data_2vda_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2vda _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.5 t80 . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.848 0.356 . . . . 10.0 110.191 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 114.52 137.27 6.42 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 121.102 -0.57 . . . . 10.0 111.853 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.88 128.2 20.51 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.028 0.442 . . . . 10.0 111.223 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.479 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 1.2 mmp_? -63.19 142.76 58.26 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.668 -0.696 . . . . 10.0 111.492 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.428 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 0.9 OUTLIER 71.89 -81.99 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.302 -0.863 . . . . 10.0 112.232 179.129 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -49.65 -66.16 0.44 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.92 0.711 . . . . 10.0 112.92 -178.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 19' ' ' ARG . 7.8 ttm105 -71.02 -27.63 63.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.679 0.276 . . . . 10.0 111.454 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.9 m -61.88 -38.08 86.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.371 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 14' ' ' ASN . 90.1 mt -59.55 -49.83 76.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.678 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 16' ' ' ARG . 26.8 ptt-85 -75.62 -29.34 59.17 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.813 -0.355 . . . . 10.0 111.383 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -63.93 -40.68 97.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.094 0.473 . . . . 10.0 109.736 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.437 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -68.49 -35.46 77.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.124 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.7 tpp180 -61.26 -35.62 77.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.617 -0.72 . . . . 10.0 110.783 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.89 -40.82 85.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.654 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.0 t -74.78 -39.81 46.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.448 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.8 t -57.57 -37.92 61.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.658 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -62.64 -44.73 95.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.498 . . . . 10.0 110.206 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.1 mt -60.77 -45.11 98.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.345 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 61.9 mt -59.56 -43.16 90.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.513 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -66.68 -33.18 75.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.488 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.488 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -76.81 -34.11 57.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.155 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 16.4 ttt -83.18 -9.66 59.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.361 -0.382 . . . . 10.0 111.295 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.422 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 19.3 tt0 -58.72 -51.74 79.67 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-O 119.39 -0.338 . . . . 10.0 111.885 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.488 ' HD2' ' O ' ' A' ' 30' ' ' ALA . 60.3 Cg_exo -53.87 -33.37 71.3 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.082 1.854 . . . . 10.0 111.772 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -71.37 -39.54 71.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.275 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 20.0 mmt -65.73 -33.59 76.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.621 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -66.5 -14.02 61.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.057 0.456 . . . . 10.0 110.813 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -94.81 -8.09 38.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.362 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.9 mp -88.45 142.0 28.07 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.675 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 p -75.15 167.07 22.62 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.725 0.297 . . . . 10.0 110.529 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.83 -42.98 90.52 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.384 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.402 ' CD ' ' HZ3' ' A' ' 44' ' ' LYS . 52.5 mm-40 -69.8 -19.7 63.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.507 -0.315 . . . . 10.0 111.423 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -75.43 -36.76 60.72 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 110.293 -0.262 . . . . 10.0 110.293 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.7 mt -61.79 -41.41 97.7 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.402 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 35.2 ttmt -64.74 -35.11 80.01 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.58 -1.191 . . . . 10.0 109.416 178.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.63 -28.83 70.36 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.341 -0.845 . . . . 10.0 112.295 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -71.83 -37.19 70.36 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 33.1 m -60.87 -45.25 95.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 10.0 109.959 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.62 -33.09 73.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.011 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -63.34 -43.62 97.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.573 -0.74 . . . . 10.0 110.304 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.7 m-30 -61.38 -37.26 82.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.284 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 9.4 tpp180 -60.54 -45.4 93.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.729 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.57 -44.3 74.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.896 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 -61.09 -37.11 81.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.279 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.0 mt -59.93 -38.04 81.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.389 -0.368 . . . . 10.0 111.077 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -86.56 -14.34 43.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.066 0.46 . . . . 10.0 110.706 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -77.69 -52.57 8.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.71 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 157.45 45.93 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.398 -0.819 . . . . 10.0 111.594 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -117.63 139.01 51.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.706 0.289 . . . . 10.0 110.338 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 42.6 t -85.51 138.66 18.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.813 -0.439 . . . . 10.0 109.813 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.446 HD12 ' O ' ' A' ' 118' ' ' LEU . 22.6 tp -57.74 -45.0 86.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.985 0.421 . . . . 10.0 110.836 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 25.7 mp0 -64.7 -16.97 63.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.835 -0.62 . . . . 10.0 111.433 179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -91.95 -14.7 29.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.07 0.462 . . . . 10.0 110.298 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.2 mt -87.61 -8.91 55.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.144 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.463 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 69.8 mt -50.16 -50.92 66.97 Favored Pre-proline 0 CA--C 1.543 0.699 0 N-CA-C 113.387 0.884 . . . . 10.0 113.387 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.463 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.7 Cg_exo -52.05 -48.39 21.85 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 122.251 1.967 . . . . 10.0 113.199 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -77.04 -43.99 32.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.621 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.15 -51.6 69.31 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.184 0.438 . . . . 10.0 112.184 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -63.74 -32.38 73.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.661 0.267 . . . . 10.0 111.178 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.23 -43.37 91.64 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.855 -0.424 . . . . 10.0 109.855 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.9 t -62.36 -43.05 97.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.127 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 46.2 t -62.01 -44.32 98.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.565 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.413 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 9.8 ttm180 -62.02 -40.87 97.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.393 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -67.57 -52.9 33.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.267 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.72 -41.72 77.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.712 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.1 m -62.59 -31.38 72.19 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -179.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -72.46 -20.43 61.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.662 0.268 . . . . 10.0 111.195 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -100.55 -27.53 13.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.826 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 90.1 t -89.82 -51.45 12.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.688 0.28 . . . . 10.0 111.725 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -104.84 -26.88 12.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.041 0.448 . . . . 10.0 111.124 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 85.66 11.67 73.82 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.862 -0.685 . . . . 10.0 111.499 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 68.3 mtt -112.2 122.02 46.57 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.803 0.335 . . . . 10.0 110.603 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 -84.03 134.32 34.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.111 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -70.38 115.66 9.82 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -60.97 156.21 18.19 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.369 0.418 . . . . 10.0 111.254 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -60.12 -37.14 79.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.144 -179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.3 m -65.13 -32.28 57.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.902 0.382 . . . . 10.0 110.57 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -73.77 -33.54 64.3 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.079 -0.509 . . . . 10.0 109.74 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.56 -39.03 92.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.57 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.8 mt -62.2 -53.05 60.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.198 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.76 -45.95 95.18 Favored Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 115.745 -0.661 . . . . 10.0 112.444 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.22 -32.49 82.78 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.284 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.437 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 25.9 ttm -71.88 -38.95 69.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.826 0.346 . . . . 10.0 110.343 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 90.7 t -67.6 -30.96 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.398 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.0 mt -69.2 -3.67 14.57 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.675 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -83.26 -20.85 33.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.527 0.68 . . . . 10.0 109.369 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -93.39 -162.92 0.98 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.538 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.7 ttt180 -107.38 58.64 0.62 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.56 -0.904 . . . . 10.0 108.56 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 3.1 m -130.58 164.52 24.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.295 -0.866 . . . . 10.0 111.224 -178.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.4 mm -109.88 127.36 66.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.692 -0.685 . . . . 10.0 109.24 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.83 127.94 53.84 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.995 0.369 . . . . 10.0 111.995 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -82.07 124.49 29.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.64 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 19.0 ttm -120.03 124.32 45.59 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.76 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.574 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 8.8 mmm180 -70.24 152.33 44.34 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.675 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.05 106.12 1.53 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.788 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 124.74 -18.96 7.08 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.618 -0.801 . . . . 10.0 113.884 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.642 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 10.2 mm-40 -58.82 -41.47 86.92 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 117.112 0.456 . . . . 10.0 112.095 -178.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.48 85.87 1.28 Allowed Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.523 -0.846 . . . . 10.0 112.324 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -65.43 -47.76 75.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.7 0.286 . . . . 10.0 111.551 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 55.7 m -63.55 -29.27 70.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.914 0.387 . . . . 10.0 111.559 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.2 tp -87.4 6.92 31.39 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.956 0.408 . . . . 10.0 111.154 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 40.8 m -120.83 -43.09 2.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.877 0.37 . . . . 10.0 110.597 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.67 -15.63 63.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.405 0.521 . . . . 10.0 112.405 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.6 -21.83 61.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.821 0.343 . . . . 10.0 111.921 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 11.6 mt -74.43 -57.57 2.09 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.58 -28.22 69.82 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 122.005 1.803 . . . . 10.0 112.156 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -64.96 -50.28 67.02 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.505 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -61.87 -44.37 96.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.952 0.405 . . . . 10.0 110.797 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.446 ' O ' HD12 ' A' ' 60' ' ' LEU . 49.6 tp -59.47 -54.31 48.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.83 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -71.0 -22.8 62.12 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.024 -0.27 . . . . 10.0 111.629 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.485 ' HB3' ' HB3' ' A' ' 173' ' ' ASP . . . -67.43 -27.71 67.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.817 0.342 . . . . 10.0 111.121 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 73.7 mt -60.17 -25.16 65.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.605 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.3 p -71.66 -20.46 61.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.018 0.437 . . . . 10.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.47 6.39 76.0 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.161 -0.542 . . . . 10.0 112.986 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 46.2 mmtt -79.2 -24.22 43.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.921 0.36 . . . . 10.0 110.778 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 106.05 117.01 4.24 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.629 -0.796 . . . . 10.0 113.559 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 74.1 t -87.82 115.05 27.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.1 m170 -94.03 101.39 13.43 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.084 0.468 . . . . 10.0 111.17 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 40.7 t -89.94 122.75 41.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.924 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.2 t -101.84 119.98 50.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.669 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.05 158.0 18.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.674 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.4 m -72.3 -31.12 37.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.977 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -145.79 172.04 13.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.584 0.231 . . . . 10.0 110.922 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -73.96 -26.81 60.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.198 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -58.67 -58.68 7.52 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.665 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.28 -35.6 80.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.912 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.58 -50.07 74.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.107 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.64 -25.3 49.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.879 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -66.22 -60.29 2.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.754 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.58 -29.63 69.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.057 -0.519 . . . . 10.0 111.475 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.52 -49.77 76.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.82 0.343 . . . . 10.0 111.237 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -79.36 -27.86 41.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.151 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . 0.409 ' O ' ' HD2' ' A' ' 145' ' ' PRO . 8.2 t30 -71.55 -45.42 62.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.298 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -86.68 -3.26 59.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.209 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.481 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 59.6 ttm-85 -59.81 -50.08 88.42 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 24.5 Cg_exo -64.56 -5.22 9.7 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 122.201 1.934 . . . . 10.0 112.701 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 23.9 tp -96.7 -54.65 3.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.955 0.407 . . . . 10.0 110.224 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -67.81 -44.34 77.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.265 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.457 ' HA ' ' O ' ' A' ' 152' ' ' LEU . 3.7 mt-10 -70.69 -16.7 62.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.918 0.389 . . . . 10.0 111.135 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.445 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 73.3 t80 -73.03 -27.43 61.76 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.422 0.629 . . . . 10.0 109.588 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 30.5 mt -95.55 -8.03 36.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.206 -0.907 . . . . 10.0 110.94 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 112.96 -14.85 23.8 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.559 -0.829 . . . . 10.0 113.454 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 148' ' ' GLU . 85.3 mt -71.41 156.27 39.67 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.951 0.405 . . . . 10.0 111.021 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 16.2 p -107.51 136.41 47.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.336 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 45.1 t -110.27 122.4 64.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.135 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -117.31 139.34 14.91 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 121.119 -0.562 . . . . 10.0 112.002 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 5.5 tp -112.89 130.45 66.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.05 0.452 . . . . 10.0 110.688 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -115.57 107.35 15.03 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.003 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 94.0 mt -102.36 145.44 30.52 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.495 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' PRO . . . . . 0.414 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 19.7 Cg_endo -59.02 113.94 1.79 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.612 2.208 . . . . 10.0 112.049 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 105.81 0.45 39.35 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.801 -0.714 . . . . 10.0 112.433 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' MET . . . . . 0.586 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 39.4 ttm -66.22 137.87 95.79 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 110.396 -0.224 . . . . 10.0 110.396 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.97 152.38 71.43 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.491 2.128 . . . . 10.0 112.371 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -53.45 -47.39 96.45 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.862 0.69 . . . . 10.0 112.862 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.26 -49.42 17.46 Favored 'Trans proline' 0 C--N 1.361 1.218 0 C-N-CA 121.831 1.687 . . . . 10.0 112.645 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.59 -38.06 86.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.088 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.586 ' HE2' ' O ' ' A' ' 161' ' ' MET . 59.1 mttm -59.92 -45.09 93.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.48 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -59.62 -35.32 74.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.845 -0.616 . . . . 10.0 111.124 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -70.15 -39.0 75.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.052 0.453 . . . . 10.0 110.422 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -73.6 -38.43 65.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.74 -0.663 . . . . 10.0 111.551 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -74.9 -25.2 58.76 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.524 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -84.34 -1.84 56.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.114 0.483 . . . . 10.0 110.712 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -79.9 168.35 19.35 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.45 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . 0.485 ' HB3' ' HB3' ' A' ' 120' ' ' ALA . 18.3 m-20 -71.04 -40.59 71.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.16 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.2 mp -127.01 127.23 69.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.168 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 5.2 m -117.33 125.37 50.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.884 0.373 . . . . 10.0 111.244 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -103.28 129.57 50.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -165.95 172.15 41.27 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.103 -1.046 . . . . 10.0 113.171 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.95 151.84 19.69 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.466 -0.198 . . . . 10.0 110.466 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -61.57 -36.42 80.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.755 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -58.26 -54.91 41.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.255 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . 0.414 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.7 tp10 -67.72 -35.71 79.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.959 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -55.03 -40.99 70.8 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.385 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -74.68 -40.97 36.32 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.008 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -63.92 -39.28 93.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.75 0.31 . . . . 10.0 110.573 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 185' ' ' ASP . . . . . 0.437 ' CG ' ' HZ3' ' A' ' 166' ' ' LYS . 19.6 m-20 -60.86 -41.98 96.97 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.98 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -62.73 -39.62 94.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.197 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 75.3 mt -66.86 -45.95 76.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.883 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 68.5 mtm-85 -63.82 -38.54 91.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.888 0.375 . . . . 10.0 110.969 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -64.45 -46.39 83.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.616 -0.72 . . . . 10.0 111.087 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -73.24 -20.98 60.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.622 -0.717 . . . . 10.0 112.064 -178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 22.9 ttp -99.87 26.57 6.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.112 0.482 . . . . 10.0 110.9 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -87.89 161.53 17.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.537 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -102.56 -29.06 11.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.083 0.468 . . . . 10.0 110.484 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.09 140.56 31.24 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.02 -26.28 81.98 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.693 2.262 . . . . 10.0 112.638 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -75.62 -11.09 59.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.542 -0.299 . . . . 10.0 111.305 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.78 -13.81 58.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.629 -0.26 . . . . 10.0 110.672 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 198' ' ' ARG . . . . . 0.444 HH11 ' HD2' ' A' ' 198' ' ' ARG . 35.1 mtt180 -53.45 155.23 3.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.951 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 14.7 m -130.93 -20.81 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.374 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -89.31 -179.09 5.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.753 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -133.44 -79.87 0.48 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.534 -0.303 . . . . 10.0 110.974 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 19.5 ttmm -151.93 142.27 22.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.8 0.334 . . . . 10.0 110.562 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 9.9 mt -93.04 60.41 3.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.343 0.592 . . . . 10.0 109.752 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -81.01 -56.71 3.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.623 -0.717 . . . . 10.0 112.285 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -132.69 137.36 46.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.033 0.445 . . . . 10.0 111.623 -178.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.472 ' HB3' ' CD1' ' A' ' 384' ' ' TYR . . . -134.01 129.43 36.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.427 -0.806 . . . . 10.0 109.741 178.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 55.0 tp -124.07 108.49 12.4 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.176 -0.465 . . . . 10.0 109.808 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -96.82 132.1 42.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.184 0.516 . . . . 10.0 111.254 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -60.98 -53.84 52.29 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.368 -0.833 . . . . 10.0 112.352 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 210' ' ' GLU . . . . . 0.531 ' HB2' HH21 ' A' ' 509' ' ' ARG . 34.4 tt0 -123.97 108.3 12.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.005 0.431 . . . . 10.0 111.027 -179.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.47 -21.11 8.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.6 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.77 -34.56 59.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.703 -0.68 . . . . 10.0 111.379 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 8.9 p -107.2 -57.16 2.11 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.923 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.66 -37.91 68.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 113.485 0.92 . . . . 10.0 113.485 -177.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 10.9 mt -94.19 -28.79 15.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.773 0.657 . . . . 10.0 112.773 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 40.3 mm -92.1 -63.05 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 112.406 0.521 . . . . 10.0 112.406 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -69.65 -47.47 63.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.857 0.317 . . . . 10.0 111.857 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 218' ' ' GLU . . . . . 0.428 ' HA ' ' OG1' ' A' ' 221' ' ' THR . 6.1 mm-40 -80.3 12.31 3.02 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.682 0.623 . . . . 10.0 112.682 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.92 -42.83 97.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.773 0.32 . . . . 10.0 111.515 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 7.1 mtp-105 -102.39 28.24 6.11 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 221' ' ' THR . . . . . 0.428 ' OG1' ' HA ' ' A' ' 218' ' ' GLU . 4.5 m -96.44 110.29 52.0 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 120.712 0.291 . . . . 10.0 110.232 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -90.54 125.53 1.15 Allowed 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.901 2.401 . . . . 10.0 112.795 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 223' ' ' LEU . . . . . 0.598 ' O ' ' HA ' ' A' ' 374' ' ' SER . 80.8 mt -78.79 90.65 4.67 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.343 -0.614 . . . . 10.0 109.343 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 90.1 mt -88.95 117.49 32.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.801 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 58.7 mt . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 177.9 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.342 0 N-CA-C 108.136 -1.061 . . . . 10.0 108.136 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 374' ' ' SER . . . . . 0.598 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 24.3 m -152.4 148.16 27.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.051 0.453 . . . . 10.0 111.769 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 16.7 tt -155.41 139.53 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.504 -0.771 . . . . 10.0 109.977 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.1 143.98 26.76 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -57.21 -41.37 79.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.672 0.272 . . . . 10.0 110.983 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 378' ' ' GLN . . . . . 0.415 ' HA ' ' CE1' ' A' ' 405' ' ' TYR . 1.5 tm0? -59.89 -39.92 86.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.174 0.511 . . . . 10.0 110.359 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -81.71 -0.85 44.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.311 -179.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -102.59 -48.04 4.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.173 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -71.04 -21.58 62.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.123 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -72.43 -12.17 60.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.882 0.372 . . . . 10.0 110.999 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 42.7 mt -84.91 -18.38 34.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.798 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . 0.472 ' CD1' ' HB3' ' A' ' 206' ' ' ALA . 39.0 m-85 -77.03 142.41 39.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.169 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -73.96 -64.31 1.04 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.95 0.405 . . . . 10.0 110.347 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -95.5 98.24 10.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.669 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 52.0 tp -107.41 110.03 21.9 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.072 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -130.21 163.99 25.49 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.206 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.35 168.89 41.97 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.422 -0.894 . . . . 10.0 112.398 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 35.9 mtm -105.75 140.01 39.44 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.211 -0.292 . . . . 10.0 110.211 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 3.4 t -124.27 156.5 36.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -91.22 174.76 38.93 Favored Glycine 0 N--CA 1.441 -0.988 0 C-N-CA 120.622 -0.799 . . . . 10.0 111.599 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 393' ' ' THR . . . . . 0.574 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 1.3 m -74.49 62.95 1.04 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.289 0.566 . . . . 10.0 110.499 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . 0.41 ' HB3' ' HG2' ' A' ' 566' ' ' ARG . . . -113.81 -43.18 3.31 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.474 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 395' ' ' ASP . . . . . 0.462 ' CG ' ' H ' ' A' ' 396' ' ' THR . 35.9 t70 59.66 -126.76 1.19 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 396' ' ' THR . . . . . 0.585 ' HB ' ' OE1' ' A' ' 397' ' ' GLU . 1.8 m 59.07 -93.78 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.77 0.428 . . . . 10.0 112.069 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 397' ' ' GLU . . . . . 0.585 ' OE1' ' HB ' ' A' ' 396' ' ' THR . 3.5 mp0 -75.77 2.28 12.59 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.943 0.401 . . . . 10.0 111.206 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -59.17 -26.09 64.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.65 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 399' ' ' PHE . . . . . 0.416 ' HD1' ' O ' ' A' ' 396' ' ' THR . 16.7 p90 -69.16 -23.06 63.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.969 0.414 . . . . 10.0 110.76 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.44 -13.38 60.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.5 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -59.37 -35.99 74.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.846 0.355 . . . . 10.0 110.558 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 402' ' ' SER . . . . . 0.476 ' O ' ' HA ' ' A' ' 406' ' ' LYS . 2.3 m -78.28 -18.23 55.58 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.656 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.2 m -100.36 -32.2 10.96 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.39 0.515 . . . . 10.0 112.39 -178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 55.4 mt -87.82 -49.58 14.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 111.736 0.273 . . . . 10.0 111.736 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 405' ' ' TYR . . . . . 0.415 ' CE1' ' HA ' ' A' ' 378' ' ' GLN . 96.6 m-85 -112.14 -5.73 14.21 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.994 -0.282 . . . . 10.0 111.654 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 406' ' ' LYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 402' ' ' SER . 3.9 mtpp 62.71 48.64 4.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.825 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 16.6 mt -109.76 152.21 25.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.071 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 408' ' ' ASP . . . . . 0.479 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 22.3 t0 -93.52 135.22 34.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.506 -0.315 . . . . 10.0 110.318 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.83 118.65 27.5 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.31 -0.405 . . . . 10.0 111.373 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.26 137.43 57.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.294 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 5.1 m -102.32 140.18 21.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.592 0.235 . . . . 10.0 110.619 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 91.2 t -108.44 131.77 21.55 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.63 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.5 152.56 80.57 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.63 2.22 . . . . 10.0 112.278 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 1.5 p -78.71 157.03 28.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.491 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -64.92 -39.27 93.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.359 0.599 . . . . 10.0 109.835 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 -124.45 157.84 63.64 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.563 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.49 122.24 10.08 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.403 2.069 . . . . 10.0 111.793 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 27.6 mtm -72.47 112.02 8.16 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.851 0.358 . . . . 10.0 111.16 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 4.0 mt -103.84 54.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.562 0.696 . . . . 10.0 109.695 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 420' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 420' ' ' ARG . 33.5 ttp180 -98.38 104.2 16.21 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.358 -0.837 . . . . 10.0 109.905 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.86 98.89 2.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.933 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 422' ' ' ASP . . . . . 0.405 ' OD2' ' HD2' ' A' ' 572' ' ' ARG . 26.4 m-20 -84.02 114.66 21.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.765 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 39.5 mt -98.41 155.73 36.53 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.468 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -66.86 176.73 4.11 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.929 2.419 . . . . 10.0 112.878 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -93.03 130.02 38.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.559 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 64.2 mt -101.19 93.64 5.56 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.01 0.433 . . . . 10.0 109.956 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 427' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 588' ' ' LEU . 61.8 t -84.31 125.1 40.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.71 -0.677 . . . . 10.0 111.003 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 428' ' ' TYR . . . . . 0.46 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 4.6 m-85 -114.45 176.73 4.92 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.85 -0.613 . . . . 10.0 109.942 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.2 mmm -78.55 -75.44 0.23 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.13 -0.228 . . . . 10.0 111.195 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 58.3 p -90.63 162.12 15.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.845 0.355 . . . . 10.0 111.353 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -61.95 -32.93 73.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.527 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 436' ' ' GLN . . . -57.32 -42.64 82.25 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.728 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -65.37 -46.94 78.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.277 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 434' ' ' LYS . . . . . 0.404 ' HE3' ' O ' ' A' ' 559' ' ' THR . 4.7 ttpt -58.95 -54.14 50.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.314 -0.857 . . . . 10.0 111.129 -179.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 40.3 mm -60.09 -45.64 95.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.388 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 432' ' ' ALA . 0.2 OUTLIER -60.96 -37.22 81.65 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.218 -179.438 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.98 -36.66 83.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.087 0.47 . . . . 10.0 109.847 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 79.9 mt -65.25 -46.48 90.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.753 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 42.1 mm -57.51 -41.16 78.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.497 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -66.24 -45.07 81.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.174 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.77 -39.14 87.68 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.13 0.491 . . . . 10.0 110.117 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 71.2 mt -70.83 -49.68 48.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.565 -0.743 . . . . 10.0 111.068 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -54.08 -42.6 69.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.791 -0.641 . . . . 10.0 112.081 -178.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.99 -34.6 78.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.303 0.573 . . . . 10.0 110.684 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.457 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 66.5 mtt-85 -82.19 -17.48 46.06 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.825 -179.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 1.8 m -69.25 -28.35 66.25 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -84.71 -23.66 29.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.656 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -87.36 -14.06 41.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.938 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 79.14 36.78 26.73 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.762 -0.733 . . . . 10.0 112.619 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 450' ' ' GLN . . . . . 0.457 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 63.7 tt0 -105.44 126.42 30.91 Favored Pre-proline 0 C--N 1.324 -0.531 0 O-C-N 122.712 -0.287 . . . . 10.0 110.542 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.87 136.17 44.12 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.535 2.157 . . . . 10.0 111.421 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 91.8 t -119.16 124.76 73.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.356 -0.384 . . . . 10.0 111.392 -178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 52.5 tp -112.21 108.25 17.42 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.965 -0.562 . . . . 10.0 109.544 178.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 12.2 t -90.92 115.27 29.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.169 -0.468 . . . . 10.0 110.418 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -96.46 79.59 0.74 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.867 -0.682 . . . . 10.0 112.294 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 6.4 p -82.43 120.43 25.45 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.386 -0.227 . . . . 10.0 110.386 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 41.9 pt -89.93 -10.28 10.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.086 0.47 . . . . 10.0 110.638 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 458' ' ' SER . . . . . 0.489 ' OG ' ' HB2' ' A' ' 461' ' ' LYS . 25.8 p -116.57 127.01 54.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.506 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 24.2 mt -62.68 -32.95 57.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-O 120.897 0.38 . . . . 10.0 111.02 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -62.88 -33.03 74.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.977 0.418 . . . . 10.0 110.568 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . 0.489 ' HB2' ' OG ' ' A' ' 458' ' ' SER . 0.0 OUTLIER -83.37 -30.66 27.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.769 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 17.5 m -59.32 -46.94 87.22 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.875 0.369 . . . . 10.0 110.697 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.74 -33.61 66.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.858 0.361 . . . . 10.0 110.376 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 46.7 tp -63.39 -53.05 58.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.69 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 8.1 p -63.56 -33.69 63.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.695 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 75.6 m -64.43 -42.22 96.15 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 120.744 0.307 . . . . 10.0 110.442 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -67.54 -40.3 85.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.13 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . 0.459 ' CD ' ' HZ2' ' A' ' 471' ' ' LYS . 8.4 mm-40 -65.57 -41.66 92.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.851 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 51.8 mt -61.75 -36.69 81.75 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.9 0.381 . . . . 10.0 110.477 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.4 m -71.01 -33.45 70.38 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.294 0.569 . . . . 10.0 109.873 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.459 ' HZ2' ' CD ' ' A' ' 468' ' ' GLU . 31.9 ttpt -66.28 -40.36 90.03 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.483 -0.781 . . . . 10.0 110.576 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.94 -21.27 37.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.584 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 89.79 52.82 2.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.709 -0.758 . . . . 10.0 112.489 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 50.0 mt -124.82 127.28 72.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.722 0.296 . . . . 10.0 110.566 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.404 ' O ' ' HB ' ' A' ' 500' ' ' VAL . 50.6 mttm -62.16 138.76 58.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.136 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 45.4 p-80 -156.88 147.54 21.56 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.882 0.372 . . . . 10.0 111.231 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -130.54 119.59 22.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.304 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.7 t -89.59 133.87 30.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.006 0.431 . . . . 10.0 111.408 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 86.4 mt -84.81 83.83 7.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.263 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -78.28 113.45 16.27 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.812 -0.44 . . . . 10.0 109.812 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -62.68 -10.11 11.42 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.897 0.703 . . . . 10.0 112.897 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -81.36 -10.17 59.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.985 0.422 . . . . 10.0 109.992 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -135.47 85.23 2.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.537 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' HIS . . . . . 0.402 ' HD2' ' OE1' ' A' ' 487' ' ' GLU . 30.8 m170 -61.57 -32.96 73.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.259 -178.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.51 -36.03 82.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.025 0.441 . . . . 10.0 110.086 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.93 -44.06 73.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.462 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.402 ' OE1' ' HD2' ' A' ' 484' ' ' HIS . 37.5 mt-10 -59.73 -47.83 84.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.433 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -60.26 -33.96 73.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.63 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -70.52 -38.56 74.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.808 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 50.8 mt -74.84 -45.68 43.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.799 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.0 t -55.36 -34.62 34.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.138 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -57.4 -31.49 65.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.542 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -124.62 26.59 7.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.734 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -69.02 -21.25 64.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.132 0.492 . . . . 10.0 110.902 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -100.08 14.12 60.04 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.771 -0.728 . . . . 10.0 111.671 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -75.52 140.44 71.94 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.208 -0.293 . . . . 10.0 110.208 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -52.59 125.98 19.54 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.689 2.26 . . . . 10.0 113.356 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 70.78 16.52 6.69 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.449 -0.796 . . . . 10.0 112.8 178.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.23 115.29 26.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.897 0.379 . . . . 10.0 110.105 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' A' ' 475' ' ' LYS . 53.8 t -96.1 108.03 20.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.247 0.546 . . . . 10.0 110.205 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 7.4 m -106.11 130.18 54.05 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.601 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 49.0 mt -109.41 119.28 58.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.2 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -109.19 130.29 55.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.87 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 7.0 m -100.72 93.58 5.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.816 0.341 . . . . 10.0 110.75 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 55.51 78.41 0.19 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.456 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 8.6 ttt -83.87 142.88 30.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.421 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -70.8 173.01 7.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.007 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -61.69 156.82 35.18 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 116.144 -0.48 . . . . 10.0 113.172 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.531 HH21 ' HB2' ' A' ' 210' ' ' GLU . 75.5 mtt180 70.77 -82.05 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.463 0.705 . . . . 10.0 111.302 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 79.73 170.65 40.72 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.53 -0.628 . . . . 10.0 111.53 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.28 148.47 49.72 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.585 0.231 . . . . 10.0 110.584 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.53 90.68 4.51 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.822 -0.436 . . . . 10.0 109.822 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 70.8 mt -70.7 114.74 9.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.692 -0.685 . . . . 10.0 111.235 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 3.9 t -89.71 133.84 30.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.663 -0.698 . . . . 10.0 110.182 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 53.7 mt -64.9 131.57 47.05 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.515 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 98.13 -17.17 59.06 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 121.079 -0.582 . . . . 10.0 111.743 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 115.66 -164.38 12.2 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.0 p -135.05 101.79 4.99 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 117.061 0.431 . . . . 10.0 110.624 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 53.3 p-90 -56.28 -28.15 57.75 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.315 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -61.0 -43.32 99.05 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.055 0.455 . . . . 10.0 110.662 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -73.09 -23.03 60.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.873 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -79.49 -47.06 16.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.042 -0.527 . . . . 10.0 110.574 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.0 m -69.4 -23.45 26.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.927 0.394 . . . . 10.0 110.848 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -78.89 -10.85 59.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.009 0.433 . . . . 10.0 110.916 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -94.25 -3.1 51.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.665 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 58.5 mt -97.19 152.28 18.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.317 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -64.64 -61.22 2.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.554 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -131.1 97.28 20.34 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 529' ' ' PRO . . . . . 0.431 ' HA ' ' OE1' ' A' ' 533' ' ' GLN . 60.7 Cg_endo -81.17 93.18 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.613 2.209 . . . . 10.0 112.057 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 17.5 p -71.04 168.84 16.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.448 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.92 -41.42 70.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.936 0.398 . . . . 10.0 111.025 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -61.01 -43.58 98.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.053 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . 0.431 ' OE1' ' HA ' ' A' ' 529' ' ' PRO . 75.0 mt-30 -65.3 -46.64 79.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.731 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 75.1 mt -58.85 -49.24 83.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.314 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -61.98 -41.88 98.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.036 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 20.1 tptp -61.08 -49.05 78.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.801 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 74.6 mt -63.79 -39.29 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.706 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 25.1 mtmt -62.11 -39.62 93.12 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.865 0.364 . . . . 10.0 110.277 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -62.92 -44.41 96.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.225 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -67.26 -41.95 84.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.115 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 70.9 t90 -60.46 -39.63 88.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.568 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -57.5 -46.03 84.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.469 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.61 -42.06 94.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.883 179.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 31.6 mtp180 -62.41 -38.54 90.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.824 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -66.77 -47.39 72.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.469 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -33.4 75.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.859 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.7 99.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.926 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 67.7 t -65.82 -35.14 74.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.386 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 84.0 mt -62.26 -43.64 98.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.315 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.18 -18.15 61.29 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.913 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -80.19 -30.49 38.76 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.398 179.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 125.82 19.14 2.29 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.571 -0.823 . . . . 10.0 112.973 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 72.21 -163.76 54.52 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.938 -0.649 . . . . 10.0 112.505 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 51.8 tp -77.91 119.68 21.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.918 0.389 . . . . 10.0 110.336 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.4 t60 -92.51 115.54 28.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.163 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 14.8 mm -98.83 132.8 43.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.929 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 557' ' ' ILE . . . . . 0.432 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.8 mt -124.21 122.72 64.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.918 0.39 . . . . 10.0 110.517 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.89 116.71 5.24 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.897 -0.668 . . . . 10.0 111.437 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 559' ' ' THR . . . . . 0.404 ' O ' ' HE3' ' A' ' 434' ' ' LYS . 19.0 p -74.37 -43.19 57.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.125 0.488 . . . . 10.0 110.656 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . 0.422 ' OE2' ' HG2' ' A' ' 461' ' ' LYS . 19.8 mp0 -136.72 145.21 44.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.631 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 88.1 mtt-85 -95.36 166.85 11.68 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.854 -0.424 . . . . 10.0 109.854 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 562' ' ' HIS . . . . . 0.423 ' CE1' HD13 ' A' ' 567' ' ' ILE . 46.2 t-80 -107.39 149.85 27.41 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -57.02 -64.98 0.7 Allowed 'General case' 0 N--CA 1.462 0.148 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.75 117.45 10.48 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 108.937 -0.764 . . . . 10.0 108.937 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 565' ' ' ARG . . . . . 0.41 ' HB3' ' OG1' ' A' ' 396' ' ' THR . 14.2 tpt180 -61.66 -14.36 30.53 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.891 -178.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 566' ' ' ARG . . . . . 0.41 ' HG2' ' HB3' ' A' ' 394' ' ' ALA . 5.4 ttm180 -55.06 -45.41 75.32 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 121.002 0.43 . . . . 10.0 110.939 179.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 567' ' ' ILE . . . . . 0.423 HD13 ' CE1' ' A' ' 562' ' ' HIS . 61.3 mt -81.1 -31.75 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.458 . . . . 10.0 110.401 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -61.41 -51.48 68.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.135 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 569' ' ' ASN . . . . . 0.519 ' HB3' ' O ' ' A' ' 393' ' ' THR . 31.3 m-20 -65.27 -28.95 69.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.634 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -62.13 -36.75 82.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.214 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 40.3 tp -76.65 -35.72 57.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.377 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 572' ' ' ARG . . . . . 0.405 ' HD2' ' OD2' ' A' ' 422' ' ' ASP . 14.4 ttp180 -69.32 -30.8 68.94 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.16 0.505 . . . . 10.0 110.497 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -85.37 13.82 53.4 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 121.035 -0.602 . . . . 10.0 113.76 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 -75.46 -32.38 60.6 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 117.231 0.515 . . . . 10.0 110.279 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 4.7 t -91.03 166.63 12.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.471 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 67.16 54.02 23.01 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.724 -0.75 . . . . 10.0 112.571 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 15.2 mmt180 -69.02 117.23 10.41 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 578' ' ' GLN . . . . . 0.642 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 3.5 tt0 61.45 26.79 16.49 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.968 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 86.4 55.97 2.36 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.867 -0.683 . . . . 10.0 112.679 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -108.36 -169.3 1.48 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.94 -0.393 . . . . 10.0 109.94 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -95.25 150.3 20.39 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.962 0.41 . . . . 10.0 111.596 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.59 -179.18 48.37 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.135 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.6 p -155.31 128.57 8.3 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.144 -0.317 . . . . 10.0 110.144 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.11 125.45 52.16 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.785 0.326 . . . . 10.0 111.147 -179.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 585' ' ' ARG . . . . . 0.432 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 2.0 tpm_? -129.69 122.51 29.11 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -113.48 149.8 33.76 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.046 0.451 . . . . 10.0 110.777 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -129.0 162.06 28.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.988 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 588' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 427' ' ' VAL . 44.6 tp -162.51 149.41 13.32 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.104 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 92.5 p -123.3 169.94 10.8 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.808 -0.442 . . . . 10.0 109.808 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 590' ' ' MET . . . . . 0.438 ' SD ' ' HE2' ' A' ' 595' ' ' MET . 71.4 mmm -83.61 0.22 47.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.144 0.497 . . . . 10.0 110.075 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -100.91 -17.37 16.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.005 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -70.71 147.48 49.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.13 0.49 . . . . 10.0 111.451 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -65.12 -15.88 62.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.558 -0.746 . . . . 10.0 112.735 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 14.5 tp -64.81 -23.15 67.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.703 0.287 . . . . 10.0 111.406 -179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.438 ' HE2' ' SD ' ' A' ' 590' ' ' MET . 7.0 mmt -75.49 -2.42 28.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.725 0.298 . . . . 10.0 111.442 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -95.17 -7.66 38.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.514 -0.312 . . . . 10.0 111.37 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 20.2 pt -79.51 -13.09 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-O 120.945 0.402 . . . . 10.0 111.298 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -84.75 50.48 1.92 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.409 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 70.6 -55.83 0.62 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.812 0.845 . . . . 10.0 111.167 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 59.4 m -155.0 137.74 15.27 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -62.88 -17.2 61.28 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 602' ' ' ARG . . . . . 0.421 ' HD2' ' O ' ' A' ' 602' ' ' ARG . 1.8 tmm_? -64.32 -35.46 80.93 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 48.5 t -71.2 -46.37 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.91 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -20.03 63.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.522 -0.763 . . . . 10.0 111.213 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -62.93 -15.08 55.15 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 116.018 -0.537 . . . . 10.0 113.088 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 46.2 tpp -67.37 -21.56 65.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.095 0.474 . . . . 10.0 110.431 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 66.6 mtt -78.32 -11.24 59.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.569 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 59.8 mtt-85 -69.17 -17.64 63.83 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.089 0.471 . . . . 10.0 110.298 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -102.74 28.37 6.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.766 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 22.6 tp -88.17 -14.59 38.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.23 0.538 . . . . 10.0 110.099 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 111.26 -48.07 0.98 Allowed Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.803 -0.635 . . . . 10.0 112.193 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 66.98 -77.54 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.368 0.667 . . . . 10.0 111.836 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 59.86 83.98 0.2 Allowed Pre-proline 0 N--CA 1.464 0.229 0 O-C-N 123.613 0.571 . . . . 10.0 110.992 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 614' ' ' PRO . . . . . 0.46 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 31.8 Cg_exo -58.13 105.03 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.833 2.355 . . . . 10.0 112.278 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 125.0 -14.68 7.46 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 121.023 -0.608 . . . . 10.0 111.71 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -110.57 129.56 55.77 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.061 -0.348 . . . . 10.0 110.061 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -83.3 100.65 10.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.542 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 4.7 tp -66.93 -28.53 43.3 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.758 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 619' ' ' GLU . . . . . 0.427 ' HA ' ' OE1' ' A' ' 619' ' ' GLU . 13.9 mm-40 40.01 82.64 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.611 0.967 . . . . 10.0 113.611 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 40.8 m170 -119.71 100.57 48.94 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -57.48 -30.17 87.3 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 123.368 2.712 . . . . 10.0 113.752 -178.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 65.9 p-90 -63.59 -22.08 66.7 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 121.12 -0.232 . . . . 10.0 111.583 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 70.1 t -66.84 -48.7 79.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 109.704 -0.48 . . . . 10.0 109.704 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 43.8 m -60.56 -40.39 91.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.38 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -67.13 -32.34 73.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.661 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -70.8 -43.81 67.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.959 0.409 . . . . 10.0 110.126 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.67 -45.25 92.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.289 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.36 -34.9 74.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.808 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -65.21 -48.8 72.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.817 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -65.99 -36.87 84.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.832 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -58.11 -44.93 87.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.066 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -74.05 -25.46 59.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.294 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -68.62 -37.13 79.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.32 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 88.5 t -57.46 -48.06 83.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 109.786 -0.45 . . . . 10.0 109.786 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -70.18 -28.18 65.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.818 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.8 m -63.48 -35.25 79.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.181 -0.674 . . . . 10.0 109.181 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -70.25 -40.96 74.11 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.359 -0.837 . . . . 10.0 109.084 178.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -66.77 -35.6 80.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.257 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -58.13 -43.88 87.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.093 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.22 -40.63 90.84 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 641' ' ' ILE . . . . . 0.432 ' O ' ' HG ' ' A' ' 645' ' ' LEU . 61.3 mt -67.77 -46.22 82.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.3 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 64.8 mtm-85 -58.16 -42.79 86.73 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.038 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -61.65 -45.52 93.68 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.73 179.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -60.9 -39.74 90.43 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.862 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 641' ' ' ILE . 85.0 mt -71.03 -40.45 71.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.675 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 646' ' ' LEU . . . . . 0.424 ' HA ' ' HB2' ' A' ' 649' ' ' ASP . 82.4 mt -67.46 -24.43 65.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.578 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.33 -44.68 88.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.043 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -77.63 -31.17 52.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.333 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 649' ' ' ASP . . . . . 0.424 ' HB2' ' HA ' ' A' ' 646' ' ' LEU . 88.1 m-20 -65.9 -45.43 82.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.428 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 650' ' ' ASP . . . . . 0.43 ' HA ' ' HB3' ' A' ' 653' ' ' ASN . 15.9 t70 -63.46 -28.75 70.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.51 -0.313 . . . . 10.0 111.469 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 53.7 t -61.25 -50.46 80.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.444 -0.576 . . . . 10.0 109.444 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -70.48 -27.61 64.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.991 179.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 653' ' ' ASN . . . . . 0.43 ' HB3' ' HA ' ' A' ' 650' ' ' ASP . 20.5 t30 -63.13 -52.14 63.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.395 -0.821 . . . . 10.0 111.11 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -62.03 -44.56 96.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.808 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -60.73 -42.1 96.63 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.871 0.367 . . . . 10.0 110.083 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 6.6 ttp-105 -63.75 -45.99 87.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.02 178.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -60.09 -43.16 95.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.694 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.71 -53.84 44.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.719 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.8 tp -65.31 -32.17 57.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-O 120.655 0.264 . . . . 10.0 111.419 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -69.78 -32.41 70.89 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 110.39 -0.226 . . . . 10.0 110.39 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 49.1 m -65.62 -46.29 79.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -63.77 -43.78 95.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.371 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 28.3 ttt-85 -63.26 -36.73 84.63 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.521 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -66.1 -40.71 90.98 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.776 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -60.67 -49.74 76.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.054 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 61.7 mt -67.32 -17.19 64.66 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.066 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 44.2 tp -83.18 -44.13 15.38 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.385 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -71.63 -47.96 51.09 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 20.0 m -68.59 149.36 11.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.073 0.463 . . . . 10.0 111.566 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -42.54 9.92 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.917 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -94.99 140.86 29.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.386 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 8.6 p -135.2 11.8 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.918 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 8.1 m -55.18 -38.61 68.57 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.587 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -59.17 -51.74 68.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 10.0 111.219 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.99 -46.12 86.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.051 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 676' ' ' ILE . . . . . 0.401 ' O ' ' HB2' ' A' ' 680' ' ' ARG . 34.0 mm -58.47 -44.2 88.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.874 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -72.52 -40.5 66.76 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.949 -0.3 . . . . 10.0 111.613 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 60.6 m -61.92 -39.43 92.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.659 -0.246 . . . . 10.0 111.464 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 45.9 pt -83.49 -21.07 8.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 120.835 -0.346 . . . . 10.0 111.011 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 680' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 676' ' ' ILE . 30.3 ttm-85 -59.66 -51.13 71.11 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.917 0.389 . . . . 10.0 110.702 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -63.76 -36.38 83.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.057 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -66.95 -46.5 74.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.836 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 72.1 t -60.09 -45.1 96.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.361 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -62.98 -45.55 91.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.308 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 34.3 tttm -58.81 -49.2 78.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.694 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -60.4 -41.04 93.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.402 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 25.6 m -67.87 -40.08 83.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.39 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 92.1 mt -68.61 -43.4 83.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.213 -0.448 . . . . 10.0 110.377 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -60.92 -19.09 60.1 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.866 0.365 . . . . 10.0 111.721 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -79.59 -21.06 45.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.736 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -117.4 -29.28 5.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.995 0.426 . . . . 10.0 110.995 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 55.6 mt -124.79 106.16 29.4 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.386 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -72.72 138.74 29.61 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.701 2.267 . . . . 10.0 111.389 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 694' ' ' PRO . . . . . 0.447 ' HA ' ' OE1' ' A' ' 732' ' ' GLU . 37.4 Cg_endo -67.21 131.37 24.9 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.344 2.029 . . . . 10.0 112.891 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 64.11 41.33 6.37 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.708 -0.678 . . . . 10.0 112.03 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 40.4 p -107.86 -150.98 0.46 Allowed 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 96.8 mt -113.55 158.71 20.42 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.174 -0.306 . . . . 10.0 110.174 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -58.99 -36.73 75.39 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.237 0.458 . . . . 10.0 112.237 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -78.29 1.39 21.89 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.032 0.444 . . . . 10.0 111.294 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 60.9 mtt -104.38 7.05 35.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.145 0.498 . . . . 10.0 110.071 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 701' ' ' TRP . . . . . . . . . . . . . 48.7 m0 -104.5 121.49 43.58 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.437 -178.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -86.05 82.74 7.98 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 703' ' ' ILE . . . . . 0.46 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 39.2 mm -61.74 -48.99 88.22 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.34 -0.846 . . . . 10.0 112.009 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 704' ' ' PRO . . . . . 0.46 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 42.9 Cg_exo -58.15 -43.69 45.47 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.008 1.805 . . . . 10.0 112.425 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -62.82 -42.93 99.59 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.954 -0.641 . . . . 10.0 112.299 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 35.2 tp -69.16 -42.49 75.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.659 0.266 . . . . 10.0 110.472 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -60.97 -44.91 96.64 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.706 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.83 -41.86 99.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.785 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -64.16 -41.98 96.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.888 0.375 . . . . 10.0 110.567 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 89.9 mt -62.64 -38.96 92.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.237 0.541 . . . . 10.0 110.011 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 21.1 mtpp -86.49 13.13 8.87 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.588 -0.733 . . . . 10.0 111.349 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -125.8 -51.95 1.57 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.767 0.318 . . . . 10.0 111.511 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -98.03 -23.64 15.68 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.353 0.871 . . . . 10.0 113.353 -177.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -108.63 -6.46 15.99 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.363 -0.535 . . . . 10.0 112.204 -178.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 39.1 t70 57.01 32.92 22.51 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.596 0.713 . . . . 10.0 110.7 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 12.5 tp -120.69 117.65 28.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.171 0.51 . . . . 10.0 111.06 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -90.96 99.24 12.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.459 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 77.7 mt -121.97 123.06 27.46 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.832 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -85.16 73.69 4.09 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.816 2.344 . . . . 10.0 111.653 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 46.7 mt -57.81 -37.67 61.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.115 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -62.34 -29.69 70.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.799 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -81.67 -37.61 27.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.003 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 42.5 m0 -60.92 -56.72 17.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.645 -0.707 . . . . 10.0 111.233 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 18.2 tp -65.07 -24.44 67.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.041 0.448 . . . . 10.0 111.244 -179.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -66.81 -39.93 87.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.042 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 726' ' ' LYS . . . . . 0.429 ' O ' ' HD3' ' A' ' 728' ' ' PRO . 8.8 mttp -99.84 -29.51 12.56 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.446 0.536 . . . . 10.0 112.446 -178.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -114.97 87.41 15.15 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 120.719 0.295 . . . . 10.0 111.049 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . 0.497 ' HD2' ' OE1' ' A' ' 729' ' ' GLU . 10.6 Cg_exo -72.27 -22.23 22.31 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.683 2.255 . . . . 10.0 112.346 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . 0.497 ' OE1' ' HD2' ' A' ' 728' ' ' PRO . 4.0 mp0 -74.59 1.95 10.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.75 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 16.4 mt -66.12 -27.34 67.97 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 731' ' ' HIS . . . . . 0.406 ' HB3' ' H ' ' A' ' 732' ' ' GLU . 5.4 t-80 56.42 -101.41 0.13 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.801 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 732' ' ' GLU . . . . . 0.447 ' OE1' ' HA ' ' A' ' 694' ' ' PRO . 8.4 tt0 -148.99 -54.31 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.924 -0.31 . . . . 10.0 111.428 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.78 -50.51 73.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.454 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.59 -35.61 74.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.559 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 4.5 tt -65.0 -43.47 92.44 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.164 -0.471 . . . . 10.0 109.898 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -62.67 -46.75 86.72 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.115 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -63.13 -38.1 89.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.198 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 21.9 mmm-85 -57.47 -49.83 75.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.853 0.359 . . . . 10.0 110.089 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 79.8 mt -57.31 -46.34 85.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.218 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 53.6 tp -62.0 -47.2 85.86 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.11 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -59.44 -46.71 87.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.382 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.9 -35.73 77.42 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.199 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 20.4 m -66.66 -44.84 80.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.435 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 73.1 mt -64.49 -37.65 80.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.458 . . . . 10.0 110.614 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.47 -55.66 25.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.363 -0.381 . . . . 10.0 110.611 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 85.0 t -62.23 -35.47 69.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.758 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -58.67 -49.48 77.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.463 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 748' ' ' GLN . . . . . 0.58 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 44.0 mt-30 -64.52 -35.99 82.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.493 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 64.8 mtp180 -64.68 -36.77 85.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.147 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -71.08 -37.72 72.45 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.45 -45.43 91.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.877 -1.056 . . . . 10.0 112.269 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 752' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 56.2 mt-10 -58.61 -28.7 65.86 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -178.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 17.8 t -78.74 -32.6 15.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.992 0.425 . . . . 10.0 111.147 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.9 t -86.59 -46.04 16.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.082 0.468 . . . . 10.0 110.946 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 130.78 137.78 4.17 Favored Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 111.137 -0.785 . . . . 10.0 111.137 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 756' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -57.64 -59.26 5.47 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 27.1 mp0 -63.09 -36.03 82.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.762 0.315 . . . . 10.0 111.032 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 17.5 tpt -65.85 -43.86 87.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.82 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 40.3 mmm -63.03 -42.51 99.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.516 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.7 mmp_? -60.12 -39.25 85.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.249 0.547 . . . . 10.0 109.834 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -69.45 -38.11 77.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.711 178.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -64.07 -49.96 70.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.158 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -59.08 -46.12 89.1 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.213 -0.448 . . . . 10.0 110.31 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -57.44 -46.2 83.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.24 178.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -66.68 -46.04 79.19 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.832 -0.622 . . . . 10.0 112.351 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 61.6 t -59.66 -42.01 87.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.408 0.147 . . . . 10.0 110.822 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 22.7 mtp -59.94 -48.82 80.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.726 0.298 . . . . 10.0 110.427 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.99 -43.3 96.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.644 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -62.5 -48.3 80.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.312 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 8.4 m -63.0 -40.17 96.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.85 0.357 . . . . 10.0 110.292 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.6 tt -61.61 -46.92 87.78 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.433 -0.581 . . . . 10.0 109.433 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 772' ' ' ASP . . . . . 0.586 ' O ' ' HG2' ' A' ' 776' ' ' LYS . 0.3 OUTLIER -63.99 -43.6 95.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.796 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 42.1 m -55.86 -45.98 78.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.896 0.379 . . . . 10.0 110.844 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.24 -24.96 59.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.723 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -67.62 -38.84 84.48 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.996 -0.372 . . . . 10.0 109.996 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.586 ' HG2' ' O ' ' A' ' 772' ' ' ASP . 3.8 mmtt -62.38 -40.84 97.79 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 108.816 -0.809 . . . . 10.0 108.816 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -63.4 -53.29 54.65 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.912 -1.04 . . . . 10.0 109.374 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 778' ' ' HIS . . . . . 0.53 ' O ' ' HG2' ' A' ' 782' ' ' MET . 16.0 t60 -54.77 -37.27 65.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.31 -0.859 . . . . 10.0 111.86 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.16 -44.31 97.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.999 0.428 . . . . 10.0 110.361 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -75.43 -38.14 59.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.433 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.97 -42.06 93.33 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.9 -0.591 . . . . 10.0 111.281 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 782' ' ' MET . . . . . 0.53 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 97.5 mmm -60.0 -37.67 80.38 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.171 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 783' ' ' ASP . . . . . 0.402 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 9.1 t70 -71.79 -45.82 60.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.421 179.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -54.48 -42.52 70.82 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.531 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 21.9 tp -78.93 -30.97 44.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.858 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -58.5 -45.15 89.36 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.956 0.407 . . . . 10.0 110.984 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 787' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 6.9 pt20 . . . . . 0 C--N 1.322 -0.598 0 C-N-CA 120.749 -0.38 . . . . 10.0 110.627 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo . . . . . 0 CA--C 1.529 0.239 0 N-CA-C 113.807 0.657 . . . . 10.0 113.807 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 25.7 mtmm -82.45 -45.48 14.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.001 0.429 . . . . 10.0 109.95 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -62.95 -44.19 96.74 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.695 -0.684 . . . . 10.0 111.418 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -65.66 -36.55 83.99 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -61.36 -47.52 85.48 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.003 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -58.3 -40.46 82.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.114 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -60.39 -53.5 56.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.33 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -60.77 -37.49 82.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.692 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 28.4 m -65.97 -36.77 84.23 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.904 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -67.37 -41.46 85.03 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 6.6 m -65.47 -38.25 89.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.204 0.526 . . . . 10.0 109.827 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 32.7 ttm -63.52 -41.85 98.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.327 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -65.83 -42.49 90.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.57 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.42 -46.53 89.73 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.008 0.432 . . . . 10.0 110.32 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.75 85.03 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.463 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 22.4 ttp -63.61 -40.72 97.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.098 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.5 -40.59 95.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.523 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -65.05 -40.88 95.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.149 0.5 . . . . 10.0 110.173 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 14.4 m -68.93 -30.84 69.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.256 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 61.5 tp -63.55 -57.43 10.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.608 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt -61.13 -34.52 75.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.691 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -60.45 -61.44 2.6 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.582 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.79 -31.57 72.29 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.554 0.576 . . . . 10.0 112.554 -178.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 822' ' ' VAL . . . . . 0.43 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 14.6 t -60.22 -54.58 32.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.851 -0.34 . . . . 10.0 110.282 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 34.3 mm -66.6 -40.63 86.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.934 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 50.7 m -60.65 -50.9 71.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.005 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 93.3 m -59.6 -38.72 82.0 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.749 0.309 . . . . 10.0 111.593 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 826' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 94.6 mt -66.65 -18.27 65.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.823 0.344 . . . . 10.0 111.347 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 5.4 m -102.51 -34.1 9.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.913 0.387 . . . . 10.0 110.309 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -63.35 -23.89 67.61 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.624 -0.717 . . . . 10.0 111.722 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.82 122.33 4.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 121.586 0.708 . . . . 10.0 111.323 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -86.38 93.13 9.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.549 -0.751 . . . . 10.0 110.161 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 62.1 t . . . . . 0 C--N 1.319 -0.743 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.606 179.664 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 74.0 t80 . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 120.887 0.375 . . . . 10.0 110.84 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 136.62 150.0 5.76 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.908 -0.663 . . . . 10.0 112.444 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.404 ' O ' ' HB3' ' A' ' 16' ' ' ARG . 6.0 m -63.31 148.16 49.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.906 0.384 . . . . 10.0 110.421 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.648 ' HD2' ' OD1' ' A' ' 408' ' ' ASP . 2.3 mmp_? -66.94 143.9 56.55 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.53 0.567 . . . . 10.0 112.53 -178.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.9 t30 68.33 -82.96 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 114.76 -1.109 . . . . 10.0 112.801 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -51.63 -59.64 4.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.509 0.929 . . . . 10.0 113.509 -177.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.404 ' HB3' ' O ' ' A' ' 12' ' ' SER . 8.1 tpt180 -72.13 -41.73 66.84 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.76 0.652 . . . . 10.0 112.76 -177.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.6 p -59.44 -50.55 73.51 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.9 mt -64.06 -37.88 89.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.762 0.315 . . . . 10.0 111.041 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 23.6 ttp-105 -65.62 -45.12 84.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.469 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -63.58 -41.74 98.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.124 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.416 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 52.1 mtt -65.81 -34.81 79.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.618 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -61.96 -33.4 74.23 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.012 0.434 . . . . 10.0 110.135 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -66.88 -35.61 80.42 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.33 -0.618 . . . . 10.0 109.33 179.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 56.9 t -71.87 -38.83 66.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.504 -0.771 . . . . 10.0 109.476 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.5 t -58.49 -36.18 57.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.683 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -60.66 -38.66 85.62 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.069 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.7 mt -65.72 -43.97 93.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 65.9 mt -62.65 -36.44 75.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.503 -0.772 . . . . 10.0 110.233 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -63.35 -36.27 83.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.478 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.2 -25.28 36.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.71 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 46.8 mtt -80.35 -19.05 47.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.064 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.475 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 5.8 tt0 -59.65 -55.87 41.46 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-O 119.356 -0.355 . . . . 10.0 110.973 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.475 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 27.5 Cg_exo -63.7 -19.34 67.1 Favored 'Trans proline' 0 C--N 1.359 1.09 0 C-N-CA 121.97 1.78 . . . . 10.0 111.712 179.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -74.3 -45.09 49.72 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.4 mmt -68.96 -24.02 64.21 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.357 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 96.5 mt-10 -65.06 -22.77 67.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.76 179.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.9 mttt -86.35 -6.61 58.9 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.386 0.613 . . . . 10.0 109.915 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.2 mp -98.38 141.21 31.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.383 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.8 p -74.48 170.15 16.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.241 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -60.23 -38.05 82.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.959 0.409 . . . . 10.0 110.846 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -68.12 -32.89 73.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.721 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.71 -34.34 73.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.764 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.88 -43.65 98.42 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -67.04 -32.48 73.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.093 -0.958 . . . . 10.0 109.761 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.5 -34.91 90.86 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.351 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -66.74 -36.88 83.49 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.3 m -60.78 -44.83 96.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.136 178.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.15 -33.85 76.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.284 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -65.16 -40.51 94.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.65 179.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.2 m-30 -61.01 -42.66 98.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.777 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -59.02 -43.12 91.53 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.016 0.436 . . . . 10.0 110.372 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.37 -41.37 76.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.891 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -61.44 -38.11 86.0 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.153 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 55.3 mt -63.22 -40.16 96.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.801 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -70.14 -31.96 69.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.539 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -69.65 -61.79 1.64 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.785 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 168.95 27.27 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.204 -0.998 . . . . 10.0 113.27 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -94.02 140.92 29.13 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.1 t -87.09 139.43 17.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.566 HD12 ' O ' ' A' ' 118' ' ' LEU . 20.6 tp -56.26 -40.75 74.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.967 0.413 . . . . 10.0 111.107 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -63.43 -21.55 66.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.626 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -82.31 -20.73 36.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.076 0.465 . . . . 10.0 110.358 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.6 mt -82.15 -9.32 59.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.625 -178.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 76.8 mt -49.43 -53.4 40.72 Favored Pre-proline 0 CA--C 1.542 0.645 0 N-CA-C 113.013 0.746 . . . . 10.0 113.013 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 33.5 Cg_exo -58.95 -49.83 10.4 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.963 1.776 . . . . 10.0 113.204 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -69.61 -43.8 72.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.335 -0.393 . . . . 10.0 111.955 -178.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.9 -47.56 77.36 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.002 0.371 . . . . 10.0 112.002 -178.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -61.5 -34.03 74.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.7 -0.227 . . . . 10.0 110.663 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.58 -43.98 88.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.372 179.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 95.5 t -61.59 -47.44 93.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.024 -0.534 . . . . 10.0 110.265 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 48.2 t -61.58 -42.52 94.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.442 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -59.82 -46.22 89.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.488 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -64.17 -44.25 92.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.383 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.46 -33.39 72.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.374 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.5 m -63.76 -37.11 86.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.38 179.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.6 mtmm -72.33 -12.51 61.17 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.83 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -110.89 -39.32 4.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -178.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 62.0 t -82.07 -45.09 20.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.957 0.408 . . . . 10.0 111.702 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -101.21 -27.88 12.96 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.854 0.359 . . . . 10.0 111.212 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.11 4.63 81.35 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.017 -0.611 . . . . 10.0 111.784 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 18.0 mtt -117.27 139.94 50.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.587 -0.523 . . . . 10.0 109.587 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.425 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 8.5 ttp180 -85.66 138.05 32.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.815 0.34 . . . . 10.0 110.711 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.41 114.31 5.33 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -55.56 152.52 8.98 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 123.596 0.56 . . . . 10.0 112.022 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.75 -40.17 96.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.975 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.9 m -68.29 -27.33 36.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 10.0 111.084 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -70.96 -30.29 66.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.221 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.9 mt -65.22 -36.21 83.45 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.19 -50.57 65.41 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.835 -0.621 . . . . 10.0 109.719 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.09 99.5 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.666 -0.697 . . . . 10.0 112.089 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -66.44 -32.2 81.1 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.886 -0.673 . . . . 10.0 112.079 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.416 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 13.9 ttm -71.27 -36.09 71.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.846 0.355 . . . . 10.0 110.424 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 76.5 t -65.82 -33.78 65.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.223 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.76 -2.27 22.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.702 -0.681 . . . . 10.0 112.13 -179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -80.5 -28.03 37.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.207 0.527 . . . . 10.0 109.988 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -103.73 175.43 5.48 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.167 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 43.1 ttt85 -78.49 77.83 4.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.888 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 408' ' ' ASP . 0.4 OUTLIER -152.0 159.85 43.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.099 0.476 . . . . 10.0 111.582 -179.676 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 49.9 mm -100.12 134.64 39.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.713 179.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.84 111.95 23.69 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.851 0.358 . . . . 10.0 111.287 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -86.99 117.11 25.49 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.7 mtt -111.59 177.67 4.58 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.281 0.562 . . . . 10.0 111.495 -178.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.451 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 9.2 mmm180 -108.73 142.71 38.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.312 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.63 110.0 2.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.771 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.43 ' O ' ' HG2' ' A' ' 578' ' ' GLN . . . 127.17 -23.36 5.51 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.856 -0.687 . . . . 10.0 112.535 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -75.85 -41.06 53.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.939 0.4 . . . . 10.0 110.834 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 155.27 150.38 5.56 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.971 -0.633 . . . . 10.0 111.63 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -121.55 -80.43 0.62 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.777 0.289 . . . . 10.0 110.687 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.74 -24.64 38.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.061 0.457 . . . . 10.0 110.675 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 45.9 tp -63.14 -25.29 68.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.323 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.96 -20.99 26.5 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.23 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -83.06 -8.84 59.49 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.435 0.531 . . . . 10.0 112.435 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 11.5 p -67.1 -33.36 75.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.768 0.318 . . . . 10.0 111.793 -179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 26.3 mt -65.71 -57.6 13.74 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.929 -178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.13 -32.28 74.83 Favored 'Trans proline' 0 C--N 1.357 0.977 0 C-N-CA 121.935 1.757 . . . . 10.0 111.959 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.98 -52.88 45.57 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.689 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.41 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 63.6 t80 -59.92 -44.55 94.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.865 0.364 . . . . 10.0 110.633 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.566 ' O ' HD12 ' A' ' 60' ' ' LEU . 36.6 tp -59.44 -54.74 43.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.462 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -69.94 -23.29 63.18 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.876 0.324 . . . . 10.0 111.876 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.435 ' HB3' ' HB3' ' A' ' 173' ' ' ASP . . . -67.28 -26.19 66.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.019 0.438 . . . . 10.0 110.882 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 63.5 mt -60.81 -25.55 66.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.382 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.7 p -70.17 -19.32 63.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.864 0.364 . . . . 10.0 111.089 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 72.45 12.09 76.84 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 121.048 -0.596 . . . . 10.0 112.711 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.1 mmpp? -85.28 -21.99 28.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.688 0.28 . . . . 10.0 111.034 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.39 115.23 3.78 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.554 -0.831 . . . . 10.0 112.962 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 96.4 t -83.78 112.18 20.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 19.0 m170 -86.87 96.43 10.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.799 0.333 . . . . 10.0 110.387 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.5 t -86.1 120.34 35.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.127 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 26.0 t -98.88 113.58 34.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.326 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.36 151.8 21.84 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.99 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -69.06 -49.15 65.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.353 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -126.96 157.6 39.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.421 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.08 -17.77 63.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.703 -178.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -68.51 -55.44 11.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.837 0.351 . . . . 10.0 110.559 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.68 -31.94 73.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.69 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.05 -44.62 74.9 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.866 -0.607 . . . . 10.0 111.118 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -80.7 -40.45 25.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.792 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -52.55 -61.37 2.32 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.922 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -70.11 -27.3 64.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.259 -0.428 . . . . 10.0 112.073 -178.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.61 -50.49 64.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.949 0.404 . . . . 10.0 110.494 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -71.17 -33.21 69.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.052 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -70.88 -36.69 72.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.569 -0.287 . . . . 10.0 111.658 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -92.69 -3.12 55.4 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.027 -0.269 . . . . 10.0 111.559 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.472 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 63.2 ttm-85 -59.77 -49.16 93.05 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-O 119.293 -0.384 . . . . 10.0 111.877 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' PRO . . . . . 0.541 ' O ' ' HB2' ' A' ' 149' ' ' PHE . 29.2 Cg_exo -63.15 -9.12 16.03 Favored 'Trans proline' 0 C--N 1.361 1.204 0 C-N-CA 122.228 1.952 . . . . 10.0 112.692 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.5 tp -93.09 -52.39 4.59 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.018 0.437 . . . . 10.0 110.245 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -72.24 -45.5 59.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.888 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -67.0 -23.29 65.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.764 0.316 . . . . 10.0 110.971 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.541 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 29.7 t80 -68.29 -26.11 65.48 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.751 -0.463 . . . . 10.0 109.751 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 54.2 mt -94.5 -1.0 54.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.637 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 97.62 1.8 58.83 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.819 -0.705 . . . . 10.0 113.447 178.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 28.8 mt -80.9 140.79 35.12 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.057 0.429 . . . . 10.0 110.794 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.86 123.95 34.26 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.754 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 56.7 t -104.95 119.78 54.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.574 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -115.51 146.87 18.89 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.652 -0.785 . . . . 10.0 112.201 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.5 tp -119.99 127.4 75.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.038 0.447 . . . . 10.0 110.45 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -108.46 105.83 15.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.137 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 161' ' ' MET . 86.1 mt -96.65 146.68 31.73 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.897 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' PRO . . . . . 0.482 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 27.5 Cg_endo -62.37 116.96 3.84 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.856 2.371 . . . . 10.0 112.355 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 96.21 6.19 59.01 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.749 -0.739 . . . . 10.0 112.825 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' MET . . . . . 0.442 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.5 OUTLIER -67.97 150.09 97.92 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.539 0.17 . . . . 10.0 110.612 179.679 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -63.52 152.53 79.75 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.628 2.219 . . . . 10.0 112.14 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . 0.478 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.46 -50.92 80.29 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 113.12 0.785 . . . . 10.0 113.12 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.478 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 52.7 Cg_exo -57.03 -44.59 42.92 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 122.029 1.819 . . . . 10.0 112.416 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.12 -41.89 97.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.848 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.452 ' HZ1' ' CG ' ' A' ' 185' ' ' ASP . 54.4 mttm -63.91 -41.38 97.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.955 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' ARG . . . . . 0.42 ' CG ' ' HA ' ' A' ' 199' ' ' VAL . 64.3 mtt180 -58.35 -36.8 74.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.285 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -70.5 -38.79 74.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.962 0.41 . . . . 10.0 110.26 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.02 -44.19 85.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.524 -0.762 . . . . 10.0 111.11 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 41.7 m-85 -73.76 -28.2 61.55 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.307 -0.406 . . . . 10.0 111.036 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -76.27 -10.3 59.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.753 0.311 . . . . 10.0 111.274 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -75.12 174.67 9.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.615 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . 0.435 ' HB3' ' HB3' ' A' ' 120' ' ' ALA . 9.4 m-20 -75.44 -38.55 59.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.12 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 66.4 mt -130.84 125.95 59.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.006 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.9 m -115.5 117.21 29.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.917 0.389 . . . . 10.0 111.626 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -96.06 131.21 42.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.998 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -166.43 173.66 41.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.284 -0.96 . . . . 10.0 112.768 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.17 153.54 20.87 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 122.214 0.205 . . . . 10.0 111.074 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -61.48 -36.59 80.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.684 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -63.23 -56.44 16.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.44 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . 0.482 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.5 tp10 -62.81 -37.85 88.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.238 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.67 -34.69 71.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.767 0.318 . . . . 10.0 110.993 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -81.21 -40.3 11.58 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.92 -0.657 . . . . 10.0 111.835 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -64.38 -36.09 83.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.826 0.346 . . . . 10.0 110.75 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 185' ' ' ASP . . . . . 0.452 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 29.8 m-20 -61.42 -40.74 95.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.333 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -61.53 -38.12 86.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.418 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 54.8 mt -67.24 -41.68 85.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.554 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 72.9 mtm-85 -67.61 -41.71 83.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.951 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.39 -23.79 67.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.19 0.519 . . . . 10.0 111.264 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -90.95 1.66 56.86 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.966 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 66.6 mtp -108.88 -7.11 15.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.736 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -62.42 160.52 13.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.621 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -110.8 -14.9 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.281 0.563 . . . . 10.0 109.932 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -129.24 138.15 32.54 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.481 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -58.3 -29.97 89.57 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.639 2.226 . . . . 10.0 112.743 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -70.77 -16.09 62.73 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.662 0.245 . . . . 10.0 111.662 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -76.36 -15.96 59.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.668 -0.242 . . . . 10.0 111.549 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 75.1 mtt180 -57.88 134.82 56.65 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.959 0.409 . . . . 10.0 111.521 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 199' ' ' VAL . . . . . 0.42 ' HA ' ' CG ' ' A' ' 167' ' ' ARG . 20.5 m -108.07 -20.49 6.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.496 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -89.47 -178.61 5.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.209 0.528 . . . . 10.0 111.729 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -137.73 -179.02 5.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.588 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -52.91 133.56 37.8 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.432 0.635 . . . . 10.0 112.351 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 17.3 mt -87.55 61.99 6.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.473 -0.785 . . . . 10.0 110.034 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -80.06 -50.08 10.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.337 0.495 . . . . 10.0 112.337 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -131.22 138.02 49.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.993 0.425 . . . . 10.0 111.701 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.604 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . . . -134.53 125.28 27.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.697 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 30.5 tp -122.68 108.57 13.23 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.877 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.4 p -96.04 129.87 45.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.207 0.527 . . . . 10.0 110.836 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -58.81 -55.9 29.16 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.377 -0.829 . . . . 10.0 111.981 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 210' ' ' GLU . . . . . 0.455 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 23.0 tt0 -126.27 114.72 18.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.867 0.365 . . . . 10.0 110.924 -179.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . 0.443 ' CG2' ' HB ' ' A' ' 391' ' ' THR . 25.5 m -85.22 -9.56 11.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.792 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 212' ' ' ASP . . . . . 0.411 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 10.0 t70 -52.97 -68.07 0.2 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.363 -0.835 . . . . 10.0 110.99 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 7.8 p -82.4 -50.8 8.49 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.996 -0.547 . . . . 10.0 112.119 -179.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 69.2 mt -55.52 -41.71 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 114.37 1.248 . . . . 10.0 114.37 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 10.8 mt -97.76 -51.95 3.91 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.614 0.968 . . . . 10.0 113.614 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 216' ' ' ILE . . . . . 0.411 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 47.0 mm -70.76 -56.24 11.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 113.387 0.884 . . . . 10.0 113.387 -177.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -74.49 -41.24 61.07 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.87 0.693 . . . . 10.0 112.87 -177.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -91.11 28.21 1.67 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 111.88 0.326 . . . . 10.0 111.88 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -66.78 -52.61 42.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.015 0.436 . . . . 10.0 111.907 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 220' ' ' ARG . . . . . 0.438 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -94.74 16.73 15.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.325 -178.419 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 90.1 m -79.82 116.92 64.51 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 120.819 0.342 . . . . 10.0 110.298 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -92.33 141.49 2.29 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.022 2.481 . . . . 10.0 113.065 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 223' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.71 112.95 25.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.528 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 53.3 mt -115.16 124.43 71.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.405 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 6.5 pt . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.974 179.968 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.227 0 CA-C-O 120.65 0.262 . . . . 10.0 111.074 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 374' ' ' SER . . . . . . . . . . . . . 18.9 m -153.82 153.21 31.71 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.42 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.5 tt -146.45 146.22 19.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.754 0.311 . . . . 10.0 110.534 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.71 142.03 28.17 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -56.39 -52.3 65.13 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -56.05 -41.84 75.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.462 . . . . 10.0 110.62 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -69.68 -21.19 63.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.693 -0.685 . . . . 10.0 111.577 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -82.04 -42.71 18.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.857 0.36 . . . . 10.0 110.268 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -70.24 -17.77 63.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.312 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -78.26 -7.48 57.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.835 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 25.5 mt -89.25 -2.86 58.64 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.548 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . 0.604 ' CD2' ' HB3' ' A' ' 206' ' ' ALA . 43.9 m-85 -96.48 137.79 35.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.793 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -70.64 -74.04 0.15 Allowed 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.169 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -88.86 98.51 11.77 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 56.2 tp -109.08 111.48 23.14 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.019 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -124.57 154.78 40.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.987 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -156.02 158.49 28.64 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.21 -0.995 . . . . 10.0 112.573 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 24.5 mtm -115.71 160.88 19.5 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.684 0.278 . . . . 10.0 110.419 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 391' ' ' THR . . . . . 0.443 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 6.6 t -164.31 169.79 17.01 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.111 178.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -93.71 166.21 27.58 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.832 -0.907 . . . . 10.0 110.832 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 393' ' ' THR . . . . . 0.451 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 0.2 OUTLIER -60.77 102.55 0.2 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.558 0.218 . . . . 10.0 110.594 179.719 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -141.79 -29.26 0.62 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.546 0.572 . . . . 10.0 112.546 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 38.8 t70 55.76 -119.63 1.41 Allowed 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 110.12 -0.326 . . . . 10.0 110.12 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 396' ' ' THR . . . . . 0.466 ' HB ' ' OE1' ' A' ' 397' ' ' GLU . 2.3 m 51.99 -100.9 0.1 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.97 0.73 . . . . 10.0 112.97 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 397' ' ' GLU . . . . . 0.466 ' OE1' ' HB ' ' A' ' 396' ' ' THR . 3.7 mp0 -76.91 9.8 2.68 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -58.8 -30.5 67.65 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.247 0.462 . . . . 10.0 112.247 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -72.2 -17.0 61.96 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.103 0.409 . . . . 10.0 112.103 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -81.59 -13.43 58.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.657 0.265 . . . . 10.0 111.277 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -61.16 -44.98 96.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.619 -0.264 . . . . 10.0 111.487 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 11.9 m -74.64 -4.44 37.22 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 48.9 m -111.15 -54.89 2.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.037 0.384 . . . . 10.0 112.037 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 49.3 mt -71.31 -47.95 56.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -106.3 -5.77 18.86 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm 60.5 47.5 8.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.37 0.605 . . . . 10.0 110.288 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 42.0 mt -117.04 135.81 53.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.626 -0.715 . . . . 10.0 109.866 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 408' ' ' ASP . . . . . 0.648 ' OD1' ' HD2' ' A' ' 13' ' ' ARG . 1.1 t0 -75.69 175.87 8.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 10.2 m -138.78 125.61 21.0 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.947 -0.47 . . . . 10.0 111.881 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 47.2 t -130.97 137.39 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.851 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.9 t -92.74 134.67 29.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 110.195 -0.298 . . . . 10.0 110.195 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 38.8 t -95.16 127.71 41.53 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.125 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -64.19 154.26 71.81 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.843 2.362 . . . . 10.0 112.055 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.3 p -84.11 154.42 23.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.196 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -66.85 -36.66 82.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.284 0.564 . . . . 10.0 109.588 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 41.2 mtm180 -129.45 154.19 80.72 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.001 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.48 115.3 2.94 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.429 2.086 . . . . 10.0 111.973 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 51.1 ttp -75.71 105.37 6.71 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.959 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -97.58 62.06 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.212 0.53 . . . . 10.0 110.936 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 36.2 ttp180 -98.42 115.57 28.78 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 47.0 mtpt -82.95 100.84 10.67 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.495 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 422' ' ' ASP . . . . . 0.446 ' HA ' ' OG ' ' A' ' 584' ' ' SER . 8.2 m-20 -89.0 102.35 14.99 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 68.1 mt -82.82 153.31 67.27 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.295 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.49 168.26 6.87 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.12 2.547 . . . . 10.0 113.444 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -88.17 124.31 33.69 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.312 -0.858 . . . . 10.0 110.706 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 58.3 mt -98.49 86.89 3.7 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.5 -0.556 . . . . 10.0 109.5 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 22.6 t -81.18 129.45 37.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.394 -179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 428' ' ' TYR . . . . . 0.533 ' CE2' ' HA ' ' A' ' 614' ' ' PRO . 6.9 m-85 -112.42 -178.17 3.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.358 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 62.9 mtm -80.99 -74.22 0.33 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.909 -0.317 . . . . 10.0 111.166 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 67.8 p -89.5 162.56 15.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.912 0.387 . . . . 10.0 111.415 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -63.09 -29.8 71.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.175 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -59.43 -46.01 89.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.768 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -61.2 -44.46 97.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.23 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -58.69 -50.3 74.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.544 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 45.7 mm -61.25 -46.0 97.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.904 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 55.9 tp60 -58.13 -43.5 87.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.876 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.52 86.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.811 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 92.0 mt -62.42 -49.64 83.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.051 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 45.6 mm -60.24 -38.76 78.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.253 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -61.83 -44.52 96.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.675 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . 0.6 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 14.8 t70 -63.98 -45.15 90.36 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.161 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 86.6 mt -58.65 -39.62 76.71 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.692 -0.686 . . . . 10.0 110.964 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -58.29 -40.62 82.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.676 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -69.18 -40.14 78.28 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.765 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 17.7 mmt180 -65.66 -45.52 82.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.548 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 7.6 m -63.04 -38.48 91.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.593 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.7 -31.61 72.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.252 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.86 -23.15 25.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.233 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 95.93 29.25 8.71 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.838 -0.696 . . . . 10.0 111.825 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 450' ' ' GLN . . . . . 0.41 ' OE1' ' HD2' ' A' ' 445' ' ' ARG . 64.2 tt0 -101.43 130.99 23.61 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 120.451 0.167 . . . . 10.0 111.046 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.96 140.58 50.63 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.676 2.251 . . . . 10.0 111.282 178.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 23.9 t -121.61 133.69 67.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.692 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 60.4 tp -120.68 106.27 11.57 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 22.5 t -95.09 127.77 46.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.752 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -115.5 115.17 3.34 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.958 -0.639 . . . . 10.0 111.911 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 21.8 p -103.72 148.58 25.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.633 0.254 . . . . 10.0 110.839 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 21.1 pt -92.36 -4.54 10.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.853 0.358 . . . . 10.0 111.107 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 7.5 m -148.82 146.98 28.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.082 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 47.6 mt -63.09 -36.68 76.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.396 -0.366 . . . . 10.0 111.127 -179.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.86 -37.23 71.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.036 0.446 . . . . 10.0 110.326 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -67.48 -40.03 85.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.04 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.87 -43.75 91.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.481 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -61.99 -43.05 99.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.637 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 40.6 tp -65.13 -50.17 67.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.901 -0.591 . . . . 10.0 111.546 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 9.3 p -64.88 -33.93 66.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 121.048 -0.261 . . . . 10.0 111.393 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 71.1 m -65.44 -38.91 91.27 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 120.84 0.352 . . . . 10.0 110.363 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -63.32 -48.27 78.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.261 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . 0.465 ' CD ' ' HZ2' ' A' ' 471' ' ' LYS . 8.7 mm-40 -62.94 -39.7 95.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.76 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 18.8 mt -63.49 -37.24 86.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.891 0.377 . . . . 10.0 110.432 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 20.7 m -68.92 -39.93 79.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.43 0.633 . . . . 10.0 109.807 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.465 ' HZ2' ' CD ' ' A' ' 468' ' ' GLU . 28.5 ttpt -64.7 -32.11 73.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.215 -0.902 . . . . 10.0 110.493 179.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -87.41 -4.61 59.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.293 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 68.31 31.55 74.53 Favored Glycine 0 C--N 1.329 0.169 0 CA-C-N 116.116 -0.493 . . . . 10.0 112.963 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 57.5 mt -101.06 136.68 31.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.731 0.301 . . . . 10.0 110.62 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.479 ' O ' ' HB ' ' A' ' 500' ' ' VAL . 52.8 mttm -61.0 134.63 57.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.135 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 -152.84 125.4 8.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.066 0.46 . . . . 10.0 111.289 -179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -110.13 124.25 51.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.868 -0.606 . . . . 10.0 109.467 178.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 19.1 t -94.16 122.24 45.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.805 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . 0.414 HD21 ' HG3' ' A' ' 487' ' ' GLU . 21.0 mt -79.5 72.83 6.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.429 0.633 . . . . 10.0 110.412 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -68.8 126.03 28.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.473 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -66.95 -18.57 65.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.618 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -72.51 -29.88 63.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.003 0.43 . . . . 10.0 110.567 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -107.71 74.33 0.95 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.955 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -65.71 -32.55 74.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.921 0.391 . . . . 10.0 110.68 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.36 -38.74 90.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.572 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -80.44 -29.88 37.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.098 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.414 ' HG3' HD21 ' A' ' 479' ' ' LEU . 26.4 tt0 -54.49 -47.41 73.07 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.516 -0.766 . . . . 10.0 110.864 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -56.82 -41.45 77.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.288 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -68.64 -41.33 79.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.956 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.2 mt -64.35 -47.82 87.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.911 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 97.4 t -63.58 -36.96 78.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.918 0.389 . . . . 10.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -62.9 -33.95 76.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.672 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -113.0 23.16 13.67 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.972 0.415 . . . . 10.0 111.106 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -73.18 -18.81 61.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.107 0.48 . . . . 10.0 110.928 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -94.38 15.0 64.21 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.867 -0.682 . . . . 10.0 111.744 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -71.27 140.63 85.3 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 110.365 -0.235 . . . . 10.0 110.365 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -56.54 128.11 28.69 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.398 2.065 . . . . 10.0 112.371 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 64.6 32.94 11.14 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.031 179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -111.52 121.6 45.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.566 -0.288 . . . . 10.0 110.274 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' VAL . . . . . 0.479 ' HB ' ' O ' ' A' ' 475' ' ' LYS . 44.5 t -101.92 117.75 47.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.035 0.445 . . . . 10.0 110.927 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.6 m -109.47 135.88 49.77 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.282 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 25.9 mt -115.99 123.47 71.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.706 0.289 . . . . 10.0 110.548 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -122.51 136.89 54.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.777 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 10.3 m -107.48 122.23 46.22 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.702 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 16.7 m120 53.37 68.04 0.9 Allowed 'General case' 0 N--CA 1.465 0.294 0 O-C-N 123.682 0.614 . . . . 10.0 110.743 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.03 135.04 57.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.176 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.9 172.59 12.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.712 -0.677 . . . . 10.0 110.848 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -68.9 167.1 46.17 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 121.009 -0.615 . . . . 10.0 112.422 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.455 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 74.8 mtt180 64.96 -86.71 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.023 0.529 . . . . 10.0 111.179 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.2 133.23 5.68 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.835 -0.697 . . . . 10.0 112.376 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.35 153.88 39.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.714 0.292 . . . . 10.0 111.046 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -76.96 112.98 14.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.806 0.336 . . . . 10.0 110.462 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 82.5 mt -84.56 125.0 40.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.186 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 2.0 t -85.84 125.47 40.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.788 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 72.4 mt -74.99 132.07 41.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.585 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 91.94 -4.31 78.24 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.505 -0.638 . . . . 10.0 111.505 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 113.0 -175.32 16.55 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.608 -0.997 . . . . 10.0 110.608 -179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 1.6 p -123.26 93.83 4.07 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.304 0.552 . . . . 10.0 111.018 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 34.8 p-90 -59.22 -32.99 70.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.009 0.433 . . . . 10.0 110.405 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -66.54 -23.58 66.25 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.32 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -92.96 -33.22 14.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.095 0.474 . . . . 10.0 109.864 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -68.2 -39.83 82.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.748 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 26.8 m -73.53 -23.1 19.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.973 0.416 . . . . 10.0 110.318 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -81.94 -27.67 33.18 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.716 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -66.26 -27.77 68.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.442 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 25.2 mt -75.98 136.5 40.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.979 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -69.33 -32.21 71.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.987 0.422 . . . . 10.0 110.027 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -134.36 88.11 31.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.312 179.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -84.34 103.01 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.462 2.108 . . . . 10.0 112.06 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 20.8 p -75.83 162.7 27.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.52 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -60.37 -34.42 73.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.937 0.398 . . . . 10.0 110.364 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.38 -47.39 76.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.107 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -64.26 -43.08 95.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.826 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 72.4 mt -59.46 -42.78 88.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.609 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.64 -36.84 68.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.541 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 9.5 tptt -64.18 -50.27 68.78 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.327 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.6 -36.05 74.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 110.114 -0.328 . . . . 10.0 110.114 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -62.3 -45.79 91.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.064 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -68.32 -40.5 81.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.449 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.56 -45.16 94.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.574 -0.739 . . . . 10.0 109.454 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 50.0 t90 -61.68 -37.63 84.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.842 -1.072 . . . . 10.0 110.877 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 40.2 tp60 -57.39 -44.9 84.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.778 0.323 . . . . 10.0 110.879 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 42.2 t -64.03 -42.74 96.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.083 0.468 . . . . 10.0 110.314 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -68.83 -38.14 79.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.588 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -62.27 -45.21 94.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.963 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.08 -34.22 77.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.271 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -60.22 -39.39 86.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.732 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 99.6 t -69.69 -39.05 77.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.526 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.88 -45.94 90.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.598 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -69.51 -15.52 63.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.503 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -86.02 -25.86 25.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.974 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 123.89 22.75 2.14 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.567 -0.825 . . . . 10.0 112.896 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 71.12 -162.51 54.14 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.007 -0.616 . . . . 10.0 112.636 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 50.7 tp -74.36 126.71 31.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.089 -0.337 . . . . 10.0 110.089 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 555' ' ' HIS . . . . . 0.402 ' HA ' ' O ' ' A' ' 583' ' ' SER . 65.9 t60 -97.86 110.97 23.44 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.328 -179.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 16.7 mm -92.8 132.88 35.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.427 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 26.4 mt -127.5 124.51 63.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.909 0.385 . . . . 10.0 110.239 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -110.13 129.92 9.62 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 111.32 -0.712 . . . . 10.0 111.32 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 16.1 p -79.58 -34.31 40.96 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.155 0.502 . . . . 10.0 110.62 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -142.04 160.19 40.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.074 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -98.11 150.35 21.53 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.257 -0.645 . . . . 10.0 109.257 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 562' ' ' HIS . . . . . 0.42 ' CE1' HD11 ' A' ' 567' ' ' ILE . 6.3 t-80 -93.91 145.35 24.69 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -62.33 -57.54 10.96 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.2 107.96 6.7 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.064 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 41.8 ttt85 -60.53 -16.96 42.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.952 -0.567 . . . . 10.0 112.275 -178.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -55.85 -41.96 75.1 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 121.236 0.541 . . . . 10.0 110.299 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 567' ' ' ILE . . . . . 0.42 HD11 ' CE1' ' A' ' 562' ' ' HIS . 58.9 mt -84.59 -28.99 6.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.367 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -61.52 -48.08 82.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.415 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -64.13 -36.27 83.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.667 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -70.89 -28.79 64.8 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.196 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . 0.405 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 25.5 tp -66.44 -39.84 89.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.994 0.426 . . . . 10.0 110.467 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 32.5 mtm105 -82.4 -16.03 50.51 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.19 0.519 . . . . 10.0 110.009 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.26 4.2 34.7 Favored Glycine 0 CA--C 1.52 0.355 0 CA-C-N 115.731 -0.668 . . . . 10.0 113.225 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 574' ' ' ARG . . . . . 0.405 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 2.4 mmt180 -77.08 -24.29 51.85 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 3.8 t -106.97 162.39 13.88 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.915 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 66.67 40.91 94.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.224 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -87.43 143.81 27.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.178 -0.305 . . . . 10.0 110.178 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 578' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 105' ' ' GLY . 60.4 mt-30 64.75 23.56 12.74 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.637 0.586 . . . . 10.0 110.371 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 69.85 45.14 59.22 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.524 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -107.52 -167.27 1.24 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.296 -0.261 . . . . 10.0 110.296 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -88.82 167.82 12.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.22 0.533 . . . . 10.0 111.877 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 168.86 166.06 27.29 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.512 -0.635 . . . . 10.0 111.512 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.402 ' O ' ' HA ' ' A' ' 555' ' ' HIS . 4.8 p -152.51 142.38 22.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.919 0.359 . . . . 10.0 110.52 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 584' ' ' SER . . . . . 0.446 ' OG ' ' HA ' ' A' ' 422' ' ' ASP . 84.6 p -126.61 139.67 53.01 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.07 0.462 . . . . 10.0 110.554 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 4.3 tpm_? -135.83 109.42 7.98 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.909 -0.775 . . . . 10.0 108.909 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -102.34 145.31 29.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.269 0.557 . . . . 10.0 111.671 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 587' ' ' TYR . . . . . 0.442 ' HH ' ' HB2' ' A' ' 441' ' ' ASP . 68.6 m-85 -127.5 164.45 21.91 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.193 -0.912 . . . . 10.0 109.39 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 588' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 587' ' ' TYR . 5.5 mt -163.57 166.89 22.01 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.194 -0.299 . . . . 10.0 110.194 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 589' ' ' SER . . . . . 0.401 ' HA ' ' O ' ' A' ' 428' ' ' TYR . 0.3 OUTLIER -139.01 150.43 45.81 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 178.262 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 590' ' ' MET . . . . . 0.404 ' HA ' ' HG3' ' A' ' 595' ' ' MET . 75.3 mmm -68.47 -8.51 41.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.563 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -93.66 2.12 56.41 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.875 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -80.58 154.46 27.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.849 0.357 . . . . 10.0 110.864 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -68.15 -17.86 64.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.746 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 9.1 tp -65.61 -24.01 66.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.992 0.425 . . . . 10.0 110.998 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.404 ' HG3' ' HA ' ' A' ' 590' ' ' MET . 13.6 mmt -73.89 1.63 10.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.652 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -96.84 -3.11 42.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.24 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 24.0 pt -84.9 -3.22 7.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.07 0.462 . . . . 10.0 110.971 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -89.78 1.55 55.99 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.696 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.84 -66.03 0.23 Allowed 'General case' 0 N--CA 1.466 0.35 0 O-C-N 124.001 0.813 . . . . 10.0 111.827 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.7 m -86.74 120.53 28.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.011 0.434 . . . . 10.0 110.918 -179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.16 -19.39 64.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.656 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -61.26 -34.57 75.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.69 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 49.4 t -65.13 -49.36 79.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.067 0.46 . . . . 10.0 109.885 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.0 -35.63 81.08 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.378 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -64.94 -38.02 94.99 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 116.076 -0.511 . . . . 10.0 112.237 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 37.8 tpp -68.16 -28.36 67.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.905 0.383 . . . . 10.0 110.543 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 58.0 mtt -68.28 -24.61 64.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.809 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 80.1 mtt-85 -69.59 -17.99 63.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.866 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -82.39 9.21 9.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.072 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 4.2 tp -78.79 -11.01 59.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.056 0.455 . . . . 10.0 110.461 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 611' ' ' GLY . . . . . 0.44 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 87.79 -45.64 3.36 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.575 -0.821 . . . . 10.0 111.776 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 612' ' ' MET . . . . . 0.44 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.6 OUTLIER 73.36 -56.8 0.65 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.625 0.77 . . . . 10.0 111.912 179.154 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 18.2 mtpp 61.21 80.79 0.25 Allowed Pre-proline 0 N--CA 1.463 0.204 0 O-C-N 123.523 0.515 . . . . 10.0 111.153 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 614' ' ' PRO . . . . . 0.533 ' HA ' ' CE2' ' A' ' 428' ' ' TYR . 32.5 Cg_exo -58.93 106.86 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.018 2.479 . . . . 10.0 112.451 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 120.0 -22.29 8.61 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.921 -0.657 . . . . 10.0 112.009 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -106.1 116.65 32.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.814 0.34 . . . . 10.0 110.1 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -69.14 102.01 1.57 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.873 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 10.5 tp -71.99 -33.09 46.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.174 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 619' ' ' GLU . . . . . 0.402 ' OE1' ' HA ' ' A' ' 619' ' ' GLU . 7.4 mm-40 48.14 86.29 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.428 0.691 . . . . 10.0 112.853 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -120.51 96.75 48.95 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.245 179.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.59 -29.49 85.35 Favored 'Trans proline' 0 N--CA 1.476 0.446 0 C-N-CA 123.49 2.793 . . . . 10.0 114.456 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 56.0 p-90 -63.21 -24.44 67.88 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.638 -0.425 . . . . 10.0 111.374 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 95.9 t -65.71 -48.24 83.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 91.3 m -61.1 -38.86 87.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.463 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -35.22 79.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.27 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -68.7 -45.04 72.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.196 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 77.9 mt -66.28 -41.48 89.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.706 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.03 -41.49 92.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.976 0.417 . . . . 10.0 110.75 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -70.07 -38.77 75.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.125 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -61.36 -42.09 98.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.943 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -58.93 -42.21 89.22 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.299 0.571 . . . . 10.0 110.022 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -70.48 -34.81 72.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.563 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -59.47 -38.05 79.77 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.786 0.327 . . . . 10.0 110.327 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 95.1 t -57.09 -52.64 53.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.423 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -73.07 -25.7 61.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.353 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 56.9 m -64.19 -38.27 90.44 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -77.44 -34.93 54.45 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.21 -0.663 . . . . 10.0 109.21 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 28.6 t30 -64.67 -40.51 95.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.088 -0.96 . . . . 10.0 110.606 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.09 -37.7 83.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.75 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 640' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 3.4 t70 -62.09 -27.6 69.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.084 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 58.0 mt -81.6 -37.24 15.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.408 -0.589 . . . . 10.0 109.408 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 53.9 mtm-85 -62.02 -38.49 88.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.33 179.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 14.6 pttm -65.56 -27.16 68.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.958 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -65.44 -41.7 93.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.159 0.504 . . . . 10.0 109.734 179.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.98 -41.61 77.67 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.043 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 646' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 650' ' ' ASP . 96.1 mt -61.07 -40.7 94.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.696 -0.683 . . . . 10.0 110.939 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -56.46 -36.37 68.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.101 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -83.8 -41.47 17.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.673 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -70.95 -32.09 68.88 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 650' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 0.3 OUTLIER -63.59 -32.58 74.09 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.892 0.377 . . . . 10.0 110.731 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 651' ' ' VAL . . . . . 0.462 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 44.8 t -63.53 -44.08 98.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.382 0.61 . . . . 10.0 109.435 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -73.6 -24.42 60.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.412 -0.813 . . . . 10.0 110.34 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -61.83 -51.57 67.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.584 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.84 -43.93 97.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.798 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 655' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 29.7 mt-30 -61.89 -44.57 96.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.368 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 16.6 ttp-105 -61.79 -42.89 99.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.124 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 45.3 ttp180 -66.39 -43.19 86.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.656 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.7 -47.11 79.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.125 -0.489 . . . . 10.0 112.014 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.8 tp -67.79 -39.84 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 120.935 -0.306 . . . . 10.0 111.389 -179.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -70.55 -31.19 68.14 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.672 -0.411 . . . . 10.0 110.088 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 27.6 t -61.34 -51.0 70.65 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -59.29 -46.52 88.34 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.34 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -60.11 -43.28 95.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.085 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -74.6 -35.19 62.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.756 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -64.57 -43.01 95.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.874 0.369 . . . . 10.0 110.038 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 79.7 mt -76.42 -17.08 59.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.343 0.592 . . . . 10.0 109.98 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 24.4 tp -76.54 -37.44 56.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.247 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -54.38 28.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.584 -0.735 . . . . 10.0 111.288 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 26.8 m -76.39 149.05 6.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.079 -0.509 . . . . 10.0 111.603 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.61 -24.0 16.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.334 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -83.37 108.63 16.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.273 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 7.9 p -113.59 -3.94 11.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.221 0.534 . . . . 10.0 109.863 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -42.16 72.63 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.338 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.85 -46.74 88.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.916 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 3.8 m -64.26 -48.03 77.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.297 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.29 -43.86 82.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.45 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.81 -40.34 75.99 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.045 -0.262 . . . . 10.0 111.372 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 69.6 m -61.43 -44.07 97.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.573 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 45.0 pt -77.26 -23.62 14.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 120.839 -0.344 . . . . 10.0 111.285 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 36.2 ttm-85 -60.4 -46.07 91.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.951 0.405 . . . . 10.0 110.61 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -63.84 -37.84 88.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.744 -0.662 . . . . 10.0 111.014 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -70.29 -47.56 60.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.205 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 75.8 t -59.79 -46.81 93.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.969 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -63.44 -42.72 98.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.482 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.4 tttm -60.54 -50.87 71.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.457 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.81 89.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.908 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 95.5 m -62.84 -46.27 88.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.727 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 95.8 mt -66.29 -41.29 88.79 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 116.58 -0.282 . . . . 10.0 110.381 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -56.61 -29.73 62.46 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.677 0.391 . . . . 10.0 111.921 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -72.97 -23.25 60.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 10.0 112.033 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -111.71 -30.41 7.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.894 0.378 . . . . 10.0 111.184 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 86.1 mt -127.84 108.03 20.34 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.454 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.14 132.1 20.52 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.352 2.035 . . . . 10.0 111.001 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -52.04 116.21 2.64 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.633 2.222 . . . . 10.0 112.69 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 63.57 74.06 0.43 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.801 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 17.1 p -135.25 -162.2 1.23 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.557 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 88.9 mt -98.41 159.29 15.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.598 -0.273 . . . . 10.0 110.585 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.41 -38.63 71.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.883 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -67.24 -16.19 64.14 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.96 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 43.0 mtt -92.49 -6.1 50.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.983 0.42 . . . . 10.0 110.482 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 701' ' ' TRP . . . . . . . . . . . . . 46.5 m0 -90.75 103.67 16.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.431 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -80.81 77.96 7.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.364 0.602 . . . . 10.0 110.006 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 703' ' ' ILE . . . . . 0.476 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.5 mm -61.65 -48.09 90.86 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.304 -0.862 . . . . 10.0 111.197 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 704' ' ' PRO . . . . . 0.476 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.2 Cg_exo -55.85 -47.27 25.94 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 121.889 1.726 . . . . 10.0 112.134 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -65.03 -43.01 96.41 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.033 -0.603 . . . . 10.0 112.293 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 61.9 tp -61.63 -46.58 89.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.767 0.318 . . . . 10.0 110.466 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -63.64 -40.46 96.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.788 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -56.52 -41.62 77.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.994 0.426 . . . . 10.0 110.862 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 709' ' ' ARG . 1.2 tpt180 -75.77 -47.62 25.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.176 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 66.6 mt -60.67 -45.68 93.23 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 44.8 mttt -75.38 -5.88 47.16 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -178.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -116.6 -57.37 2.19 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.09 0.774 . . . . 10.0 113.09 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -89.29 -16.76 30.39 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.929 0.715 . . . . 10.0 112.929 -177.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -108.48 -7.22 15.83 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.14 -0.624 . . . . 10.0 111.603 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.16 27.28 17.07 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.068 0.461 . . . . 10.0 110.786 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 1.9 mp -108.53 100.76 9.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.486 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -86.26 77.25 9.57 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.013 -0.539 . . . . 10.0 109.712 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.64 131.52 21.72 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.346 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 719' ' ' PRO . . . . . 0.475 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 85.4 Cg_endo -83.75 65.81 7.33 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.152 2.568 . . . . 10.0 112.23 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 52.6 mt -59.53 -43.77 91.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.689 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -66.45 -27.27 67.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.022 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 722' ' ' GLU . . . . . 0.475 ' HB2' ' HB2' ' A' ' 719' ' ' PRO . 1.0 OUTLIER -98.58 27.58 4.74 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.776 -179.581 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -115.41 -47.44 2.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.636 179.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 94.8 mt -63.84 -21.1 66.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.089 -0.505 . . . . 10.0 112.081 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -78.4 -17.32 56.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.039 0.447 . . . . 10.0 110.613 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -107.39 -29.9 9.0 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.784 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 727' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' A' ' 730' ' ' LEU . 33.7 mt-10 -123.65 87.35 52.44 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.53 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . 0.404 ' HD2' ' OE2' ' A' ' 729' ' ' GLU . 29.0 Cg_exo -63.75 -30.73 69.23 Favored 'Trans proline' 0 CA--C 1.528 0.195 0 C-N-CA 122.577 2.185 . . . . 10.0 112.218 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . 0.404 ' OE2' ' HD2' ' A' ' 728' ' ' PRO . 2.3 mp0 -91.11 20.11 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.411 -0.358 . . . . 10.0 111.258 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 730' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 727' ' ' GLU . 0.5 OUTLIER -66.75 -30.09 70.22 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.829 -0.434 . . . . 10.0 109.829 178.938 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 32.4 m170 62.44 -167.71 0.2 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.54 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.84 -45.0 6.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.164 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -61.22 -55.12 35.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.636 -0.257 . . . . 10.0 111.154 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 734' ' ' THR . . . . . 0.519 ' HB ' ' O ' ' A' ' 730' ' ' LEU . 1.3 m -58.27 -32.89 68.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.839 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 37.5 tp -63.56 -42.94 98.31 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 51.7 mtt180 -62.84 -44.85 95.04 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.949 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -62.09 -36.18 80.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.91 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 20.8 mmm-85 -61.08 -50.64 72.45 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.943 -0.391 . . . . 10.0 109.943 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 59.7 mt -60.08 -43.36 92.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.381 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 34.1 tp -63.29 -48.12 79.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.767 -0.651 . . . . 10.0 111.029 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.18 -40.21 95.62 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.869 0.366 . . . . 10.0 111.014 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -39.36 93.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.919 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 48.3 p -61.27 -38.3 86.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.76 0.314 . . . . 10.0 110.444 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 58.2 mt -70.2 -41.89 78.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.192 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -60.87 -46.59 90.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.553 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 87.6 t -69.49 -37.27 74.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.433 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -61.04 -51.95 67.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.341 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 748' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 21.9 mt-30 -63.84 -28.05 69.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.438 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -46.03 79.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.847 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -67.13 -33.6 75.79 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.154 -0.476 . . . . 10.0 109.824 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.44 -25.24 67.87 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.367 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 752' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 85.5 mt-10 -62.15 -24.8 67.39 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.895 0.332 . . . . 10.0 111.895 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 1.7 t -102.59 4.93 10.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.266 0.555 . . . . 10.0 110.611 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 47.8 t -113.64 -49.68 5.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.17 145.82 6.96 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.047 -0.821 . . . . 10.0 111.047 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 756' ' ' ALA . . . . . 0.454 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -59.98 -66.25 0.55 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.056 0.428 . . . . 10.0 111.785 -178.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.48 -27.48 66.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.068 0.461 . . . . 10.0 110.742 -179.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.5 tpt -66.56 -46.91 74.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.876 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 759' ' ' MET . . . . . 0.406 ' O ' ' HG3' ' A' ' 763' ' ' GLU . 12.4 tpt -62.39 -38.66 90.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.556 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.9 mmp_? -59.13 -35.11 72.9 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.267 0.556 . . . . 10.0 110.41 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -69.96 -38.41 76.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.581 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -65.51 -44.93 85.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.085 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 759' ' ' MET . 84.9 mt-10 -58.95 -49.29 78.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.857 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -59.74 -42.97 94.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.306 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.89 -46.82 92.79 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.946 -0.645 . . . . 10.0 112.011 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.15 -42.09 91.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-O 120.686 0.279 . . . . 10.0 110.637 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 23.7 mtp -59.09 -48.47 81.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.606 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.7 -44.94 92.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.53 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 -59.35 -46.26 89.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.115 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 9.2 m -65.74 -39.94 91.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.974 0.416 . . . . 10.0 110.416 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.2 tt -61.46 -49.88 75.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.942 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -64.29 -30.98 72.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.934 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 7.8 t -64.69 -52.67 55.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.214 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 71.4 mt -72.79 -26.96 61.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.245 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 9.3 t-105 -60.5 -47.01 88.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.621 -0.263 . . . . 10.0 110.835 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -69.96 -31.34 69.02 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.768 -0.373 . . . . 10.0 110.337 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.24 -47.16 74.66 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 38.1 t60 -60.06 -40.46 89.54 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.69 -1.141 . . . . 10.0 110.64 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 19.7 mt -63.46 -46.77 84.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.537 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -65.69 -43.29 89.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.382 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.57 -46.43 89.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.03 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 50.8 mmm -63.1 -41.58 99.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.762 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.21 -46.95 86.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.828 0.347 . . . . 10.0 110.52 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -65.24 -38.81 91.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.03 0.443 . . . . 10.0 110.458 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 15.8 tp -67.4 -38.89 85.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.468 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -57.06 -42.51 80.73 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.63 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 . . . . . 0 C--N 1.326 -0.418 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.388 -179.402 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo . . . . . 0 CA--C 1.529 0.241 0 N-CA-C 113.314 0.467 . . . . 10.0 113.314 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 22.1 mtmm -90.88 -49.6 6.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.947 0.403 . . . . 10.0 110.022 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -65.07 -39.46 93.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.104 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -65.9 -41.97 90.8 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -59.83 -37.03 78.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.479 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -67.01 -25.7 66.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.466 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 44.9 ttp85 -80.16 -47.95 13.92 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -58.1 -43.46 87.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.644 -0.707 . . . . 10.0 111.048 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 3.9 p -66.86 -37.73 85.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.265 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -66.11 -48.44 70.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.555 -0.293 . . . . 10.0 110.416 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 15.0 m -63.11 -34.78 78.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.092 0.472 . . . . 10.0 110.169 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 35.0 ttm -66.78 -36.48 82.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.86 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -70.55 -44.08 68.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.334 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -59.67 -47.07 87.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.385 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.64 81.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.799 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 23.6 ttp -62.78 -36.25 82.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.447 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 95.7 mt -71.88 -30.02 64.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.479 . . . . 10.0 109.876 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 816' ' ' GLU . . . . . 0.463 ' HA ' ' CE ' ' A' ' 819' ' ' LYS . 74.4 mm-40 -69.8 -45.14 68.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.474 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 1.3 p -70.11 -28.73 65.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.615 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 58.8 tp -56.7 -63.15 1.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.705 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 819' ' ' LYS . . . . . 0.463 ' CE ' ' HA ' ' A' ' 816' ' ' GLU . 31.0 pttt -62.31 -32.8 73.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.797 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -60.91 -59.22 5.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.271 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -66.42 -32.58 74.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.309 -0.405 . . . . 10.0 111.584 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 20.3 t -60.87 -53.25 51.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-O 120.792 0.33 . . . . 10.0 110.211 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 33.7 mm -65.36 -37.46 80.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.42 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 45.5 t -58.44 -57.88 10.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.229 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 22.1 m -59.19 -42.61 91.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.377 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 68.2 mt -65.39 -43.26 91.26 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 4.9 m -75.03 -26.06 59.2 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.974 0.416 . . . . 10.0 111.059 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -87.06 11.95 12.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.451 0.538 . . . . 10.0 112.451 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.8 p -64.17 128.98 27.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -101.69 115.26 30.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.035 0.445 . . . . 10.0 111.15 -179.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 4.4 m . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.607 179.59 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.703 0.287 . . . . 10.0 110.773 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 109.76 -168.43 13.18 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.117 -0.563 . . . . 10.0 111.94 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.417 ' O ' ' HB3' ' A' ' 16' ' ' ARG . 0.3 OUTLIER -57.0 140.38 49.16 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.942 0.401 . . . . 10.0 110.452 179.472 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.458 ' HD2' ' OD1' ' A' ' 408' ' ' ASP . 16.9 mmt85 -88.98 164.15 15.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.696 -178.143 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.402 ' HB3' ' H ' ' A' ' 15' ' ' ASP . 5.9 t30 64.84 -88.4 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.167 -0.924 . . . . 10.0 112.652 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.402 ' H ' ' HB3' ' A' ' 14' ' ' ASN . 13.9 t70 -55.52 -60.07 3.94 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.825 0.676 . . . . 10.0 112.825 -177.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.417 ' HB3' ' O ' ' A' ' 12' ' ' SER . 11.7 ttt85 -63.56 -38.13 89.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.668 -0.242 . . . . 10.0 111.437 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -57.85 -51.54 69.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.739 0.304 . . . . 10.0 110.982 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.429 HD12 ' O ' ' A' ' 411' ' ' VAL . 45.4 mt -64.72 -35.38 80.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.203 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.7 ttp-105 -66.87 -44.42 80.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.807 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -39.47 90.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.149 0.499 . . . . 10.0 110.133 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 55.4 mtt -71.84 -28.28 63.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.644 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -29.96 69.09 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.366 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -71.07 -39.92 71.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.714 -0.675 . . . . 10.0 109.584 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.1 t -65.84 -38.44 82.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.62 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 98.7 t -58.79 -37.42 66.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.233 178.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -63.4 -41.34 98.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.431 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.1 mt -62.32 -44.65 99.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.079 0.466 . . . . 10.0 109.885 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 48.8 mt -62.66 -44.57 99.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.341 179.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -63.35 -38.77 92.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.787 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.476 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -75.01 -26.06 59.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.477 -0.328 . . . . 10.0 111.531 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 15.9 ttt -84.25 -12.55 54.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.066 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.489 ' OE1' ' HD3' ' A' ' 72' ' ' ARG . 7.1 tt0 -57.2 -51.96 77.74 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 116.371 -0.377 . . . . 10.0 111.34 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 61.1 Cg_exo -54.11 -30.64 61.34 Favored 'Trans proline' 0 C--N 1.363 1.296 0 C-N-CA 122.207 1.938 . . . . 10.0 112.429 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -70.13 -44.24 69.33 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 23.3 mmt -66.92 -31.07 71.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.749 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -63.06 -20.36 65.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.902 0.382 . . . . 10.0 111.0 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.6 mtmt -96.42 1.55 51.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.566 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 mp -100.14 148.85 24.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.095 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.4 p -81.66 166.81 19.82 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -58.58 -38.74 78.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.965 0.412 . . . . 10.0 110.999 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -68.89 -33.14 73.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.977 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -68.55 -35.65 77.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.836 0.35 . . . . 10.0 110.144 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.3 mt -66.58 -46.97 74.24 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -60.64 -33.75 73.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.338 -0.846 . . . . 10.0 110.305 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.64 -33.25 86.72 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 115.538 -0.755 . . . . 10.0 111.873 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -69.09 -36.87 78.06 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.5 m -60.07 -46.25 90.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.946 0.403 . . . . 10.0 110.221 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.37 -34.93 79.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.932 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -62.26 -45.04 95.09 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.995 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -60.36 -42.57 96.03 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.102 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -58.35 -38.23 76.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.872 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.89 -40.38 32.52 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.967 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -60.51 -40.49 91.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.571 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 32.2 mt -63.94 -20.9 66.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.707 0.289 . . . . 10.0 111.62 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -106.34 9.85 31.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.07 0.462 . . . . 10.0 110.857 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -117.52 -50.29 2.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.365 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 168.57 64.51 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.602 -0.809 . . . . 10.0 112.309 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -144.35 149.42 36.12 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.7 t -97.3 142.53 14.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.52 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 39.1 tp -61.3 -47.14 87.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.945 0.403 . . . . 10.0 111.238 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -73.82 1.35 10.74 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.265 -0.425 . . . . 10.0 111.45 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -105.54 -11.05 16.54 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.311 0.577 . . . . 10.0 109.839 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.6 mt -93.56 -4.64 50.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.798 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.452 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 73.9 mt -49.58 -56.64 15.53 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 115.806 -0.634 . . . . 10.0 112.62 -179.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' A' ' 64' ' ' ILE . 11.3 Cg_endo -54.32 -47.28 27.78 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.34 2.027 . . . . 10.0 113.474 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -71.44 -42.96 67.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.84 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.64 -48.25 72.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.898 -179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -63.72 -31.55 72.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.512 -0.313 . . . . 10.0 111.11 -179.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.45 -44.73 93.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.832 0.348 . . . . 10.0 110.288 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 81.9 t -62.82 -43.93 99.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.442 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 40.4 t -64.06 -44.34 97.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.835 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.489 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 1.1 ttm180 -59.01 -39.73 82.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.843 0.354 . . . . 10.0 110.212 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.8 tp10 -68.45 -49.81 57.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.664 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.28 -30.75 69.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.654 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.6 m -57.79 -40.6 80.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.505 -0.316 . . . . 10.0 111.392 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.0 mtmt -77.65 -17.86 57.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.699 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -95.65 -29.92 14.05 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.938 0.348 . . . . 10.0 111.938 -178.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 64.9 t -94.31 -55.51 6.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.618 0.246 . . . . 10.0 111.458 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -90.95 -40.84 11.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.88 0.371 . . . . 10.0 111.039 -179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.45 9.94 34.71 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.681 -0.771 . . . . 10.0 111.94 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.1 mtt -122.83 151.72 41.41 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.444 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 11.7 ttp180 -98.79 138.48 35.88 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.979 0.418 . . . . 10.0 111.192 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.02 110.89 4.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.584 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -56.9 156.88 6.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.299 0.571 . . . . 10.0 112.003 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.38 -38.17 79.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.229 -0.896 . . . . 10.0 111.182 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.77 -31.64 51.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.839 0.352 . . . . 10.0 111.082 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -67.08 -34.04 76.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.82 -36.16 82.69 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.6 mt -66.46 -49.62 66.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.705 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.437 ' O ' ' HG ' ' A' ' 94' ' ' LEU . . . -60.12 -43.85 97.91 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.842 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.26 -32.75 85.22 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.03 -0.605 . . . . 10.0 112.096 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 8.7 ttm -69.2 -42.11 76.21 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.901 -0.407 . . . . 10.0 109.901 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 85.2 t -65.9 -36.42 77.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.656 -0.702 . . . . 10.0 110.071 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 90' ' ' GLY . 79.9 mt -68.14 -8.83 41.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.734 -0.666 . . . . 10.0 111.993 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -81.36 -20.68 40.09 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.499 0.666 . . . . 10.0 109.236 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -102.18 174.56 5.87 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.315 -0.857 . . . . 10.0 110.236 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -83.63 67.88 9.62 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.308 0.575 . . . . 10.0 109.564 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 16.4 m -141.01 161.77 37.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.4 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.0 mm -103.17 131.0 52.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.734 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -110.06 122.97 48.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.891 0.377 . . . . 10.0 111.793 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.608 ' CD ' ' HA ' ' A' ' 393' ' ' THR . 42.5 tt0 -94.72 130.08 41.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.134 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 41.6 mtm -145.34 176.94 9.19 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.707 0.289 . . . . 10.0 110.78 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.47 ' HB2' ' HG2' ' A' ' 106' ' ' GLU . 16.9 mmm180 -105.76 175.77 5.39 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.808 -0.442 . . . . 10.0 109.808 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 18.9 p -77.2 -36.65 54.69 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.757 0.313 . . . . 10.0 111.821 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -72.55 -9.4 73.81 Favored Glycine 0 N--CA 1.453 -0.23 0 CA-C-N 116.08 -0.509 . . . . 10.0 113.888 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.47 ' HG2' ' HB2' ' A' ' 103' ' ' ARG . 3.2 mm-40 -90.86 -1.29 57.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.226 0.513 . . . . 10.0 110.6 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.94 62.16 4.44 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.381 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -52.94 -45.54 67.74 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 111.884 0.327 . . . . 10.0 111.884 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -33.97 76.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.707 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 25.5 tp -70.46 -28.98 65.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.936 0.398 . . . . 10.0 110.494 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 64.8 m -70.81 -30.24 66.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.327 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.17 -15.94 63.56 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.3 0.852 . . . . 10.0 113.3 -178.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 41.1 p -72.41 -25.4 61.47 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 31.1 mt -68.18 -57.26 9.37 Favored Pre-proline 0 CA--C 1.537 0.478 0 N-CA-C 112.411 0.523 . . . . 10.0 112.411 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -62.38 -31.42 81.27 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 121.994 1.796 . . . . 10.0 111.85 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.67 -49.48 68.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.431 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.465 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 59.1 t80 -62.5 -45.74 91.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.961 0.41 . . . . 10.0 110.66 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 62.8 tp -59.77 -49.36 78.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.668 -0.697 . . . . 10.0 111.616 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 14.0 m-80 -72.41 -26.43 61.86 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.13 -26.08 67.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.7 0.286 . . . . 10.0 111.137 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 60.7 mt -60.71 -21.25 62.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.75 -179.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.7 p -79.92 -17.31 53.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.704 0.288 . . . . 10.0 111.027 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.53 6.83 59.59 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.099 -0.572 . . . . 10.0 112.802 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.92 -24.08 44.31 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.857 -0.202 . . . . 10.0 111.326 -179.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 109.21 123.85 4.81 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.342 -0.932 . . . . 10.0 113.546 179.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 68.9 t -102.15 119.05 49.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -99.73 107.13 19.13 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.894 0.378 . . . . 10.0 110.806 -179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 64.0 t -96.27 122.03 47.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.242 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 26.5 t -102.02 110.0 27.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.527 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.52 162.31 13.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.528 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 4.4 m -67.23 -40.42 84.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 111.876 0.324 . . . . 10.0 111.876 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -145.41 161.07 40.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.359 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -64.68 -24.61 67.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.892 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -59.18 -55.85 29.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.474 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 89.8 mt -73.68 -31.49 63.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.512 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.85 -52.0 67.28 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.696 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -33.8 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.417 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -59.17 -57.15 14.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.488 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.32 -29.65 67.53 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.518 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.521 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -60.24 -41.64 93.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.811 0.339 . . . . 10.0 110.69 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -89.16 -25.33 21.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.337 -0.392 . . . . 10.0 111.329 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -75.56 -43.28 49.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.79 0.329 . . . . 10.0 111.466 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.7 m-20 -90.35 -1.92 57.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.936 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 59.2 ttm-85 -60.44 -48.83 92.68 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 116.102 -0.499 . . . . 10.0 112.084 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' PRO . . . . . 0.571 ' O ' ' HB2' ' A' ' 149' ' ' PHE . 34.1 Cg_exo -61.86 -12.69 26.82 Favored 'Trans proline' 0 C--N 1.359 1.092 0 C-N-CA 122.083 1.855 . . . . 10.0 112.946 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.3 tp -88.52 -53.96 4.41 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.982 0.42 . . . . 10.0 110.322 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -70.89 -42.79 69.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.868 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.43 -10.13 59.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.803 0.335 . . . . 10.0 111.54 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.571 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 19.1 t80 -83.97 -26.01 29.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.365 0.603 . . . . 10.0 109.714 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 37.4 mt -95.47 -8.19 36.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.434 -0.803 . . . . 10.0 110.805 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 106.28 15.31 18.02 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.619 -0.8 . . . . 10.0 113.634 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 90.0 mt -101.84 136.76 41.12 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.15 0.475 . . . . 10.0 109.903 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.8 p -90.6 130.18 36.66 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.062 0.458 . . . . 10.0 111.298 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 61.4 t -102.46 120.06 51.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.379 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -111.54 139.63 15.68 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.746 -0.74 . . . . 10.0 111.701 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.2 tp -117.28 130.21 72.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.833 0.349 . . . . 10.0 110.125 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -115.26 129.75 56.72 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.11 -0.495 . . . . 10.0 109.913 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 66.0 mt -121.61 147.8 48.83 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.362 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' PRO . . . . . 0.517 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 17.9 Cg_endo -59.92 102.11 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.212 2.608 . . . . 10.0 112.658 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 110.72 4.03 28.33 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.695 -0.764 . . . . 10.0 112.611 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' MET . . . . . 0.469 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 48.1 ttm -64.33 138.97 97.6 Favored Pre-proline 0 C--N 1.327 -0.394 0 C-N-CA 122.254 0.222 . . . . 10.0 110.696 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -52.06 144.32 37.75 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.801 2.334 . . . . 10.0 112.601 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . 0.432 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.77 -48.34 93.79 Favored Pre-proline 0 CA--C 1.54 0.586 0 N-CA-C 113.054 0.761 . . . . 10.0 113.054 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.432 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.8 Cg_exo -55.51 -41.57 76.58 Favored 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 121.935 1.757 . . . . 10.0 112.39 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -69.16 -39.89 78.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.642 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.469 ' HE2' ' O ' ' A' ' 161' ' ' MET . 58.7 mttm -58.78 -45.12 90.56 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.33 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -59.94 -29.26 68.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.625 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -78.8 -43.63 24.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.919 0.39 . . . . 10.0 110.288 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.7 -38.47 91.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.377 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -78.11 -26.63 48.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.307 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.22 -11.29 59.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.178 0.513 . . . . 10.0 110.424 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -70.84 177.94 3.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.591 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -76.18 -46.31 29.08 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.597 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 49.2 mt -127.49 125.95 66.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.207 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.9 m -111.46 126.87 55.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.408 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -103.33 137.17 41.82 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -179.19 177.19 48.31 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.368 -0.92 . . . . 10.0 112.727 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -93.7 158.86 15.47 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.713 0.292 . . . . 10.0 110.835 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -68.37 -32.65 72.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.816 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -59.68 -53.93 52.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.123 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . 0.517 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.9 tp10 -68.13 -35.6 78.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.768 0.318 . . . . 10.0 110.661 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -54.85 -42.93 72.59 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.286 -0.416 . . . . 10.0 111.005 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -72.84 -41.0 50.95 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.844 -0.694 . . . . 10.0 112.147 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -64.94 -37.39 87.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 10.0 110.464 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 185' ' ' ASP . . . . . 0.468 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 15.1 m-20 -62.3 -41.76 98.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.021 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -62.13 -41.84 98.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.666 -0.697 . . . . 10.0 110.051 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 187' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' A' ' 191' ' ' MET . 67.8 mt -62.35 -45.19 94.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.828 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 58.3 mtm-85 -67.91 -38.94 83.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.888 0.375 . . . . 10.0 110.885 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -62.82 -50.95 68.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.76 -0.655 . . . . 10.0 111.618 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.22 1.66 20.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.569 0.581 . . . . 10.0 112.569 -178.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 191' ' ' MET . . . . . 0.451 ' HB2' ' O ' ' A' ' 187' ' ' LEU . 23.1 ttp -106.52 2.84 26.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.048 0.451 . . . . 10.0 110.568 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.423 ' HB1' ' HB2' ' A' ' 197' ' ' GLU . . . -73.3 167.67 20.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.199 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -105.56 -29.77 9.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.126 0.488 . . . . 10.0 110.004 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.12 144.88 35.7 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.813 179.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.77 -24.87 74.66 Favored 'Trans proline' 0 CA--C 1.527 0.163 0 C-N-CA 122.364 2.042 . . . . 10.0 112.629 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 45.1 mp0 -75.29 -10.44 59.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.361 -0.381 . . . . 10.0 111.384 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.423 ' HB2' ' HB1' ' A' ' 192' ' ' ALA . 46.1 mt-10 -89.03 -3.27 58.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.778 0.323 . . . . 10.0 110.544 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 198' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 198' ' ' ARG . 30.5 mtt85 -61.42 158.67 14.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.569 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 4.8 m -136.32 -18.41 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.756 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -88.81 177.87 6.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.15 0.5 . . . . 10.0 111.085 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -137.44 176.6 8.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.462 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.7 tmtm? -60.01 126.95 29.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.277 0.56 . . . . 10.0 111.143 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . 0.413 HD21 ' CZ ' ' A' ' 384' ' ' TYR . 14.2 mt -80.47 91.08 5.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.528 -0.76 . . . . 10.0 109.691 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 29.9 t-80 -99.91 -63.28 1.14 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.295 -0.412 . . . . 10.0 111.082 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -128.54 138.06 52.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.139 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.503 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . . . -133.37 129.55 37.58 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.476 -0.783 . . . . 10.0 109.659 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 45.7 tp -119.53 110.53 17.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.167 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 2.4 p -92.43 126.22 44.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.521 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -58.26 -65.58 0.62 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.617 -0.72 . . . . 10.0 111.269 -179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 210' ' ' GLU . . . . . 0.464 ' CD ' HH21 ' A' ' 509' ' ' ARG . 0.5 OUTLIER -112.64 113.91 26.28 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.923 0.392 . . . . 10.0 110.745 -179.83 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . 0.461 ' CG2' ' HB ' ' A' ' 391' ' ' THR . 27.6 m -76.56 -14.13 14.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.041 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 212' ' ' ASP . . . . . 0.524 ' OD2' ' HD3' ' A' ' 566' ' ' ARG . 1.1 m-20 -45.91 -78.17 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 124.061 0.851 . . . . 10.0 112.247 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.34 -47.09 9.68 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.455 -0.793 . . . . 10.0 112.17 -178.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 53.2 mt -53.25 -31.89 18.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 N-CA-C 113.876 1.065 . . . . 10.0 113.876 -177.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 10.6 mt -106.26 -58.46 1.92 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 39.1 mm -68.22 -54.46 21.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 113.207 0.817 . . . . 10.0 113.207 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -73.27 -45.04 58.11 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.798 0.666 . . . . 10.0 112.798 -177.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -73.45 1.7 9.25 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.36 0.504 . . . . 10.0 112.36 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.47 -25.37 68.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.689 0.281 . . . . 10.0 111.73 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 220' ' ' ARG . . . . . 0.475 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -114.31 19.38 16.33 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.069 -0.253 . . . . 10.0 111.306 -179.241 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 5.6 m -97.45 106.28 31.48 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 120.951 -0.3 . . . . 10.0 110.605 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 222' ' ' PRO . . . . . 0.475 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 81.7 Cg_endo -92.84 131.46 0.93 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.925 2.417 . . . . 10.0 113.202 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 223' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' A' ' 374' ' ' SER . 47.6 mt -85.56 124.02 31.64 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 83.3 mt -117.68 130.67 72.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.787 0.327 . . . . 10.0 111.663 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 20.8 pt . . . . . 0 C--N 1.329 -0.285 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 178.452 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 374' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 4.2 t -153.33 152.92 31.66 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.763 0.316 . . . . 10.0 110.519 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 14.4 tt -156.9 140.51 7.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.47 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.91 147.77 22.56 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.424 178.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -59.44 -37.97 79.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.478 0.18 . . . . 10.0 111.301 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 378' ' ' GLN . . . . . 0.42 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.5 tm0? -59.84 -39.04 83.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.305 0.574 . . . . 10.0 110.12 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -82.96 -2.49 55.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.344 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -101.12 -46.13 5.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.278 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -70.31 -20.66 62.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.169 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 42.8 mtp180 -76.54 -9.05 58.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.805 0.336 . . . . 10.0 111.031 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 80.3 mt -83.25 -19.56 36.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.016 0.436 . . . . 10.0 110.001 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . 0.503 ' CD2' ' HB3' ' A' ' 206' ' ' ALA . 49.1 m-85 -77.39 141.45 39.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.304 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -71.17 -67.61 0.5 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.154 0.502 . . . . 10.0 110.235 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -100.75 102.32 13.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.169 0.509 . . . . 10.0 110.039 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 50.1 tp -111.05 115.72 29.93 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.879 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -121.3 158.21 28.68 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.104 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -154.52 158.28 28.13 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.198 -1.001 . . . . 10.0 112.61 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 39.6 mtm -115.47 154.79 28.66 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 391' ' ' THR . . . . . 0.461 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 14.7 t -149.94 159.52 44.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.533 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -88.49 157.83 28.13 Favored Glycine 0 N--CA 1.441 -1.016 0 N-CA-C 109.99 -1.244 . . . . 10.0 109.99 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 393' ' ' THR . . . . . 0.608 ' HA ' ' CD ' ' A' ' 101' ' ' GLU . 9.5 m -56.69 99.99 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.11 0.455 . . . . 10.0 111.218 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . 0.448 ' HA ' HD21 ' A' ' 569' ' ' ASN . . . -160.11 -27.96 0.06 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.816 -0.629 . . . . 10.0 112.037 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 6.7 t70 59.26 -95.27 0.05 Allowed 'General case' 0 N--CA 1.474 0.729 0 O-C-N 123.326 0.391 . . . . 10.0 110.499 -179.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 5.7 m 55.97 -105.6 0.28 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.045 0.757 . . . . 10.0 113.045 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -84.24 25.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.118 0.414 . . . . 10.0 112.118 -177.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 398' ' ' ALA . . . . . 0.51 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -67.69 -31.02 70.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.9 0.381 . . . . 10.0 110.858 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -65.99 -18.61 65.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.587 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -83.41 -19.67 35.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.682 -0.235 . . . . 10.0 111.235 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 401' ' ' PHE . . . . . 0.51 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 17.5 m-85 -60.56 -42.02 95.74 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.909 0.337 . . . . 10.0 111.909 -179.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 6.8 m -70.39 -19.87 62.98 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.423 0.527 . . . . 10.0 112.423 -178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 26.7 m -98.82 -43.68 6.67 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.998 0.37 . . . . 10.0 111.998 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 60.4 mt -77.87 -62.01 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 112.843 0.683 . . . . 10.0 112.843 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 405' ' ' TYR . . . . . 0.42 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 81.9 m-85 -97.36 -2.7 41.83 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -177.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt 62.73 48.1 4.37 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.161 0.505 . . . . 10.0 110.427 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 16.2 mt -113.2 142.08 46.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.028 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 408' ' ' ASP . . . . . 0.458 ' OD1' ' HD2' ' A' ' 13' ' ' ARG . 9.5 t0 -80.79 166.09 21.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.599 0.238 . . . . 10.0 110.602 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 2.0 m -118.42 109.18 15.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.717 0.294 . . . . 10.0 110.953 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 42.1 t -121.6 115.91 47.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.966 0.412 . . . . 10.0 110.918 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . 0.429 ' O ' HD12 ' A' ' 18' ' ' LEU . 53.3 t -83.99 108.67 16.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.017 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 58.6 t -79.15 130.47 69.28 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.927 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.21 146.46 81.43 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.49 2.127 . . . . 10.0 111.507 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 74.3 p -89.14 149.34 23.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.809 0.337 . . . . 10.0 111.136 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -83.65 -28.16 28.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 178.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -97.87 128.26 34.57 Favored Pre-proline 0 N--CA 1.448 -0.573 0 CA-C-N 114.765 -1.107 . . . . 10.0 109.13 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.36 124.91 12.19 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.62 2.213 . . . . 10.0 113.451 -178.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 48.9 mtm -90.26 82.1 6.03 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.527 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 5.9 pt -92.31 42.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.118 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 420' ' ' ARG . . . . . 0.552 ' HA ' ' O ' ' A' ' 581' ' ' ALA . 38.5 ttp180 -73.83 137.46 43.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.413 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 83.0 mttt -93.38 95.65 9.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.248 0.547 . . . . 10.0 110.398 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -80.26 125.33 29.74 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.51 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 89.9 mt -109.43 152.08 42.5 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.259 -0.428 . . . . 10.0 109.951 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.77 160.14 42.1 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.586 2.19 . . . . 10.0 112.895 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -81.72 119.6 24.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.568 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 12.6 mt -99.87 102.75 14.25 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.241 0.543 . . . . 10.0 110.661 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 6.0 t -94.65 125.49 47.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.817 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 428' ' ' TYR . . . . . 0.497 ' O ' ' HG2' ' A' ' 590' ' ' MET . 2.7 m-85 -104.29 179.86 4.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.636 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 28.4 mmm -73.54 -76.78 0.12 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.682 0.277 . . . . 10.0 111.383 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 64.4 p -88.26 159.75 17.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.971 0.415 . . . . 10.0 111.389 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.79 -31.5 70.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.624 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -61.63 -38.05 86.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.93 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 433' ' ' GLU . . . . . 0.425 ' HG2' ' HG3' ' A' ' 614' ' ' PRO . 31.8 mt-10 -65.58 -39.42 91.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.039 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -59.53 -48.5 81.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.948 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 41.1 mm -61.81 -43.38 97.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.458 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -56.67 -44.7 81.66 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.709 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.36 -38.91 91.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.732 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 92.4 mt -62.47 -49.91 81.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.658 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 47.9 mm -58.45 -43.25 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.268 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -63.13 -44.81 94.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.717 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . 0.606 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 14.1 t70 -63.56 -44.88 92.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.775 0.321 . . . . 10.0 110.326 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 54.8 mt -59.9 -42.17 88.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.378 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -57.3 -42.8 82.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.5 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 444' ' ' GLU . . . . . 0.41 ' CD ' ' HZ2' ' A' ' 448' ' ' LYS . 0.1 OUTLIER -62.18 -41.71 98.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.408 179.417 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.606 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 15.7 mmt180 -68.25 -39.63 82.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.485 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 13.3 m -62.94 -37.15 85.88 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.773 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.12 71.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.035 -0.529 . . . . 10.0 111.363 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 448' ' ' LYS . . . . . 0.41 ' HZ2' ' CD ' ' A' ' 444' ' ' GLU . 47.7 mttp -85.48 -19.4 31.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.215 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 89.41 33.55 9.29 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.67 -0.776 . . . . 10.0 111.321 -178.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 450' ' ' GLN . . . . . 0.526 ' OE1' ' HD2' ' A' ' 445' ' ' ARG . 60.2 tt0 -105.37 129.58 24.51 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 120.432 0.158 . . . . 10.0 110.836 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.28 141.71 63.66 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.683 2.255 . . . . 10.0 111.462 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 51.7 t -121.94 128.11 75.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.396 -178.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 57.1 tp -115.07 109.1 17.55 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 18.9 t -95.93 127.93 47.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.358 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -110.26 109.86 2.74 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.887 -0.673 . . . . 10.0 112.391 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 15.9 p -105.06 146.84 28.56 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.397 -0.223 . . . . 10.0 110.397 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 24.3 pt -94.13 -17.66 7.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.829 0.347 . . . . 10.0 111.294 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 23.2 m -130.75 137.85 49.68 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.339 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 39.4 mt -60.4 -32.24 50.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.091 0.472 . . . . 10.0 110.886 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.67 -33.74 71.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.712 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 -33.8 47.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.512 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.3 m -61.33 -43.74 98.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.545 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -68.62 -36.79 79.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.16 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.48 -53.71 50.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.81 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 10.2 p -65.04 -32.7 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 120.775 0.321 . . . . 10.0 110.322 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 47.0 t -65.0 -43.49 92.37 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.464 -0.569 . . . . 10.0 109.464 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -60.4 -49.38 77.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.661 -0.699 . . . . 10.0 110.294 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . 0.418 ' CD ' ' HZ2' ' A' ' 471' ' ' LYS . 10.7 mm-40 -62.16 -38.89 90.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.706 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 24.0 mt -63.16 -38.15 90.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.078 0.466 . . . . 10.0 110.279 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.1 m -72.09 -34.38 68.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.762 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.418 ' HZ2' ' CD ' ' A' ' 468' ' ' GLU . 35.3 ttpt -63.57 -36.91 85.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.437 -0.801 . . . . 10.0 110.004 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -79.45 -30.78 42.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.743 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 97.91 34.31 5.49 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.955 -0.641 . . . . 10.0 112.281 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 70.6 mt -102.71 127.98 55.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.641 0.258 . . . . 10.0 110.849 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -63.63 129.31 39.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.141 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -155.38 153.74 30.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.832 0.349 . . . . 10.0 111.195 -179.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -130.48 132.87 45.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.033 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 19.2 t -100.03 130.0 49.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.356 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 36.6 mt -75.76 94.17 3.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.856 0.36 . . . . 10.0 110.574 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -78.66 108.13 11.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.636 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -65.2 -7.69 13.98 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.888 0.699 . . . . 10.0 112.888 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -88.05 -11.44 47.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.988 0.423 . . . . 10.0 110.254 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -126.66 90.95 3.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.036 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -60.72 -30.67 70.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.3 -179.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.97 -37.25 87.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.069 0.461 . . . . 10.0 109.939 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.66 -38.71 64.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.431 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -52.32 -60.91 2.65 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.692 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -59.63 -36.67 76.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.243 -0.89 . . . . 10.0 111.953 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.41 86.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.876 0.37 . . . . 10.0 111.529 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 83.1 mt -70.91 -45.99 70.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.241 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 71.6 t -58.88 -35.26 55.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 120.836 0.351 . . . . 10.0 111.305 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -59.29 -33.21 70.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.998 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -121.11 24.37 10.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.642 0.258 . . . . 10.0 111.165 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.77 -19.38 62.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.042 0.449 . . . . 10.0 111.198 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -97.88 14.44 62.81 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.858 -0.687 . . . . 10.0 112.023 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -73.4 143.04 82.23 Favored Pre-proline 0 C--N 1.327 -0.407 0 N-CA-C 110.07 -0.345 . . . . 10.0 110.07 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.98 123.8 14.01 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.591 2.194 . . . . 10.0 113.167 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.8 17.65 7.59 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -91.8 113.71 26.05 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.017 0.437 . . . . 10.0 110.315 179.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 33.0 t -92.3 112.05 25.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.598 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 12.0 m -108.35 131.62 54.56 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.526 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 55.5 mt -109.84 117.6 55.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 120.827 0.346 . . . . 10.0 110.311 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -111.95 122.84 48.89 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.811 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 8.8 m -103.28 124.15 48.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.19 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 52.88 68.71 0.79 Allowed 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.864 0.728 . . . . 10.0 110.763 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.0 132.87 36.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.838 -179.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.57 177.02 7.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.066 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -67.09 163.19 45.45 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.125 -0.56 . . . . 10.0 112.486 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.464 HH21 ' CD ' ' A' ' 210' ' ' GLU . 98.5 mtt180 64.83 -92.98 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 122.849 0.46 . . . . 10.0 111.016 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 86.43 141.16 6.22 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.941 -0.647 . . . . 10.0 112.252 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.84 137.06 58.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.762 0.315 . . . . 10.0 110.835 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.17 116.48 8.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.641 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 59.2 mt -80.32 123.12 36.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.557 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 3.4 t -83.31 133.51 28.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.601 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 52.0 mt -70.8 130.49 41.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.566 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 84.65 10.15 79.91 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.103 -0.799 . . . . 10.0 111.103 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 93.55 -175.15 35.57 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 110.432 -1.067 . . . . 10.0 110.432 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 13.0 p -124.68 111.44 15.58 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 117.517 0.659 . . . . 10.0 110.539 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 41.7 p-90 -61.51 -20.2 62.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.049 0.452 . . . . 10.0 110.096 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -59.63 -40.95 89.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.421 -0.809 . . . . 10.0 110.277 178.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -74.63 -32.44 62.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.755 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -70.43 -45.19 66.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.91 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 27.7 m -69.3 -28.36 38.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.966 0.412 . . . . 10.0 110.265 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -75.11 -22.96 57.88 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.498 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -78.29 -24.13 46.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.009 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 63.0 mt -75.7 145.56 40.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.741 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -75.7 -46.0 33.62 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.018 0.437 . . . . 10.0 110.295 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -138.15 84.39 20.61 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.263 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 529' ' ' PRO . . . . . 0.448 ' HA ' ' OE1' ' A' ' 533' ' ' GLN . 64.6 Cg_endo -78.88 104.15 1.76 Allowed 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.758 2.305 . . . . 10.0 112.66 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 72.2 p -82.4 175.07 10.53 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.309 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.11 -39.88 72.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.545 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 57.9 mp0 -60.89 -43.01 99.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.142 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . 0.448 ' OE1' ' HA ' ' A' ' 529' ' ' PRO . 52.4 mt-30 -69.72 -51.14 37.0 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.169 -0.468 . . . . 10.0 110.727 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.04 -42.8 87.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 10.0 111.024 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -64.13 -40.61 96.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.036 0.446 . . . . 10.0 110.45 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.456 ' HG3' ' N ' ' A' ' 537' ' ' ILE . 0.0 OUTLIER -67.1 -43.22 83.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.478 179.804 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . 0.456 ' N ' ' HG3' ' A' ' 536' ' ' LYS . 77.2 mt -64.21 -41.83 93.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-N 116.398 -0.365 . . . . 10.0 110.755 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -59.84 -41.15 90.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.799 0.333 . . . . 10.0 110.547 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -67.36 -45.63 75.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.384 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -42.31 99.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.348 0.594 . . . . 10.0 110.028 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 66.4 t90 -63.81 -38.72 92.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.274 -0.875 . . . . 10.0 110.59 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 31.7 tp60 -56.37 -44.41 80.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.551 -0.295 . . . . 10.0 110.591 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 16.9 t -59.77 -46.7 93.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.033 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -65.49 -44.6 86.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.572 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -57.88 -52.72 64.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.147 -0.933 . . . . 10.0 111.922 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.11 -27.12 63.36 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.657 -178.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.7 91.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.994 0.426 . . . . 10.0 110.065 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 64.7 t -65.5 -43.74 94.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.072 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 24.9 mt -62.29 -41.32 98.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.191 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.85 -36.06 81.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.808 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.16 -38.38 82.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.963 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 148.26 6.74 0.24 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.379 -0.915 . . . . 10.0 113.584 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 82.75 -164.24 42.85 Favored Glycine 0 CA--C 1.516 0.103 0 C-N-CA 120.762 -0.732 . . . . 10.0 112.062 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 36.0 tp -74.06 118.09 16.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.27 0.557 . . . . 10.0 110.864 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -91.45 119.6 31.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.807 0.337 . . . . 10.0 110.808 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 29.9 mm -104.19 132.07 51.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.554 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 557' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.1 mt -128.19 123.04 59.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.972 0.415 . . . . 10.0 110.052 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -106.02 129.72 9.88 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.741 -0.742 . . . . 10.0 111.667 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 23.7 p -86.13 -34.13 20.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.233 0.54 . . . . 10.0 110.584 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -134.14 162.28 32.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.335 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -109.46 138.68 45.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.511 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 66.2 t60 -86.58 141.15 29.22 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -52.21 -63.85 1.01 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.607 0.567 . . . . 10.0 111.037 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.64 131.9 41.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.112 178.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 565' ' ' ARG . . . . . 0.444 ' HA ' ' HB3' ' A' ' 568' ' ' ASP . 9.3 tpt180 -64.1 -19.58 65.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.381 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 566' ' ' ARG . . . . . 0.524 ' HD3' ' OD2' ' A' ' 212' ' ' ASP . 9.9 ttm180 -52.08 -64.64 0.75 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.528 -179.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 25.8 mt -75.59 -28.28 19.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.965 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 568' ' ' ASP . . . . . 0.444 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 20.5 t70 -61.73 -49.28 77.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.245 0.545 . . . . 10.0 111.005 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 569' ' ' ASN . . . . . 0.448 HD21 ' HA ' ' A' ' 394' ' ' ALA . 40.2 t30 -73.12 -31.6 64.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.473 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -67.94 -29.45 68.51 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.773 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 32.1 tp -66.89 -34.08 77.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.443 0.639 . . . . 10.0 109.474 178.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 26.5 ttp180 -83.3 -22.82 32.84 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.15 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -71.88 12.94 2.66 Favored Glycine 0 CA--C 1.522 0.5 0 CA-C-N 115.862 -0.608 . . . . 10.0 113.972 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 574' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 1.5 mmt180 -77.15 -35.48 56.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 117.277 0.538 . . . . 10.0 109.806 179.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.576 ' OG ' ' HA2' ' A' ' 582' ' ' GLY . 41.2 t -94.96 165.29 12.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.422 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 576' ' ' GLY . . . . . 0.57 ' HA3' ' O ' ' A' ' 580' ' ' ASP . . . 76.64 39.07 30.53 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.718 -0.753 . . . . 10.0 111.281 -179.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -111.07 136.71 49.69 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.56 0.219 . . . . 10.0 110.488 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 59.93 21.65 10.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.905 -0.589 . . . . 10.0 112.423 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 105.31 1.75 41.17 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.404 -0.903 . . . . 10.0 113.338 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 580' ' ' ASP . . . . . 0.57 ' O ' ' HA3' ' A' ' 576' ' ' GLY . 2.8 t70 -66.06 148.01 52.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.726 0.298 . . . . 10.0 110.316 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 581' ' ' ALA . . . . . 0.552 ' O ' ' HA ' ' A' ' 420' ' ' ARG . . . -84.3 -85.54 0.13 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.79 -0.819 . . . . 10.0 108.79 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . 0.576 ' HA2' ' OG ' ' A' ' 575' ' ' SER . . . 83.77 174.71 50.54 Favored Glycine 0 N--CA 1.439 -1.133 0 C-N-CA 120.59 -0.814 . . . . 10.0 113.396 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -153.64 121.44 6.0 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -97.97 110.34 22.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.872 0.367 . . . . 10.0 110.985 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 585' ' ' ARG . . . . . 0.45 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 3.3 tpm_? -119.36 112.96 20.08 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.714 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -106.9 137.68 44.49 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.975 0.417 . . . . 10.0 111.012 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -124.75 141.93 51.76 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 8.6 mt -142.71 171.32 14.21 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.923 0.392 . . . . 10.0 110.863 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.39 155.56 48.23 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.988 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 590' ' ' MET . . . . . 0.497 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 90.7 mmm -71.18 -5.37 31.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.771 0.32 . . . . 10.0 111.131 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -99.33 -4.39 31.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.408 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -73.13 149.73 42.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.369 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -60.25 -17.25 40.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.525 -0.761 . . . . 10.0 112.224 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 20.4 tp -64.2 -28.35 69.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.831 0.348 . . . . 10.0 110.842 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.451 ' SD ' ' HB3' ' A' ' 604' ' ' SER . 14.8 mmt -81.75 5.37 18.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.984 0.421 . . . . 10.0 111.297 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -97.9 -15.92 19.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.439 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 42.6 pt -86.41 11.34 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.188 0.518 . . . . 10.0 110.764 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -90.25 22.56 3.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.799 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.1 -58.42 0.57 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.684 0.794 . . . . 10.0 111.842 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.2 m -127.53 136.62 51.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.746 0.307 . . . . 10.0 110.567 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.11 -20.3 63.9 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.249 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 602' ' ' ARG . . . . . 0.422 ' HD3' ' O ' ' A' ' 602' ' ' ARG . 0.9 OUTLIER -64.64 -33.7 76.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.75 -179.793 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 16.2 t -67.57 -50.19 63.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.177 0.513 . . . . 10.0 109.752 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 604' ' ' SER . . . . . 0.451 ' HB3' ' SD ' ' A' ' 595' ' ' MET . 0.0 OUTLIER -65.93 -35.8 81.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.08 179.173 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -61.25 -28.73 69.68 Favored Glycine 0 N--CA 1.45 -0.433 0 CA-C-N 115.788 -0.642 . . . . 10.0 112.637 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 14.9 tpt -66.6 -32.21 73.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.191 0.52 . . . . 10.0 110.253 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 67.5 mtt -74.12 -11.27 60.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.698 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -77.39 -0.61 26.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.08 0.467 . . . . 10.0 110.686 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -108.31 22.7 15.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.527 179.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.68 -12.29 57.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.436 -0.802 . . . . 10.0 111.235 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 93.67 -57.16 2.27 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.949 -0.643 . . . . 10.0 112.339 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 66.85 -79.34 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.27 0.628 . . . . 10.0 112.219 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? 67.62 95.4 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.34 0 O-C-N 123.67 0.606 . . . . 10.0 110.172 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 614' ' ' PRO . . . . . 0.425 ' HG3' ' HG2' ' A' ' 433' ' ' GLU . 53.6 Cg_exo -51.79 110.62 0.45 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.211 2.607 . . . . 10.0 113.412 -178.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 117.98 -22.21 9.92 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.012 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -92.79 98.44 11.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.189 0.518 . . . . 10.0 110.449 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -95.06 88.11 5.12 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.489 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -86.45 -12.2 11.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.777 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 69.62 142.41 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.66 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -144.13 93.25 6.04 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.337 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -62.73 -29.92 77.76 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.15 2.567 . . . . 10.0 113.805 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 64.8 p-90 -68.82 -17.72 64.05 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.055 0.391 . . . . 10.0 112.055 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 44.2 t -66.07 -51.25 62.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.779 0.323 . . . . 10.0 110.3 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 27.9 m -59.03 -34.65 72.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.233 0.54 . . . . 10.0 110.437 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -68.04 -41.93 81.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.988 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -65.45 -43.65 89.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.523 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 92.1 mt -63.34 -45.11 99.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.686 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -59.49 -42.68 92.71 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.914 0.388 . . . . 10.0 110.721 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -68.5 -39.41 81.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.351 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -62.11 -39.68 93.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.969 0.414 . . . . 10.0 110.154 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -61.46 -46.39 90.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.626 178.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.7 -34.09 69.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.432 -0.803 . . . . 10.0 110.915 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -62.75 -48.15 80.45 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.95 0.405 . . . . 10.0 110.519 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 48.1 t -62.97 -43.29 98.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.477 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -64.54 -43.23 94.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.676 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 49.9 m -62.91 -32.89 74.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.991 0.424 . . . . 10.0 110.161 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -67.89 -42.81 80.62 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -65.59 -40.29 92.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.302 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -59.38 -40.57 86.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.255 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 640' ' ' ASP . . . . . 0.565 ' O ' ' HG2' ' A' ' 644' ' ' GLN . 33.1 t70 -60.11 -43.59 95.48 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 179.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 58.2 mt -66.11 -43.03 92.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.159 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 642' ' ' ARG . . . . . 0.418 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 7.6 mtm-85 -59.77 -40.71 89.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.731 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 19.7 ttpp -60.85 -41.98 96.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.494 -0.776 . . . . 10.0 110.599 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 644' ' ' GLN . . . . . 0.565 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 9.8 mm100 -64.07 -43.33 95.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.577 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 87.3 mt -63.97 -44.14 93.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.198 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 646' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 97.1 mt -66.09 -30.24 70.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.277 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 647' ' ' GLU . . . . . 0.407 ' CD ' ' HZ3' ' A' ' 804' ' ' LYS . 1.0 OUTLIER -61.07 -27.79 68.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.24 -179.75 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -100.61 -32.41 10.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.888 0.375 . . . . 10.0 110.731 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -35.69 80.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.234 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -69.73 -22.98 63.34 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.988 0.423 . . . . 10.0 110.897 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 651' ' ' VAL . . . . . 0.425 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 48.5 t -64.71 -47.18 89.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.163 -0.68 . . . . 10.0 109.163 178.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -70.7 -28.49 64.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.517 -0.765 . . . . 10.0 109.503 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -60.79 -52.31 65.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.617 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -60.04 -45.95 91.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.937 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 655' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 35.5 mt-30 -62.2 -41.73 98.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.626 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 11.4 ttp-105 -63.8 -48.53 76.52 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 52.0 ttp180 -57.54 -44.92 85.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.91 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.19 -53.55 51.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.902 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 8.5 tp -66.21 -33.31 62.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 121.028 -0.269 . . . . 10.0 111.356 -178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -69.86 -33.49 72.33 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 110.257 -0.275 . . . . 10.0 110.257 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 57.1 m -65.08 -39.13 92.78 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.78 -44.22 74.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.712 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 44.5 ttt-85 -62.97 -37.84 88.71 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.238 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -68.6 -35.71 77.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.325 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.62 -51.51 64.9 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 52.0 mt -65.91 -18.25 65.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.601 -0.727 . . . . 10.0 110.472 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 47.6 tp -80.42 -44.43 19.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.457 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.49 -43.15 60.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.991 -0.549 . . . . 10.0 112.351 -178.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 34.3 m -67.68 149.31 11.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.203 0.525 . . . . 10.0 111.73 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.47 -31.71 11.85 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.672 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -101.61 146.47 27.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.125 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 9.5 p -143.47 10.75 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.958 0.409 . . . . 10.0 110.69 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.85 -43.61 86.01 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.036 0.446 . . . . 10.0 110.942 -179.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -62.33 -50.34 72.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.84 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 1.8 m -56.95 -46.41 82.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.022 -0.536 . . . . 10.0 111.33 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 46.4 mm -61.73 -44.23 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.942 0.401 . . . . 10.0 110.932 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -67.27 -41.41 85.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.459 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 40.2 m -62.35 -44.98 95.21 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 47.2 pt -74.79 -26.38 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 C-N-CA 120.535 -0.466 . . . . 10.0 110.669 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -59.63 -42.04 91.82 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.209 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -60.88 -47.13 87.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.657 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.75 -47.7 77.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.152 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 81.0 t -58.66 -51.91 66.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.314 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -60.57 -42.84 97.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.126 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.1 tttm -63.39 -49.77 72.49 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 121.16 -0.216 . . . . 10.0 110.554 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.92 -41.85 88.3 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.44 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 23.9 m -65.41 -40.77 93.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.022 0.439 . . . . 10.0 110.597 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 84.1 mt -67.43 -42.2 86.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.487 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -57.23 -24.96 58.14 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 122.755 0.422 . . . . 10.0 111.946 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -75.63 -28.45 58.82 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -108.21 -24.64 11.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.096 0.474 . . . . 10.0 111.161 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 84.6 mt -132.91 99.89 14.87 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.41 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -62.14 139.91 80.89 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.427 2.085 . . . . 10.0 111.571 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.82 113.88 1.59 Allowed 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.813 2.342 . . . . 10.0 112.855 -179.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 58.13 67.37 0.96 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.215 -0.902 . . . . 10.0 111.942 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 14.3 p -127.35 177.81 6.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.199 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 18.6 mt -75.88 154.54 35.99 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.18 -26.98 65.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.378 . . . . 10.0 111.598 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -67.06 -14.23 62.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.554 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -104.96 7.43 34.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.626 -0.261 . . . . 10.0 111.041 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 701' ' ' TRP . . . . . . . . . . . . . 41.7 m0 -101.23 106.3 17.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.742 0.306 . . . . 10.0 111.099 -179.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 58.7 t0 -82.51 77.58 9.26 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 703' ' ' ILE . . . . . 0.493 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 24.2 mm -57.76 -49.9 91.17 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.652 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 704' ' ' PRO . . . . . 0.493 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 32.2 Cg_exo -60.14 -42.0 46.9 Favored 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 121.894 1.729 . . . . 10.0 111.718 179.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -63.81 -44.8 95.67 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.622 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 55.6 tp -65.06 -40.99 95.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.189 -0.301 . . . . 10.0 110.189 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -62.04 -48.11 81.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.512 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -59.42 -42.23 91.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.02 -0.537 . . . . 10.0 110.235 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -63.46 -43.44 97.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.548 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 49.6 mt -64.07 -42.62 96.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.297 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 14.3 mtpp -76.1 -6.05 49.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.881 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -111.84 -56.54 2.37 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.484 0.55 . . . . 10.0 112.484 -178.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -83.73 -19.22 35.56 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.879 0.696 . . . . 10.0 112.879 -177.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -123.02 -8.92 8.27 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.465 -0.494 . . . . 10.0 112.123 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.98 21.79 12.59 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.019 0.438 . . . . 10.0 110.758 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 12.8 tp -97.65 109.88 22.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.407 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -91.47 92.32 8.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.918 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 40.0 mt -123.4 122.7 26.65 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.399 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -82.36 77.99 3.57 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.8 2.334 . . . . 10.0 112.186 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 44.7 mt -61.43 -37.24 77.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.197 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.45 4.35 4.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.883 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -109.18 -0.88 19.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.865 0.364 . . . . 10.0 110.211 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 15.9 m0 -114.44 -44.92 3.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.676 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 11.1 tp -60.33 -16.51 35.47 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.358 0.873 . . . . 10.0 113.358 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -90.27 -32.67 16.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.994 0.426 . . . . 10.0 111.075 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 726' ' ' LYS . . . . . 0.507 ' O ' ' HD3' ' A' ' 728' ' ' PRO . 40.3 mttp -93.34 -23.19 18.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.925 -178.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -109.36 94.74 16.54 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-O 120.752 0.311 . . . . 10.0 110.725 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . 0.507 ' HD3' ' O ' ' A' ' 726' ' ' LYS . 11.7 Cg_exo -71.66 -16.81 30.06 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.939 2.426 . . . . 10.0 112.41 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.28 21.42 17.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.111 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.73 -28.35 66.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 731' ' ' HIS . . . . . 0.404 ' HB3' ' H ' ' A' ' 732' ' ' GLU . 0.2 OUTLIER 61.71 -134.58 0.57 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.44 179.312 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 732' ' ' GLU . . . . . 0.404 ' H ' ' HB3' ' A' ' 731' ' ' HIS . 0.0 OUTLIER -128.35 -56.25 1.24 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.066 0.46 . . . . 10.0 110.564 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 733' ' ' GLU . . . . . 0.5 ' HG2' ' N ' ' A' ' 734' ' ' THR . 20.2 pm0 -60.67 -38.95 86.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.758 -0.655 . . . . 10.0 111.8 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 734' ' ' THR . . . . . 0.5 ' N ' ' HG2' ' A' ' 733' ' ' GLU . 0.1 OUTLIER -65.68 -27.59 68.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.974 0.416 . . . . 10.0 110.794 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 50.2 tp -69.04 -40.41 78.6 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 -64.38 -41.15 96.84 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.858 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -60.21 -40.82 91.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.701 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 21.6 mmm-85 -61.15 -50.64 72.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.795 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 55.4 mt -60.38 -43.6 94.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.652 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 16.5 tp -63.93 -50.95 66.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.001 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.83 86.54 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.24 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -64.95 -39.51 93.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.744 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 24.5 p -63.44 -33.54 75.77 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.062 0.458 . . . . 10.0 110.033 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 744' ' ' ILE . . . . . 0.525 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 66.7 mt -70.41 -43.98 77.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -48.93 79.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.34 -0.846 . . . . 10.0 111.114 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.32 -36.66 77.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.065 0.46 . . . . 10.0 110.261 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.48 -43.22 99.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.332 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 748' ' ' GLN . . . . . 0.525 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 23.4 mt-30 -58.75 -37.93 77.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.748 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -46.01 90.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.477 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -65.5 -37.56 87.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.08 0.467 . . . . 10.0 109.888 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -64.1 -41.89 97.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.222 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -64.52 -29.82 70.85 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 54.9 t -78.74 -48.96 21.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.824 0.345 . . . . 10.0 111.37 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 38.9 t -74.07 -52.04 21.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.961 0.41 . . . . 10.0 111.637 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 139.77 141.61 4.09 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.301 -0.719 . . . . 10.0 111.301 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 756' ' ' ALA . . . . . 0.492 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -60.94 -63.2 1.38 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.783 0.291 . . . . 10.0 111.458 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -60.19 -37.87 81.54 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.729 0.299 . . . . 10.0 110.701 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 14.6 tpt -61.19 -45.21 95.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.27 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 45.0 mmm -65.23 -41.34 94.48 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.49 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.4 mmp_? -59.35 -41.4 89.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.255 0.55 . . . . 10.0 109.997 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -70.48 -33.86 71.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.829 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -65.24 -52.41 54.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.542 -0.754 . . . . 10.0 109.772 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -58.91 -45.31 90.64 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.175 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 764' ' ' LYS . . . . . 0.402 ' O ' ' HG ' ' A' ' 768' ' ' LEU . 50.9 tttp -56.11 -47.7 77.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.163 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -68.64 -38.88 86.53 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 121.003 -0.617 . . . . 10.0 112.079 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 30.2 t -61.89 -45.41 98.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 110.523 -0.177 . . . . 10.0 110.523 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 37.8 mtp -59.2 -46.13 89.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.73 -0.213 . . . . 10.0 110.516 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 768' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 764' ' ' LYS . 85.1 mt -64.46 -47.92 77.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.494 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -58.42 -46.58 86.19 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.94 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 19.3 m -63.7 -38.77 92.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.925 0.393 . . . . 10.0 110.563 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.65 -50.56 72.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.788 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.46 -29.95 71.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.702 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 773' ' ' SER . . . . . 0.47 ' HA ' ' HZ3' ' A' ' 776' ' ' LYS . 69.1 m -68.05 -43.86 77.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.911 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.16 -25.44 34.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.731 0.301 . . . . 10.0 111.109 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 27.2 t-105 -63.68 -49.45 73.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.565 -0.289 . . . . 10.0 111.3 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.47 ' HZ3' ' HA ' ' A' ' 773' ' ' SER . 8.5 ptpp? -59.58 -39.26 83.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.81 0.338 . . . . 10.0 110.547 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -68.42 -39.93 81.4 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.204 0.526 . . . . 10.0 109.985 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 68.0 t60 -62.24 -38.17 88.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.274 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 80.7 mt -65.41 -47.16 77.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.488 179.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -63.81 -46.16 86.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.759 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -60.56 -41.62 94.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.128 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 51.1 mmm -63.16 -42.33 99.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.734 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -68.31 -36.64 79.62 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.099 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -69.69 -32.99 71.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.43 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.55 -37.29 60.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.962 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -60.96 -50.79 71.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.35 -0.841 . . . . 10.0 111.075 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 . . . . . 0 C--N 1.329 -0.285 0 CA-C-O 120.944 0.402 . . . . 10.0 110.986 -179.814 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 CA--C 1.529 0.242 0 CA-C-O 121.04 0.35 . . . . 10.0 112.0 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -81.46 155.39 25.86 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 73.09 -49.43 0.7 Allowed 'General case' 0 N--CA 1.468 0.448 0 O-C-N 123.578 0.549 . . . . 10.0 111.166 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 802' ' ' GLU . . . . . 0.447 ' OE2' ' HD3' ' A' ' 805' ' ' ARG . 3.1 tp10 -65.16 -47.65 76.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.069 0.461 . . . . 10.0 109.83 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -61.8 -34.73 76.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.87 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 804' ' ' LYS . . . . . 0.407 ' HZ3' ' CD ' ' A' ' 647' ' ' GLU . 95.2 mttt -63.63 -36.24 83.17 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.922 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 805' ' ' ARG . . . . . 0.447 ' HD3' ' OE2' ' A' ' 802' ' ' GLU . 44.8 mtp180 -58.5 -43.59 89.1 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.153 0.502 . . . . 10.0 109.718 178.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.6 -44.79 95.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.964 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 6.2 m -61.02 -39.82 91.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.713 -0.676 . . . . 10.0 110.966 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -71.99 -38.01 69.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.865 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 40.2 m -62.94 -39.66 95.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.06 0.457 . . . . 10.0 109.946 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 18.9 ttm -66.74 -37.21 84.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.086 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 811' ' ' PHE . . . . . 0.419 ' O ' ' HG ' ' A' ' 815' ' ' LEU . 27.4 t80 -65.7 -41.98 91.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.348 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.29 -45.88 92.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.654 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.72 -37.27 85.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.13 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 22.9 ttt -62.83 -44.31 96.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.597 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 815' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 811' ' ' PHE . 94.1 mt -62.06 -41.53 98.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.846 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -64.21 -45.95 86.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.241 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 11.7 m -65.02 -35.8 82.34 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.992 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 63.6 tp -56.07 -51.01 69.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.639 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -62.49 -42.09 99.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.225 0.536 . . . . 10.0 110.399 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -58.88 -57.45 12.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.196 -0.911 . . . . 10.0 111.629 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -59.97 -42.95 95.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.076 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 30.4 t -58.44 -52.55 57.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.561 0.219 . . . . 10.0 110.614 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 35.4 mm -63.77 -41.24 91.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.695 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 37.1 t -56.83 -49.42 75.47 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.736 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 16.7 m -63.16 -37.96 89.28 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.323 -0.398 . . . . 10.0 111.75 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 93.5 mt -75.56 -17.03 60.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.553 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 16.3 m -95.94 -41.75 8.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.997 0.427 . . . . 10.0 110.627 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -77.34 -1.01 27.78 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.867 -0.606 . . . . 10.0 112.453 -178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.0 p -64.59 118.37 6.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.439 0.638 . . . . 10.0 110.065 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -80.44 106.16 12.25 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.237 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 C--N 1.319 -0.726 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.148 179.526 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 . . . . . 0 C--O 1.235 0.317 0 CA-C-O 120.821 0.343 . . . . 10.0 110.864 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 142.58 165.16 10.46 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.842 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.411 ' H ' ' HD3' ' A' ' 16' ' ' ARG . 0.7 OUTLIER -57.28 133.45 55.11 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 122.413 0.285 . . . . 10.0 110.566 179.661 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.499 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 5.1 mmp_? -58.52 137.72 57.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.739 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 68.17 -83.67 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.328 -0.851 . . . . 10.0 112.543 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -41.08 -68.13 0.2 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.497 1.295 . . . . 10.0 114.497 -177.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.411 ' HD3' ' H ' ' A' ' 12' ' ' SER . 44.0 ttt180 -64.32 -43.01 96.01 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.48 0.548 . . . . 10.0 112.48 -177.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.89 -39.34 88.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.15 0.426 . . . . 10.0 112.15 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.5 mt -61.17 -53.94 50.66 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.08 0.4 . . . . 10.0 112.08 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -66.66 -24.22 66.25 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.57 -0.452 . . . . 10.0 110.953 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.07 -42.44 56.89 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 60.5 mtt -68.5 -32.3 72.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.817 -0.628 . . . . 10.0 109.667 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -57.5 -32.96 67.54 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.453 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -63.36 -43.72 96.85 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.182 0.515 . . . . 10.0 109.843 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.64 -41.94 91.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.391 -0.822 . . . . 10.0 109.943 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.5 t -60.72 -37.07 74.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.681 -0.69 . . . . 10.0 110.117 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -63.24 -43.12 98.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.66 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 82.3 mt -61.95 -45.57 98.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.986 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 55.8 mt -59.66 -40.29 81.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.346 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -63.84 -33.55 75.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.862 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.436 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -82.56 -26.94 31.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.479 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 13.4 ttt -83.3 -16.42 46.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.69 0.281 . . . . 10.0 110.814 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.458 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 27.5 tt0 -59.49 -51.93 77.77 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 116.352 -0.385 . . . . 10.0 111.728 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.458 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 51.8 Cg_exo -56.28 -28.3 70.98 Favored 'Trans proline' 0 C--N 1.361 1.214 0 C-N-CA 121.844 1.696 . . . . 10.0 111.949 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -73.1 -42.09 63.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.835 -0.62 . . . . 10.0 109.908 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 25.4 mmt -66.31 -27.83 68.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.435 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 83.7 mt-10 -62.48 -23.48 66.94 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.839 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 mtpt -86.17 -14.32 44.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.069 0.461 . . . . 10.0 110.589 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 7.8 mp -87.48 140.51 29.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.321 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.6 p -76.28 171.67 14.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.649 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.04 -38.24 82.18 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.894 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -70.55 -32.01 69.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.554 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -66.94 -34.74 78.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.276 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.2 mt -62.93 -44.79 95.12 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.896 -0.779 . . . . 10.0 108.896 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -63.4 -28.05 69.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.926 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.65 -34.3 72.65 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 115.421 -0.808 . . . . 10.0 111.449 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -68.89 -39.34 79.82 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.6 m -60.21 -44.24 95.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.103 0.478 . . . . 10.0 109.915 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -38.32 88.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.653 -0.703 . . . . 10.0 110.055 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -60.5 -40.07 90.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.375 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -62.77 -43.42 98.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.321 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -58.48 -46.83 85.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.357 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.563 ' O ' ' HG3' ' A' ' 56' ' ' LYS . . . -68.83 -44.39 73.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.302 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 33.5 mtp180 -58.23 -40.27 81.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.786 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 72.6 mt -62.76 -38.5 90.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 10.0 110.626 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -72.45 -23.93 61.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.301 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.563 ' HG3' ' O ' ' A' ' 52' ' ' ALA . 20.5 mtpp -83.22 -66.96 0.83 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.77 0.319 . . . . 10.0 110.422 179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 178.22 67.07 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 121.071 -0.585 . . . . 10.0 111.918 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -133.39 150.6 51.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.809 0.338 . . . . 10.0 110.203 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.1 t -100.15 133.66 42.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.892 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' ' 118' ' ' LEU . 17.1 tp -60.35 -41.41 93.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.096 0.474 . . . . 10.0 110.608 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.7 mp0 -68.04 -8.99 42.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.255 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -100.15 -15.18 18.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.38 0.61 . . . . 10.0 109.963 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 55.4 mt -89.1 -5.49 57.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.516 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.487 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 66.6 mt -49.54 -51.01 62.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 113.256 0.835 . . . . 10.0 113.256 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.487 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 32.1 Cg_exo -57.3 -48.19 18.83 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.829 1.686 . . . . 10.0 112.957 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -71.01 -43.47 67.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.719 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.88 -51.44 68.19 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.061 0.393 . . . . 10.0 112.061 -178.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -61.92 -34.17 75.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.325 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.44 -45.01 92.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.415 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 85.6 t -60.86 -46.39 96.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.334 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.1 t -60.87 -46.08 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.677 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.405 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 2.7 ttt180 -59.82 -43.02 94.76 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.682 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.3 tp10 -64.49 -47.56 78.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.83 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.41 72.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.572 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.5 m -58.45 -40.94 83.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.301 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -71.14 -21.21 62.22 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -96.21 -44.38 7.3 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.731 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 67.1 t -74.1 -53.13 18.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.647 0.261 . . . . 10.0 111.628 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -98.87 -47.47 5.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.131 0.491 . . . . 10.0 111.213 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 119.54 -34.24 4.33 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.217 -0.753 . . . . 10.0 111.217 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.6 mpt? -77.99 139.62 39.15 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.01 -0.367 . . . . 10.0 110.01 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -91.13 139.04 31.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.583 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.89 114.96 3.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.079 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -61.31 152.48 29.16 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.056 0.455 . . . . 10.0 111.822 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -41.83 94.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.511 -0.768 . . . . 10.0 111.77 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -63.65 -31.61 53.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.116 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.424 HE22 HD22 ' A' ' 110' ' ' LEU . 97.9 mt-30 -70.19 -31.34 68.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.253 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.22 -31.75 73.07 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.1 mt -73.77 -48.82 28.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.806 -0.634 . . . . 10.0 109.438 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.88 -40.84 99.38 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.779 -0.646 . . . . 10.0 112.508 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.32 -28.66 73.34 Favored Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 112.026 -0.43 . . . . 10.0 112.026 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 16.4 ttm -74.34 -37.6 63.5 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.8 t -66.82 -33.78 65.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.03 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.1 mt -74.29 -2.69 26.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.562 -0.745 . . . . 10.0 112.141 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -83.13 -35.05 25.9 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 178.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -96.35 178.02 5.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.194 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -79.07 71.33 5.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.066 0.46 . . . . 10.0 110.443 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 56.2 m -143.74 154.35 43.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.445 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 41.1 mm -103.29 136.48 35.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -116.18 126.99 54.42 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 111.929 0.344 . . . . 10.0 111.929 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -87.54 121.04 29.46 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.402 ' SD ' ' HG2' ' A' ' 108' ' ' LYS . 45.5 ttm -112.63 158.58 19.82 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.974 0.416 . . . . 10.0 111.271 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 103' ' ' ARG . 9.9 mmm180 -95.02 157.38 15.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.25 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.43 108.04 7.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.39 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 132.31 -28.36 3.47 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.485 -0.864 . . . . 10.0 112.926 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.595 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 4.4 mm-40 -60.47 -51.02 71.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.018 0.437 . . . . 10.0 110.542 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 114.71 99.52 2.28 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.806 -0.711 . . . . 10.0 112.469 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.402 ' HG2' ' SD ' ' A' ' 102' ' ' MET . 40.2 mtmt -69.8 -45.5 67.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.657 0.265 . . . . 10.0 111.054 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 73.4 m -62.07 -34.16 75.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.269 0.556 . . . . 10.0 110.68 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.424 HD22 HE22 ' A' ' 87' ' ' GLN . 13.3 tp -81.14 -1.99 46.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.998 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 42.2 m -110.81 -42.71 3.95 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.895 0.378 . . . . 10.0 110.464 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.52 -13.56 59.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.975 -0.557 . . . . 10.0 112.155 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -24.98 63.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.462 -0.335 . . . . 10.0 111.799 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.406 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 55.5 mt -73.63 -57.16 2.68 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 31.6 Cg_endo -62.11 -32.34 83.31 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.108 1.872 . . . . 10.0 112.118 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.29 77.16 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.385 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.407 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 57.1 t80 -63.47 -46.97 83.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.488 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.554 ' O ' HD12 ' A' ' 60' ' ' LEU . 52.1 tp -58.85 -51.1 71.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.706 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -72.26 -21.78 61.32 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.693 0.257 . . . . 10.0 111.693 -178.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.22 -26.64 63.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.877 0.37 . . . . 10.0 110.861 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 58.8 mt -58.72 -32.32 69.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.218 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 69.0 p -64.23 -35.56 81.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.244 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.06 19.26 59.51 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.914 -0.66 . . . . 10.0 112.303 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 64.1 mmtt -87.36 -26.77 23.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.938 0.399 . . . . 10.0 110.881 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 109.1 105.77 2.99 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.771 -0.728 . . . . 10.0 112.922 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 78.4 t -79.35 115.66 22.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -93.56 99.05 11.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.741 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 40.5 t -92.21 118.9 38.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.957 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 52.4 t -104.8 119.71 54.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.854 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.11 155.7 19.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.275 -0.42 . . . . 10.0 110.764 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 5.1 m -64.71 -36.94 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.899 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -139.0 162.66 34.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.766 0.317 . . . . 10.0 110.631 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.88 -24.12 63.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.406 -178.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -62.68 -55.24 28.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.82 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 83.2 mt -68.71 -33.08 73.34 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.595 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.75 -50.8 69.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.976 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -72.55 -35.63 68.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.725 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -58.92 -57.33 13.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.724 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.76 -32.63 74.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.001 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.7 -49.15 77.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.997 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -78.53 -28.26 46.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.472 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -71.38 -43.0 67.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.015 0.436 . . . . 10.0 111.08 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -88.77 -1.66 58.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.119 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.485 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 60.6 ttm-85 -64.87 -50.16 64.68 Favored Pre-proline 0 CA--C 1.535 0.404 0 N-CA-C 112.484 0.55 . . . . 10.0 112.484 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' PRO . . . . . 0.485 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 32.4 Cg_exo -60.69 -14.39 31.28 Favored 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 122.102 1.868 . . . . 10.0 112.62 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 14.3 tp -89.07 -56.49 3.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.405 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -65.87 -46.74 77.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 10.0 112.186 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -64.95 -25.57 67.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.781 0.324 . . . . 10.0 111.591 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -77.45 -22.93 50.68 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.071 0.462 . . . . 10.0 110.306 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 81.8 mt -93.17 -6.73 47.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.659 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 103.74 8.16 40.45 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.515 -0.85 . . . . 10.0 113.585 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 91.8 mt -96.91 138.7 34.06 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.1 0.45 . . . . 10.0 110.592 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.35 130.65 34.44 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.279 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.45 123.03 66.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.941 0.4 . . . . 10.0 110.689 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -120.57 150.46 17.37 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.993 -0.622 . . . . 10.0 112.278 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 4.3 tp -123.81 133.2 69.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -118.98 116.48 26.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.407 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.502 ' O ' ' HB2' ' A' ' 161' ' ' MET . 94.7 mt -109.06 146.07 33.08 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.482 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' PRO . . . . . 0.559 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 15.2 Cg_endo -58.46 115.08 2.28 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 122.655 2.236 . . . . 10.0 112.22 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.85 5.24 56.6 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.785 -0.722 . . . . 10.0 112.746 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' MET . . . . . 0.502 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.3 OUTLIER -65.87 151.96 94.15 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.555 0.177 . . . . 10.0 110.809 179.496 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -61.33 147.0 96.69 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.496 2.131 . . . . 10.0 111.866 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . 0.459 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.82 -49.71 87.79 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 112.384 0.513 . . . . 10.0 112.384 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.459 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 52.2 Cg_exo -56.59 -44.87 41.45 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 121.819 1.68 . . . . 10.0 112.205 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.69 98.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.67 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.418 ' HZ1' ' CG ' ' A' ' 185' ' ' ASP . 48.1 mttm -62.25 -44.47 96.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.456 179.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' ARG . . . . . 0.432 ' CG ' ' HA ' ' A' ' 199' ' ' VAL . 74.9 mtt180 -59.68 -40.52 88.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.005 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.99 -35.07 74.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.882 0.373 . . . . 10.0 110.437 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -68.62 -39.11 80.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.746 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -80.94 -12.84 59.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.59 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -85.66 -9.6 56.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.32 0.581 . . . . 10.0 109.463 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -80.13 165.03 22.87 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.285 -0.87 . . . . 10.0 109.895 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -70.54 -37.05 74.0 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.805 0.336 . . . . 10.0 110.76 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.3 mp -126.52 122.59 61.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.061 179.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 5.8 m -115.7 121.01 41.24 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.886 0.374 . . . . 10.0 111.18 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -99.74 141.67 32.23 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -177.83 172.62 45.26 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.34 -0.933 . . . . 10.0 112.895 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.87 153.45 21.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.805 0.336 . . . . 10.0 111.15 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -63.31 -35.92 81.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.899 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -59.49 -52.19 66.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.169 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . 0.559 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.8 tp10 -69.79 -37.53 76.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.102 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -56.8 -36.04 69.43 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.974 0.416 . . . . 10.0 110.834 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -77.88 -40.03 22.66 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.804 -0.713 . . . . 10.0 111.694 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -64.3 -40.03 95.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.581 0.229 . . . . 10.0 110.58 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 185' ' ' ASP . . . . . 0.418 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 20.4 m-20 -60.43 -41.43 93.99 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.104 0.478 . . . . 10.0 109.973 179.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -62.25 -39.54 93.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.518 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 87.1 mt -67.4 -44.02 79.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.989 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 64.1 mtm-85 -65.48 -43.56 89.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.953 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 189' ' ' ASP . . . . . 0.403 ' OD1' ' HA ' ' A' ' 198' ' ' ARG . 16.3 m-20 -62.93 -32.91 74.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.79 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -85.27 -0.61 55.24 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.484 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 24.8 ttp -121.58 10.6 10.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.819 0.343 . . . . 10.0 110.848 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -69.74 172.18 7.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.07 -0.513 . . . . 10.0 111.111 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -107.09 -30.02 9.04 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.167 0.508 . . . . 10.0 110.394 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 194' ' ' SER . . . . . 0.411 ' O ' ' HB2' ' A' ' 197' ' ' GLU . 0.1 OUTLIER -115.42 140.07 25.4 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.734 -0.667 . . . . 10.0 109.577 179.136 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.15 -28.61 87.33 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.696 2.264 . . . . 10.0 113.031 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.02 0.63 52.87 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 121.151 -0.219 . . . . 10.0 111.417 -179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 194' ' ' SER . 32.9 mt-10 -80.06 -11.32 59.78 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 121.234 -0.186 . . . . 10.0 110.71 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 198' ' ' ARG . . . . . 0.403 ' HA ' ' OD1' ' A' ' 189' ' ' ASP . 66.2 mtt180 -58.17 142.42 47.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.622 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 199' ' ' VAL . . . . . 0.432 ' HA ' ' CG ' ' A' ' 167' ' ' ARG . 28.9 m -94.77 -26.7 4.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.482 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -107.63 159.73 16.23 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.889 0.376 . . . . 10.0 110.705 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 55.3 mtm180 -82.4 -66.18 0.92 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.75 172.82 7.61 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.497 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . 0.43 HD21 ' CZ ' ' A' ' 384' ' ' TYR . 19.5 mt -102.68 124.97 49.21 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -140.59 -56.5 0.52 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.916 0.388 . . . . 10.0 110.325 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -127.12 136.37 52.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.64 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.534 ' HB3' ' CD1' ' A' ' 384' ' ' TYR . . . -132.05 127.29 35.84 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.084 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 47.5 tp -125.65 109.89 13.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.702 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.16 132.26 46.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.214 0.53 . . . . 10.0 111.109 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -49.54 77.38 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.237 -0.892 . . . . 10.0 112.243 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.52 103.97 6.44 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.927 0.394 . . . . 10.0 110.362 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . 0.441 ' CG2' ' HB ' ' A' ' 391' ' ' THR . 30.9 m -74.05 -18.35 17.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.754 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 212' ' ' ASP . . . . . 0.423 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.3 m-20 -46.11 -74.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.561 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 66.0 m -86.84 -19.86 28.34 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.78 0.659 . . . . 10.0 112.78 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 50.3 mt -77.7 -38.98 26.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.316 0.488 . . . . 10.0 112.316 -178.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 18.4 mt -98.44 -42.35 7.37 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 216' ' ' ILE . . . . . 0.423 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 49.5 mm -81.83 -59.04 3.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 112.575 0.583 . . . . 10.0 112.575 -178.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.6 -34.36 76.85 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.05 0.759 . . . . 10.0 113.05 -177.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 218' ' ' GLU . . . . . 0.428 ' O ' ' HB2' ' A' ' 377' ' ' PHE . 7.5 mm-40 -97.69 15.8 22.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.66 0.267 . . . . 10.0 111.718 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.14 -49.54 77.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.936 0.398 . . . . 10.0 111.84 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 220' ' ' ARG . . . . . 0.556 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -97.59 32.8 2.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.1 0.476 . . . . 10.0 111.511 -178.436 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 10.0 m -105.25 106.69 56.79 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -91.52 125.65 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.918 2.412 . . . . 10.0 113.318 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 223' ' ' LEU . . . . . 0.526 ' O ' ' HA ' ' A' ' 374' ' ' SER . 88.0 mt -79.8 110.43 15.15 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 178.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 55.7 mt -108.48 130.64 60.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.035 0.445 . . . . 10.0 111.715 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 9.4 mt . . . . . 0 C--N 1.327 -0.376 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.537 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.238 0 N-CA-C 109.858 -0.423 . . . . 10.0 109.858 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 374' ' ' SER . . . . . 0.526 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 16.4 m -152.04 136.53 16.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.655 0.264 . . . . 10.0 111.161 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 17.2 tt -155.83 137.17 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.337 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.38 145.64 27.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.398 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 377' ' ' PHE . . . . . 0.428 ' HB2' ' O ' ' A' ' 218' ' ' GLU . 36.2 m-85 -57.53 -37.65 73.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.654 0.264 . . . . 10.0 110.657 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -57.32 -39.94 76.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.404 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -74.38 -39.16 62.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.024 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -63.68 -46.43 85.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.378 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -74.65 -16.78 60.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.831 0.308 . . . . 10.0 111.831 -179.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -80.7 -3.29 50.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.856 0.36 . . . . 10.0 110.539 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 60.7 mt -99.37 4.76 46.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.385 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . 0.534 ' CD1' ' HB3' ' A' ' 206' ' ' ALA . 21.1 m-85 -99.79 143.68 29.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.147 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -79.27 -70.8 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.928 0.394 . . . . 10.0 110.526 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -89.13 91.92 8.99 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.627 -0.508 . . . . 10.0 109.627 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 54.5 tp -103.27 110.03 21.86 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.012 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -128.96 161.68 29.33 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.18 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.83 165.26 37.01 Favored Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.255 -0.974 . . . . 10.0 112.158 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 46.0 mtm -107.65 143.32 36.28 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.119 -0.326 . . . . 10.0 110.119 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 391' ' ' THR . . . . . 0.441 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 7.1 t -129.51 155.57 45.54 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -80.66 163.57 46.23 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.501 -0.856 . . . . 10.0 112.044 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.63 91.58 0.43 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.166 -0.309 . . . . 10.0 110.166 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . 0.531 ' HA ' HD21 ' A' ' 569' ' ' ASN . . . -151.58 -28.72 0.18 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.229 0.455 . . . . 10.0 112.229 -178.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 31.9 t70 58.83 -108.94 0.43 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 109.205 -0.665 . . . . 10.0 109.205 -178.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 6.7 m 58.81 -89.8 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.239 0.829 . . . . 10.0 113.239 177.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -88.76 22.75 2.53 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.003 0.371 . . . . 10.0 112.003 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -60.84 -35.19 75.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.044 0.449 . . . . 10.0 110.946 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -66.51 -20.05 65.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.487 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.64 -22.36 46.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.712 -0.222 . . . . 10.0 110.847 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -63.64 -46.69 84.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 10.0 110.556 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.36 -20.74 58.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.599 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 41.7 m -87.6 -42.5 12.66 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.328 0.492 . . . . 10.0 112.328 -178.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 56.4 mt -91.44 -61.56 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 N-CA-C 112.763 0.653 . . . . 10.0 112.763 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -88.11 -4.76 58.72 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt 60.48 44.42 11.95 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.788 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 20.7 mt -109.8 141.4 42.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.828 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 408' ' ' ASP . . . . . 0.499 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 47.7 t0 -76.87 166.87 22.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 6.9 m -134.35 101.49 5.01 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.057 0.456 . . . . 10.0 111.149 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 62.0 t -106.84 133.53 51.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.068 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 23.6 t -87.15 126.08 40.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.509 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 54.2 t -86.69 128.46 56.43 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.385 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.96 146.35 82.38 Favored 'Trans proline' 0 N--CA 1.463 -0.292 0 C-N-CA 122.436 2.091 . . . . 10.0 112.095 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.75 145.4 45.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.873 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -56.89 -38.03 72.21 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.268 0.556 . . . . 10.0 110.514 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 416' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 578' ' ' GLN . 71.1 mtm180 -129.66 151.32 77.86 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.451 179.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -61.77 116.26 3.33 Favored 'Trans proline' 0 N--CA 1.465 -0.167 0 C-N-CA 122.6 2.2 . . . . 10.0 111.84 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 48.8 mtm -64.32 118.53 8.81 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.969 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 6.4 pt -108.29 30.9 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.359 0.6 . . . . 10.0 110.348 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -77.2 122.66 25.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.279 -0.873 . . . . 10.0 109.45 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 27.0 mmtp -88.76 101.47 14.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.996 0.427 . . . . 10.0 111.104 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -88.4 114.99 25.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.01 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 74.5 mt -94.32 156.09 39.14 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.493 -0.322 . . . . 10.0 110.542 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -65.94 170.28 11.88 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.694 2.263 . . . . 10.0 113.006 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -85.67 129.15 34.9 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.461 -0.791 . . . . 10.0 110.596 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.28 92.08 4.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.353 0.596 . . . . 10.0 110.189 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 25.6 t -87.75 122.04 38.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.545 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 428' ' ' TYR . . . . . 0.41 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 2.5 m-85 -105.36 -176.71 3.16 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 429' ' ' MET . . . . . 0.533 ' HE2' ' O ' ' A' ' 608' ' ' ARG . 12.8 mmt -78.09 -74.16 0.28 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.94 0.4 . . . . 10.0 111.342 -178.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 73.2 p -89.53 174.01 8.01 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.869 -178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -71.91 -36.04 69.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.39 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.63 -41.12 85.23 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.571 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 433' ' ' GLU . . . . . 0.414 ' OE2' ' HB2' ' A' ' 429' ' ' MET . 33.1 mt-10 -62.51 -45.38 93.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.143 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 434' ' ' LYS . . . . . 0.489 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 38.7 ttpt -58.67 -50.46 73.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.706 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 49.7 mm -62.33 -43.48 98.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.905 -179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -59.6 -39.92 85.78 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.615 0.245 . . . . 10.0 110.886 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.35 87.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.338 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 70.1 mt -65.53 -45.88 91.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.952 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 50.2 mm -58.31 -40.48 78.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.893 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -63.96 -50.42 68.66 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.389 -0.368 . . . . 10.0 110.707 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . 0.405 ' HB2' ' HH ' ' A' ' 587' ' ' TYR . 20.2 t70 -58.36 -42.06 86.1 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.127 0.489 . . . . 10.0 110.557 179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 79.2 mt -67.26 -50.7 60.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.637 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -50.01 -49.31 51.21 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.372 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 444' ' ' GLU . . . . . 0.413 ' O ' ' HD3' ' A' ' 448' ' ' LYS . 0.0 OUTLIER -56.74 -47.22 80.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.528 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 47.8 mtt-85 -74.34 -22.24 59.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.016 -0.538 . . . . 10.0 112.19 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 27.4 m -69.4 -39.46 77.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.175 0.512 . . . . 10.0 109.917 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -74.06 -34.17 63.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.943 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 448' ' ' LYS . . . . . 0.413 ' HD3' ' O ' ' A' ' 444' ' ' GLU . 14.0 mptt -70.13 -58.57 3.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.143 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 127.88 35.9 0.5 Allowed Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.667 -0.778 . . . . 10.0 112.267 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -113.43 126.53 28.02 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 110.158 -0.312 . . . . 10.0 110.158 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.44 140.6 58.31 Favored 'Trans proline' 0 C--O 1.237 0.455 0 C-N-CA 122.524 2.149 . . . . 10.0 111.503 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 85.4 t -125.28 126.62 71.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.246 -178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 37.6 tp -112.99 107.75 16.41 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.781 -0.645 . . . . 10.0 109.352 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 20.8 t -93.72 126.0 46.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.266 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -106.56 109.48 3.11 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.7 -0.762 . . . . 10.0 111.996 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 2.7 p -97.66 142.15 29.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.733 0.302 . . . . 10.0 110.72 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 30.3 pt -84.39 -20.76 8.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.789 0.328 . . . . 10.0 111.229 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 458' ' ' SER . . . . . 0.477 ' HB3' ' OE2' ' A' ' 460' ' ' GLU . 57.7 m -134.38 145.43 48.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.962 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 16.8 mt -62.93 -33.86 62.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.249 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.477 ' OE2' ' HB3' ' A' ' 458' ' ' SER . 2.7 mp0 -59.03 -35.73 73.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.343 -0.844 . . . . 10.0 111.143 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.61 -29.11 51.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.751 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 9.8 m -63.45 -41.21 98.63 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.342 0.591 . . . . 10.0 110.067 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -68.46 -30.58 69.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.488 -0.778 . . . . 10.0 110.656 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 57.0 tp -70.64 -53.81 14.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.828 -0.624 . . . . 10.0 111.144 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 14.6 p -63.51 -31.4 52.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 120.884 0.374 . . . . 10.0 110.836 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.9 t -66.3 -38.35 87.53 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.881 0.372 . . . . 10.0 110.021 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -61.67 -49.19 77.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.764 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -65.12 -40.49 94.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.329 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 27.0 mt -61.69 -34.94 76.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.939 0.399 . . . . 10.0 110.329 179.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 23.4 m -72.26 -33.55 67.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.162 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -67.39 -37.37 83.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.455 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -77.62 -23.73 49.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.141 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 87.41 33.78 11.26 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.948 -0.644 . . . . 10.0 111.844 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 78.3 mt -100.68 131.19 48.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.669 0.271 . . . . 10.0 110.828 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -63.05 124.64 21.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.116 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 50.2 p-80 -154.85 159.42 40.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.802 0.334 . . . . 10.0 111.216 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -141.37 132.77 26.73 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.166 178.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 40.0 t -97.81 123.69 50.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.751 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 55.5 mt -81.36 146.48 30.31 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.419 -0.585 . . . . 10.0 109.419 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -157.78 135.78 10.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.124 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -60.04 -25.87 65.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.352 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -62.32 -33.44 74.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.231 0.539 . . . . 10.0 110.305 179.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -116.64 35.27 4.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.629 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -58.0 -24.86 59.94 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.289 -178.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -62.92 -42.97 99.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.928 0.395 . . . . 10.0 110.84 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -86.03 -28.24 24.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.956 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -55.42 -40.32 71.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.22 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -57.92 -29.11 64.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.942 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -84.03 -36.54 23.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.128 0.49 . . . . 10.0 110.418 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 53.9 mt -69.17 -45.93 78.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.095 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 71.9 t -61.09 -34.21 59.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.085 0.469 . . . . 10.0 110.946 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -65.91 -24.28 66.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.48 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' GLN . . . . . 0.43 ' NE2' ' H ' ' A' ' 518' ' ' SER . 53.7 mm-40 -115.44 16.84 16.63 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.826 0.346 . . . . 10.0 110.753 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.87 -12.97 61.85 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.402 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -89.19 7.69 81.53 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.781 -0.723 . . . . 10.0 112.211 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -69.84 141.53 89.91 Favored Pre-proline 0 C--N 1.328 -0.364 0 C-N-CA 122.319 0.248 . . . . 10.0 110.515 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -52.54 126.22 20.21 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.718 2.279 . . . . 10.0 113.04 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 67.92 24.92 7.88 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.487 -0.778 . . . . 10.0 112.57 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -94.88 110.28 22.18 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 10.0 110.261 178.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 38.6 t -92.16 109.71 21.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.106 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 1.2 m -116.4 130.16 56.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.799 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 28.9 mt -105.6 115.26 47.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.042 -0.526 . . . . 10.0 109.734 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -103.67 111.3 23.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.907 0.384 . . . . 10.0 111.191 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 13.1 m -82.32 110.94 17.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.411 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 13.3 t30 62.79 91.61 0.07 Allowed 'General case' 0 N--CA 1.465 0.275 0 O-C-N 123.686 0.616 . . . . 10.0 111.0 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 1.3 mmt -75.05 113.8 12.8 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.762 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -64.95 168.71 6.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.98 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -58.98 142.11 46.63 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 121.165 -0.541 . . . . 10.0 113.026 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 69.26 -80.1 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.354 0.662 . . . . 10.0 111.502 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.17 143.42 11.4 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.732 -0.747 . . . . 10.0 112.165 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.81 147.02 35.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.905 0.383 . . . . 10.0 111.349 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -76.23 93.92 3.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.528 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 55.0 mt -69.55 121.85 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.482 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 7.4 t -90.27 133.52 31.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.671 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 61.2 mt -70.45 135.54 48.76 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.412 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 85.85 0.34 87.57 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.085 -0.579 . . . . 10.0 111.773 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 106.6 -170.0 15.83 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 110.784 -0.927 . . . . 10.0 110.784 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 518' ' ' SER . . . . . 0.43 ' H ' ' NE2' ' A' ' 493' ' ' GLN . 2.8 p -128.07 98.99 5.3 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 117.235 0.517 . . . . 10.0 110.918 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 33.2 p-90 -59.55 -28.47 67.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.076 0.465 . . . . 10.0 110.206 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -62.57 -32.26 73.22 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.646 -0.707 . . . . 10.0 110.681 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -85.12 -35.91 21.46 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.225 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -63.6 -45.56 89.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.899 -0.591 . . . . 10.0 111.013 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 33.8 m -70.74 -22.35 23.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.99 0.424 . . . . 10.0 110.806 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -81.13 -23.26 38.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.64 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -73.32 -21.83 60.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.532 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 91.7 mt -79.44 127.02 31.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.176 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -63.55 -33.76 76.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.299 0.571 . . . . 10.0 109.462 179.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -120.46 93.92 48.54 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 115.307 -0.861 . . . . 10.0 109.258 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -80.72 75.09 5.22 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.114 2.542 . . . . 10.0 111.956 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.97 144.6 55.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.598 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.97 -43.49 60.48 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.328 0.492 . . . . 10.0 112.328 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -59.8 -44.4 94.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.989 0.423 . . . . 10.0 110.949 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.08 -40.77 91.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.717 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 91.4 mt -60.92 -43.55 96.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . 0.478 ' CD ' ' HZ3' ' A' ' 538' ' ' LYS . 7.8 tp10 -66.6 -41.86 87.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.319 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -62.04 -47.37 85.02 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.275 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 85.2 mt -66.29 -33.8 65.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.787 0.327 . . . . 10.0 110.544 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . 0.478 ' HZ3' ' CD ' ' A' ' 535' ' ' GLU . 31.4 ttmt -63.66 -49.81 71.73 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -66.37 -36.14 82.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.317 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . 0.588 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 19.7 t70 -62.9 -52.06 64.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.718 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 47.8 t90 -61.87 -37.96 86.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.866 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -50.98 -49.86 59.36 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.297 -0.41 . . . . 10.0 111.107 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 47.4 t -64.58 -45.1 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.994 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 544' ' ' ARG . . . . . 0.588 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 5.8 mtm180 -64.23 -35.79 81.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.936 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -68.94 -48.4 63.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.741 -0.663 . . . . 10.0 111.178 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -69.11 -26.01 64.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.626 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -65.46 -36.79 84.94 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.266 0.555 . . . . 10.0 109.576 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.2 -32.75 55.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.709 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 85.4 mt -61.84 -47.19 86.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.904 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -76.49 -18.9 58.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.737 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -75.4 -33.68 61.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.641 179.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 134.55 10.36 1.65 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.444 -0.884 . . . . 10.0 113.21 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 73.07 -168.28 53.74 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.859 -0.686 . . . . 10.0 112.672 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 40.9 tp -72.78 117.11 14.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.958 0.408 . . . . 10.0 110.078 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -92.7 113.79 26.16 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.011 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 10.9 mm -94.87 137.63 22.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.31 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 557' ' ' ILE . . . . . 0.489 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 23.7 mt -127.74 128.87 69.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.64 0.257 . . . . 10.0 110.343 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -106.8 120.25 6.18 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 111.404 -0.678 . . . . 10.0 111.404 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 17.3 p -74.71 -37.38 62.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.126 0.489 . . . . 10.0 110.907 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -138.61 140.76 39.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.081 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 23.4 mmt180 -82.81 141.39 32.34 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.74 151.15 23.64 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.9 -0.32 . . . . 10.0 110.377 -179.461 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -41.99 68.21 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 179.461 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 36.3 t -81.18 115.65 20.7 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.398 -0.819 . . . . 10.0 109.064 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -66.33 -27.87 68.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.657 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 566' ' ' ARG . . . . . 0.424 ' HA ' ' HB3' ' A' ' 394' ' ' ALA . 8.3 ttm180 -62.03 -37.09 83.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.064 0.459 . . . . 10.0 110.37 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 44.1 mt -88.71 -31.23 5.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.324 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -66.02 -44.77 83.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.185 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 569' ' ' ASN . . . . . 0.531 HD21 ' HA ' ' A' ' 394' ' ' ALA . 46.3 t30 -71.25 -23.64 62.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.885 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -63.2 -29.15 70.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.84 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 29.2 tp -72.1 -35.98 69.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.072 0.463 . . . . 10.0 110.167 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 -75.36 -31.09 60.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.256 0.55 . . . . 10.0 110.031 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -76.26 0.68 62.84 Favored Glycine 0 CA--C 1.519 0.303 0 CA-C-N 115.659 -0.701 . . . . 10.0 113.188 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.52 -33.35 72.68 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.794 0.33 . . . . 10.0 110.397 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 2.6 t -98.68 169.93 9.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.165 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 63.96 50.87 57.87 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.693 -0.765 . . . . 10.0 111.47 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 577' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' A' ' 580' ' ' ASP . 27.6 mtt180 -79.6 126.24 30.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.751 0.31 . . . . 10.0 110.996 -179.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 578' ' ' GLN . . . . . 0.595 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 7.4 tt0 56.76 32.6 21.51 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.626 -0.715 . . . . 10.0 110.746 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 78.18 43.08 14.06 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.797 -0.638 . . . . 10.0 112.651 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 580' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 577' ' ' ARG . 0.9 OUTLIER -100.11 -170.3 1.86 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.714 0.292 . . . . 10.0 110.841 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -83.89 172.37 12.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.114 -179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 146.94 174.13 18.76 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.783 -0.723 . . . . 10.0 112.107 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 2.0 p -157.69 155.48 30.05 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.872 -0.418 . . . . 10.0 109.872 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 79.9 p -131.15 135.85 47.82 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.052 0.453 . . . . 10.0 110.578 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 585' ' ' ARG . . . . . 0.489 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 1.6 tpm_? -139.29 116.97 11.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -108.47 148.02 30.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.99 0.424 . . . . 10.0 111.147 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 587' ' ' TYR . . . . . 0.489 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 84.4 m-85 -129.16 158.98 37.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.486 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 13.2 mt -157.62 169.29 24.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.857 0.361 . . . . 10.0 110.922 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.85 155.92 37.14 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.328 178.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 60.9 mmm -72.59 -15.22 61.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.292 0.568 . . . . 10.0 110.73 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -118.79 29.86 7.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.243 -0.89 . . . . 10.0 109.017 178.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.25 176.96 9.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.188 -0.914 . . . . 10.0 111.798 -178.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.03 77.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.525 -0.761 . . . . 10.0 111.606 -179.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 5.2 tp -68.69 -21.74 64.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.859 0.361 . . . . 10.0 110.945 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 13.1 mmt -77.27 9.58 3.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.416 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -106.16 -12.69 15.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.642 0.258 . . . . 10.0 110.542 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 18.8 pt -88.33 -1.71 8.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.855 0.36 . . . . 10.0 111.375 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -82.29 -9.15 59.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.964 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 69.84 -59.63 0.5 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.99 0.806 . . . . 10.0 111.908 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.5 m -88.79 115.03 26.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.713 0.292 . . . . 10.0 110.864 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -64.06 -23.3 67.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.197 0.522 . . . . 10.0 110.538 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 3.0 mmt180 -59.01 -24.48 62.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.481 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 76.4 t -68.17 -49.68 65.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 1.4 m -65.27 -36.94 85.66 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.551 -0.75 . . . . 10.0 110.0 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -63.47 -39.11 97.34 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.01 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 61.1 tpp -74.52 -27.92 60.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.121 0.486 . . . . 10.0 110.619 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 39.7 mtt -74.29 -18.94 60.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.347 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 608' ' ' ARG . . . . . 0.533 ' O ' ' HE2' ' A' ' 429' ' ' MET . 74.5 mtt-85 -77.5 6.11 7.68 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.053 0.454 . . . . 10.0 110.704 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -94.76 2.58 55.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.859 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 77.1 mt -80.93 -9.79 59.79 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.343 -0.389 . . . . 10.0 111.037 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 611' ' ' GLY . . . . . 0.436 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 83.85 -50.84 4.47 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.914 -0.66 . . . . 10.0 111.934 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 612' ' ' MET . . . . . 0.436 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.7 OUTLIER 73.66 -61.07 0.51 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.834 0.853 . . . . 10.0 111.847 179.145 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 613' ' ' LYS . . . . . 0.408 ' HZ1' ' CD ' ' A' ' 616' ' ' GLU . 2.6 tmtp? 62.85 93.17 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.301 0 O-C-N 123.536 0.523 . . . . 10.0 110.603 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 614' ' ' PRO . . . . . 0.41 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 38.2 Cg_exo -57.09 94.94 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.136 2.558 . . . . 10.0 112.269 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 142.85 -29.47 2.1 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.831 -0.699 . . . . 10.0 111.916 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 616' ' ' GLU . . . . . 0.408 ' CD ' ' HZ1' ' A' ' 613' ' ' LYS . 0.4 OUTLIER -104.59 140.66 37.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.943 0.402 . . . . 10.0 110.981 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -95.72 114.15 25.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.071 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.08 -37.62 78.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.795 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 51.78 74.67 0.25 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.763 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.97 105.23 20.39 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 120.86 0.362 . . . . 10.0 110.726 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.91 -21.27 25.67 Favored 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.659 2.906 . . . . 10.0 114.585 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 9.5 p-90 -60.43 -29.3 68.91 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 120.662 -0.415 . . . . 10.0 110.493 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 60.3 t -65.54 -48.85 81.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 85.1 m -61.36 -37.97 85.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.408 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -64.67 -42.47 95.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.122 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.09 94.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.641 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.1 -50.44 76.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.447 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -62.76 -35.73 80.76 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.116 0.484 . . . . 10.0 110.797 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 629' ' ' ASN . . . . . 0.56 ' O ' ' HG2' ' A' ' 633' ' ' LYS . 63.2 t30 -65.85 -44.56 85.12 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.849 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -67.15 -42.11 84.91 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.08 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -58.64 -40.54 83.68 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.379 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -61.57 -38.45 87.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.377 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 633' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 629' ' ' ASN . 26.1 mmtp -65.37 -37.79 88.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.166 -179.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 53.7 t -62.34 -47.1 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.081 0.467 . . . . 10.0 110.36 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -69.24 -35.78 76.48 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.67 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 49.1 m -64.63 -36.51 84.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.019 0.438 . . . . 10.0 110.04 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -67.89 -31.92 72.05 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -66.95 -38.14 85.58 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -65.02 -37.14 86.67 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.006 -0.543 . . . . 10.0 109.735 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 640' ' ' ASP . . . . . 0.62 ' O ' ' HG2' ' A' ' 644' ' ' GLN . 25.6 t0 -60.54 -35.84 76.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.636 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 59.1 mt -80.02 -38.57 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.325 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 642' ' ' ARG . . . . . 0.462 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 14.0 mtm-85 -61.71 -43.14 99.42 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.648 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 12.1 pttm -66.0 -26.88 67.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.868 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 644' ' ' GLN . . . . . 0.62 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 16.2 mm100 -65.03 -45.75 84.18 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 48.5 mt -65.63 -41.7 92.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.039 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 646' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 90.7 mt -63.5 -29.63 70.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.372 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.69 -28.32 69.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.078 0.465 . . . . 10.0 110.738 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -96.84 -28.28 14.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.621 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -75.38 -34.64 61.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.184 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 650' ' ' ASP . . . . . 0.494 ' O ' ' HB3' ' A' ' 653' ' ' ASN . 2.6 t0 -66.36 -23.51 66.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.13 0.49 . . . . 10.0 110.512 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 36.2 t -67.2 -42.01 87.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.319 0.58 . . . . 10.0 109.466 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -73.71 -22.5 59.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.473 -0.785 . . . . 10.0 109.912 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 653' ' ' ASN . . . . . 0.494 ' HB3' ' O ' ' A' ' 650' ' ' ASP . 18.1 t30 -61.39 -48.95 78.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.441 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -62.09 -46.85 87.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.62 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -62.67 -45.48 92.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.781 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 656' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 656' ' ' ARG . 11.2 ttp-105 -63.57 -40.76 97.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.332 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 30.9 ttp85 -61.74 -50.49 72.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.64 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -62.02 -49.08 77.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.732 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 659' ' ' ILE . . . . . 0.434 ' O ' ' HB2' ' A' ' 663' ' ' ARG . 8.7 tp -66.1 -34.52 70.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 116.628 -0.26 . . . . 10.0 111.6 -178.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -69.84 -34.21 73.33 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.731 0.301 . . . . 10.0 110.266 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.3 m -63.0 -54.26 41.05 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.112 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 662' ' ' GLN . . . . . 0.41 HE21 ' HB2' ' A' ' 662' ' ' GLN . 5.8 tt0 -62.12 -39.2 91.74 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.688 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 659' ' ' ILE . 2.2 tmt_? -60.44 -34.07 73.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.621 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -83.36 -37.75 22.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.714 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -57.86 -48.44 79.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.418 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 45.7 mt -72.21 -14.72 61.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.21 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 34.9 tp -86.16 -44.38 12.25 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.492 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -68.1 -53.94 21.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.898 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 29.4 m -59.99 150.9 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 112.26 0.467 . . . . 10.0 112.26 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.57 -50.6 5.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.482 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -83.48 150.37 26.05 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.238 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 6.6 p -141.07 8.74 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.051 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 15.4 m -49.84 -49.28 49.62 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.681 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.94 -51.85 67.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.767 -178.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 2.0 m -60.48 -50.49 73.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.158 -0.474 . . . . 10.0 112.084 -179.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 14.1 mm -62.13 -38.59 81.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 121.152 -0.219 . . . . 10.0 111.518 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -68.36 -42.77 78.72 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.167 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 45.0 m -58.09 -44.03 87.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.911 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 24.3 pt -79.6 -24.71 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.953 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 18.8 mtm-85 -61.32 -50.45 72.91 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.147 0.499 . . . . 10.0 110.059 178.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.98 -35.4 74.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.377 -0.829 . . . . 10.0 110.692 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -66.03 -47.21 75.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.639 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 44.5 t -61.9 -45.75 98.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.189 -0.459 . . . . 10.0 111.444 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -59.78 -42.68 93.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.585 -0.28 . . . . 10.0 110.618 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -62.47 -46.01 90.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.09 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.59 99.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.472 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 21.0 m -65.22 -45.92 82.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.695 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.98 -39.32 85.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 10.0 110.253 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.31 -28.1 62.76 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.788 -0.642 . . . . 10.0 112.111 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -70.26 -22.9 62.83 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.479 0.548 . . . . 10.0 112.479 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -119.86 -19.33 7.97 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.704 0.288 . . . . 10.0 111.544 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 42.8 mt -128.82 103.67 19.0 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.908 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -67.45 139.39 49.16 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.675 2.25 . . . . 10.0 111.745 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -50.23 106.27 0.12 Allowed 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.05 2.5 . . . . 10.0 113.215 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 61.7 86.99 0.1 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.478 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 2.3 p -142.9 -165.86 2.16 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.193 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 62.4 mt -99.17 161.79 13.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.465 0.174 . . . . 10.0 110.945 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . 0.541 ' HA ' ' CE3' ' A' ' 701' ' ' TRP . 15.0 tt0 -58.07 -31.27 66.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.314 -179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -66.13 -24.14 66.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.179 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 54.9 mtp -95.57 4.57 53.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.389 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 701' ' ' TRP . . . . . 0.541 ' CE3' ' HA ' ' A' ' 698' ' ' GLU . 50.2 m0 -103.2 111.88 24.48 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.733 0.301 . . . . 10.0 111.297 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -81.91 78.59 8.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.75 -0.833 . . . . 10.0 108.75 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 703' ' ' ILE . . . . . 0.538 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 44.5 mm -56.39 -51.9 77.35 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.243 -0.889 . . . . 10.0 111.951 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 704' ' ' PRO . . . . . 0.538 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 35.9 Cg_exo -60.65 -44.33 27.14 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.679 1.586 . . . . 10.0 111.836 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -61.1 -39.2 96.79 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.947 -0.644 . . . . 10.0 112.744 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 64.1 tp -78.1 -45.17 24.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.655 0.264 . . . . 10.0 111.392 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -59.67 -49.68 76.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.277 -0.42 . . . . 10.0 111.017 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -65.98 -30.3 70.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.88 0.372 . . . . 10.0 110.291 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 709' ' ' ARG . 5.2 tpt180 -62.74 -49.69 74.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.164 179.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 65.3 mt -67.23 -29.25 68.84 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.007 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.1 mtpp -78.13 -18.15 56.0 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.402 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -108.09 -53.3 2.65 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.1 -35.96 69.34 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.665 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -105.87 -12.57 15.8 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 121.061 -0.256 . . . . 10.0 111.348 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.43 24.08 13.98 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.887 -0.597 . . . . 10.0 112.261 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 23.7 tp -113.7 126.95 55.81 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.689 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -81.03 100.71 9.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.792 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 95.3 mt -113.57 114.15 47.58 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.432 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.69 66.57 8.05 Favored 'Trans proline' 0 CA--C 1.536 0.575 0 C-N-CA 122.93 2.42 . . . . 10.0 112.665 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 68.0 mt -60.5 -46.83 94.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.65 -179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -64.0 -31.19 72.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.918 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -69.87 -40.88 75.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.566 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 45.0 m0 -66.86 -54.14 25.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.672 -0.694 . . . . 10.0 111.477 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 16.9 tp -63.01 -18.57 63.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 10.0 112.144 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -77.88 -37.39 48.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.48 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -102.21 -25.97 13.5 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.131 0.419 . . . . 10.0 112.131 -178.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -122.11 78.58 42.73 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 121.01 0.433 . . . . 10.0 110.222 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -72.49 -9.05 23.61 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.845 2.363 . . . . 10.0 112.564 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -78.55 -10.84 59.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.836 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 93.4 mt -69.64 -29.37 66.83 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.222 0.534 . . . . 10.0 109.829 178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 51.53 -95.64 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.624 -1.171 . . . . 10.0 112.147 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -56.01 0.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.611 0.243 . . . . 10.0 111.526 -178.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -56.38 -54.34 46.78 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.797 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.46 -27.22 68.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.027 0.441 . . . . 10.0 110.756 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 25.3 tp -67.39 -43.49 81.19 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 33.7 mtt180 -61.65 -40.23 94.16 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.996 -0.547 . . . . 10.0 109.642 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -60.28 -45.51 93.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.379 -0.828 . . . . 10.0 110.687 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 23.1 mmm-85 -61.08 -45.43 94.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.807 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 97.0 mt -60.99 -52.78 57.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.707 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 21.1 tp -58.25 -46.33 86.16 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.789 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.61 99.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.376 -0.374 . . . . 10.0 111.181 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -62.98 -42.2 99.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.314 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.14 -41.71 98.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.701 0.286 . . . . 10.0 110.797 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 82.3 mt -67.05 -43.18 89.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.84 0.352 . . . . 10.0 110.232 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.97 -44.9 83.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.868 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 85.0 t -70.4 -40.22 77.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.716 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -59.19 -41.45 88.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.795 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -60.48 -31.54 70.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.439 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.23 -45.8 79.41 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 179.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -64.77 -37.79 88.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.719 -0.673 . . . . 10.0 109.516 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.478 ' HA ' ' HG3' ' A' ' 759' ' ' MET . 27.1 tt0 -62.57 -41.78 99.15 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.17 -0.923 . . . . 10.0 110.963 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -63.22 -41.08 99.08 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.511 -0.313 . . . . 10.0 111.4 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 39.6 t -67.22 -47.17 82.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.272 -0.422 . . . . 10.0 112.021 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 39.7 t -77.26 -42.06 30.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.207 0.527 . . . . 10.0 111.106 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 120.51 122.55 2.96 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 110.527 -1.029 . . . . 10.0 110.527 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 756' ' ' ALA . . . . . 0.458 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -51.01 -46.03 61.39 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.163 0.431 . . . . 10.0 112.163 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.61 -46.15 91.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.984 0.421 . . . . 10.0 110.949 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 15.6 tpt -66.62 -39.66 88.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.283 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 759' ' ' MET . . . . . 0.478 ' HG3' ' HA ' ' A' ' 751' ' ' GLU . 80.9 mmm -61.79 -41.24 97.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.211 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . 0.458 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.9 mmp_? -60.29 -39.0 85.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.236 0.541 . . . . 10.0 110.119 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -73.2 -34.83 66.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.802 -0.635 . . . . 10.0 109.644 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -66.86 -48.21 69.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.318 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -57.19 -46.06 83.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.082 0.467 . . . . 10.0 110.294 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -60.73 -42.57 97.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.082 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -64.72 -43.3 96.5 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 111.408 -0.677 . . . . 10.0 111.408 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 63.8 t -60.74 -43.23 94.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 11.9 mtp -60.96 -48.2 82.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.085 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 80.9 mt -60.55 -46.64 89.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.704 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -60.88 -52.68 64.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.361 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 9.4 m -60.2 -44.26 95.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.847 0.356 . . . . 10.0 111.358 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -64.32 -42.62 96.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.238 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 772' ' ' ASP . . . . . 0.615 ' O ' ' HG2' ' A' ' 776' ' ' LYS . 15.7 t70 -61.97 -51.27 68.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.806 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 68.5 m -59.12 -44.48 92.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.079 -0.51 . . . . 10.0 112.371 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 23.5 mt -66.53 -35.02 79.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.712 0.291 . . . . 10.0 111.113 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -64.38 -37.6 88.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.991 0.424 . . . . 10.0 110.009 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.615 ' HG2' ' O ' ' A' ' 772' ' ' ASP . 26.6 mmtp -66.63 -41.32 88.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.398 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -63.02 -48.25 79.59 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 778' ' ' HIS . . . . . 0.596 ' O ' ' HG2' ' A' ' 782' ' ' MET . 72.0 t60 -58.78 -35.97 73.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.034 -0.984 . . . . 10.0 111.199 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 21.3 mt -59.55 -47.92 83.66 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.872 0.368 . . . . 10.0 110.306 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -69.51 -38.61 77.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.165 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.32 -36.03 74.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.412 -0.813 . . . . 10.0 111.192 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 782' ' ' MET . . . . . 0.596 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 98.6 mmm -60.56 -41.16 94.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.048 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.93 -41.67 70.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 10.0 110.096 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -62.15 -42.01 98.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.286 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 11.6 tp -67.94 -39.34 83.46 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.154 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -55.12 -36.53 65.83 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.721 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.535 179.585 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo . . . . . 0 CA--C 1.528 0.193 0 N-CA-C 113.131 0.396 . . . . 10.0 113.131 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 28.1 mtmm -66.26 -55.23 17.15 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -63.64 -38.6 91.74 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.677 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.7 -48.39 82.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.04 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -59.91 -40.64 89.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.406 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -62.83 -47.81 81.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.792 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 37.0 ttp85 -62.44 -44.55 96.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.68 0.276 . . . . 10.0 111.002 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -58.5 -52.78 64.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.261 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 11.5 p -65.28 -39.56 92.74 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.297 0.481 . . . . 10.0 112.297 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -65.99 -44.68 84.14 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 121.032 -0.267 . . . . 10.0 110.89 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 17.5 m -65.71 -38.26 88.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.167 0.508 . . . . 10.0 110.102 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 35.0 ttm -63.85 -35.32 80.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.197 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -65.97 -38.9 89.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.271 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.88 92.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.353 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.46 73.86 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.468 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 17.7 ttp -64.53 -42.87 95.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.823 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 81.0 mt -66.07 -36.27 82.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.414 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -64.57 -38.05 89.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.227 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 13.0 m -73.51 -30.14 62.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.105 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 14.1 tp -58.77 -61.64 2.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.134 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -60.01 -36.24 76.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.011 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -60.08 -57.41 12.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.196 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -63.74 -37.67 88.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.836 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 41.1 t -57.91 -51.85 65.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.891 0.377 . . . . 10.0 110.71 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 30.4 mm -68.22 -37.92 78.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.647 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 46.4 t -60.01 -48.42 81.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.169 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 24.6 m -60.43 -40.61 91.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.494 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 96.0 mt -69.65 -23.03 63.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.275 -0.421 . . . . 10.0 111.812 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 7.5 m -93.4 -36.42 12.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.801 0.334 . . . . 10.0 110.481 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 51.2 mttm -67.5 -28.3 67.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.783 -0.644 . . . . 10.0 112.133 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 6.6 p -65.51 112.13 1.68 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 121.573 0.701 . . . . 10.0 109.842 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -94.97 117.59 30.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.188 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 12.1 t . . . . . 0 C--N 1.321 -0.644 0 CA-C-N 115.559 -0.746 . . . . 10.0 109.214 179.335 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.2 t80 . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.667 0.27 . . . . 10.0 110.569 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.41 176.0 14.22 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.899 -0.667 . . . . 10.0 112.541 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.5 127.72 32.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.946 0.403 . . . . 10.0 110.506 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.56 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 8.7 mmt180 -70.22 144.52 51.86 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.62 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.6 m120 73.35 -63.13 0.44 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.097 -0.956 . . . . 10.0 112.059 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.94 -54.47 21.67 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -178.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -86.31 -25.86 25.22 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.966 0.728 . . . . 10.0 112.966 -178.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.0 p -60.61 -46.68 89.37 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.72 -0.392 . . . . 10.0 110.685 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.2 mt -64.46 -31.79 73.15 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.784 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -67.62 -45.78 74.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.072 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -67.4 -44.17 79.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.51 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 39.6 mtt -63.55 -34.04 76.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.88 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.5 tpp180 -61.32 -35.7 78.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.944 0.402 . . . . 10.0 110.304 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -65.52 -39.8 92.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.808 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -69.04 -39.45 79.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.915 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 52.7 t -58.33 -37.51 63.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 121.277 0.56 . . . . 10.0 109.935 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -65.45 -38.74 90.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.334 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 72.1 mt -66.64 -45.02 89.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.075 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.5 mt -59.33 -41.76 85.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.642 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -67.55 -27.69 67.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.074 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.25 -26.66 30.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.064 0.459 . . . . 10.0 110.597 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 8.6 tpt -83.95 -18.72 36.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.629 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.472 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 37.2 tt0 -56.98 -52.01 77.32 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.304 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.472 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 71.5 Cg_exo -53.47 -33.41 67.37 Favored 'Trans proline' 0 C--N 1.36 1.159 0 C-N-CA 121.927 1.751 . . . . 10.0 112.178 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.433 ' CD ' ' HZ2' ' A' ' 37' ' ' LYS . 38.8 tp10 -70.52 -40.31 73.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.168 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.3 mmt -66.59 -29.83 69.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.579 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -66.14 -23.09 66.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.562 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.433 ' HZ2' ' CD ' ' A' ' 34' ' ' GLU . 43.0 mtpt -83.32 -24.2 32.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.046 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp -76.92 142.19 40.2 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.542 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.7 p -82.48 171.12 14.48 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.041 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -57.03 -38.78 73.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.312 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -68.43 -36.33 78.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.904 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.9 -32.11 70.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.285 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.98 -45.4 94.93 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -67.44 -31.45 71.63 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.951 -1.022 . . . . 10.0 109.725 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.81 -37.59 95.11 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.56 -0.746 . . . . 10.0 111.736 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -67.28 -36.26 81.18 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.724 -0.472 . . . . 10.0 109.724 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 19.1 m -58.18 -48.16 81.16 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.162 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.54 -35.25 80.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.342 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.18 -43.2 99.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.553 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -58.79 -43.06 90.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.738 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.7 mtp180 -61.81 -44.23 97.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.656 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 56' ' ' LYS . . . -66.67 -39.41 88.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.267 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 -62.83 -39.29 93.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.555 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 mt -58.09 -37.36 74.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.317 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.15 -37.14 72.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.321 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.432 ' HG3' ' O ' ' A' ' 52' ' ' ALA . 28.4 mtpp -72.72 -9.19 58.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.958 -0.565 . . . . 10.0 111.204 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.67 61.67 0.66 Allowed Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.757 -0.735 . . . . 10.0 111.983 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -116.91 146.1 43.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.718 -0.475 . . . . 10.0 109.718 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 38.2 t -85.84 133.18 30.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.182 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.405 HD12 ' O ' ' A' ' 118' ' ' LEU . 17.8 tp -61.09 -43.89 98.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.918 0.389 . . . . 10.0 110.464 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -65.83 -21.54 66.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.17 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -81.23 -17.36 49.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.243 0.544 . . . . 10.0 110.151 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.1 mt -84.65 -13.29 51.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.079 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.487 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 73.9 mt -50.23 -52.55 52.91 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 113.054 0.761 . . . . 10.0 113.054 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.487 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.0 Cg_exo -53.46 -34.77 73.35 Favored 'Trans proline' 0 C--N 1.36 1.151 0 C-N-CA 122.362 2.041 . . . . 10.0 113.444 -179.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -89.58 -46.59 8.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.46 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.8 -47.92 83.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.996 -178.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -63.33 -32.34 73.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.675 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.91 -43.63 78.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.257 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.08 -47.72 92.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.107 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 46.7 t -59.5 -45.21 94.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.34 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.414 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 19.0 ttm180 -61.0 -44.86 96.8 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.604 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 29.1 tp10 -61.05 -48.4 81.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.376 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.99 -33.27 74.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.079 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 29.8 m -61.04 -35.89 78.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.746 0.307 . . . . 10.0 111.059 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -75.06 -16.89 60.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.296 -0.411 . . . . 10.0 112.028 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -104.24 -35.83 7.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.762 0.315 . . . . 10.0 111.518 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 92.8 t -81.41 -52.52 13.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.614 -0.266 . . . . 10.0 111.64 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -104.22 -14.05 15.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.656 0.265 . . . . 10.0 111.562 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.22 29.09 66.96 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.714 -0.755 . . . . 10.0 111.552 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.5 mtt -126.49 141.23 51.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.799 0.333 . . . . 10.0 110.791 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 37.0 ttt85 -85.59 122.67 30.03 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.95 111.06 1.52 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -47.23 141.12 4.76 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 124.139 0.9 . . . . 10.0 112.307 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -64.17 -34.42 78.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.338 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 m -69.58 -25.19 28.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.847 0.355 . . . . 10.0 110.839 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -71.67 -28.4 63.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.826 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.415 ' O ' ' HG3' ' A' ' 92' ' ' MET . 85.2 mt -62.03 -36.78 82.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.055 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 36.0 mt -66.15 -47.88 72.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.826 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -63.14 -36.45 93.46 Favored Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.712 -0.677 . . . . 10.0 112.164 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.76 -34.57 89.12 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.195 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.415 ' HG3' ' O ' ' A' ' 88' ' ' LEU . 38.4 mtt -74.21 -35.87 63.93 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.2 t -65.47 -43.05 94.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 10.0 110.02 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 84.3 mt -72.92 -5.35 37.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.268 -0.878 . . . . 10.0 111.966 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -83.29 -24.67 32.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.892 0.377 . . . . 10.0 110.383 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -103.37 -146.33 0.37 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.585 -179.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 97' ' ' ARG . 28.7 ttt85 -108.07 58.98 0.61 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.168 0.509 . . . . 10.0 110.189 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 408' ' ' ASP . 0.0 OUTLIER -137.57 150.19 47.28 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.335 0.588 . . . . 10.0 111.981 -178.862 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 50.7 mm -93.46 132.55 37.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.373 -0.831 . . . . 10.0 108.881 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -107.6 120.11 41.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.735 0.302 . . . . 10.0 111.703 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -85.47 125.68 33.22 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.4 mtm -122.48 140.6 52.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.076 0.465 . . . . 10.0 110.886 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.482 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 11.5 mmm180 -77.1 152.19 35.08 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.563 -0.744 . . . . 10.0 111.082 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.65 94.68 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.9 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.2 -33.48 1.23 Allowed Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.824 -0.703 . . . . 10.0 112.353 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.62 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 2.2 mm-40 -65.56 -49.42 68.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.013 0.435 . . . . 10.0 110.292 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 143.79 168.03 12.08 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.753 -0.737 . . . . 10.0 112.085 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.97 -82.63 0.65 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.93 0.395 . . . . 10.0 110.461 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.03 -20.86 66.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.166 0.508 . . . . 10.0 111.117 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 27.7 tp -70.02 -19.96 63.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.252 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 3.2 m -95.72 -36.6 11.13 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.194 0.521 . . . . 10.0 110.654 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.417 ' HB1' ' SD ' ' A' ' 390' ' ' MET . . . -75.98 -4.66 42.35 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.863 0.69 . . . . 10.0 112.863 -178.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.06 -24.28 61.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.947 0.403 . . . . 10.0 111.27 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 17.7 mt -71.15 -57.13 4.95 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-N 116.11 -0.495 . . . . 10.0 111.795 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -61.92 -30.62 83.98 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 122.17 1.914 . . . . 10.0 112.222 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.55 -47.16 73.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.635 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.428 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 65.4 t80 -61.25 -46.15 91.59 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.068 0.461 . . . . 10.0 110.477 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.405 ' O ' HD12 ' A' ' 60' ' ' LEU . 20.5 tp -61.86 -50.39 72.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.629 -0.714 . . . . 10.0 112.007 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -68.2 -28.42 67.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.24 -28.51 67.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.396 0.141 . . . . 10.0 111.34 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 85.9 mt -55.38 -29.24 58.08 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 76.7 p -66.29 -26.82 67.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.632 -0.258 . . . . 10.0 111.363 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.36 -1.33 87.41 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.389 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -76.53 -21.41 55.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.717 0.294 . . . . 10.0 110.953 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 101.12 138.04 10.05 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.708 -0.758 . . . . 10.0 113.778 178.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 68.4 t -107.04 121.39 59.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -98.41 102.7 14.52 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.67 0.271 . . . . 10.0 110.782 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 26.2 t -95.59 125.06 48.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.905 0.384 . . . . 10.0 110.447 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 79.3 t -110.48 117.59 55.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.453 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.87 160.76 14.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.955 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 13.2 m -67.24 -35.25 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -145.63 161.35 40.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.518 -0.31 . . . . 10.0 110.187 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -67.37 -28.83 68.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.697 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -55.3 -53.7 52.83 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.132 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.3 mt -74.23 -32.92 63.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.877 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -53.83 -49.98 67.19 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.833 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -72.1 -36.41 69.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.856 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 17.6 ttp180 -62.61 -59.64 4.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.966 -0.561 . . . . 10.0 112.13 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.63 -29.31 69.32 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.667 -178.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.45 88.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 10.0 110.55 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -75.8 -26.0 56.88 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.154 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . 0.418 ' O ' ' HD2' ' A' ' 145' ' ' PRO . 11.3 t30 -73.43 -40.82 63.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.021 0.439 . . . . 10.0 110.634 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -86.92 -6.81 58.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.367 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.503 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 61.7 ttm-85 -60.01 -49.46 91.06 Favored Pre-proline 0 CA--C 1.537 0.467 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' PRO . . . . . 0.503 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 34.1 Cg_exo -63.81 -10.37 22.25 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 122.155 1.903 . . . . 10.0 112.886 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 20.3 tp -96.07 -48.92 5.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.935 0.398 . . . . 10.0 110.424 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -71.54 -51.11 25.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.012 -0.54 . . . . 10.0 112.18 -178.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -65.27 -23.48 67.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.677 0.275 . . . . 10.0 111.438 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -67.17 -28.92 68.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.105 0.479 . . . . 10.0 110.037 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 43.9 mt -96.9 -2.41 43.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.006 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 98.82 22.8 12.81 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.598 -0.811 . . . . 10.0 113.502 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 43.2 mt -109.76 121.8 46.05 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.7 p -78.4 130.32 35.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.016 0.436 . . . . 10.0 112.024 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 48.3 t -104.74 127.88 58.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.933 -0.576 . . . . 10.0 109.971 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -123.02 142.72 14.73 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.613 -0.803 . . . . 10.0 112.264 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 6.6 tp -112.85 134.55 55.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -121.34 110.29 15.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.856 0.36 . . . . 10.0 110.247 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.486 ' O ' ' HB2' ' A' ' 161' ' ' MET . 94.1 mt -102.4 147.75 34.44 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.617 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' PRO . . . . . 0.514 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 16.7 Cg_endo -58.49 114.26 1.91 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.7 2.267 . . . . 10.0 112.232 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 99.63 6.96 54.36 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.771 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' MET . . . . . 0.486 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.1 OUTLIER -67.27 144.8 98.36 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 110.529 -0.174 . . . . 10.0 110.529 179.57 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -57.3 149.56 64.0 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.635 2.223 . . . . 10.0 112.301 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -52.09 -49.86 82.03 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 112.769 0.655 . . . . 10.0 112.769 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.504 ' O ' ' HG3' ' A' ' 168' ' ' GLU . 53.0 Cg_exo -57.15 -41.39 74.66 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 121.774 1.65 . . . . 10.0 112.029 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -63.08 -44.42 95.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.661 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.449 ' HE2' ' O ' ' A' ' 161' ' ' MET . 59.6 mttm -60.86 -45.44 94.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.432 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -57.83 -42.69 84.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.821 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' GLU . . . . . 0.504 ' HG3' ' O ' ' A' ' 164' ' ' PRO . 58.2 mt-10 -66.28 -39.12 89.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.784 0.326 . . . . 10.0 111.024 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -69.44 -42.56 74.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.584 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -74.7 -31.2 61.8 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.449 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.12 3.26 18.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.882 0.372 . . . . 10.0 110.832 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -84.59 -179.17 7.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.148 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -79.22 -42.59 25.62 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.1 mp -128.78 121.51 54.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.281 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.7 m -108.74 123.34 48.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.84 0.352 . . . . 10.0 111.353 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -102.71 131.26 49.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.747 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.62 176.74 44.05 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.568 -0.825 . . . . 10.0 112.202 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.79 155.79 16.63 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.77 0.319 . . . . 10.0 111.158 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -59.99 -35.4 74.95 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.237 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -55.63 -57.87 10.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.037 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . 0.514 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.6 tp10 -69.53 -36.61 76.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.381 -178.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -58.1 -38.87 77.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.904 0.383 . . . . 10.0 111.308 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -78.23 -42.4 15.29 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.715 -0.755 . . . . 10.0 111.921 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -64.56 -38.17 90.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.767 0.318 . . . . 10.0 111.077 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 185' ' ' ASP . . . . . 0.401 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 10.9 m-20 -60.6 -41.55 94.98 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.47 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -64.51 -38.33 90.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.411 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 18.6 mt -63.85 -44.78 92.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.777 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 39.0 mtm-85 -72.03 -36.05 69.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.868 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -64.14 -47.29 80.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.287 0.565 . . . . 10.0 110.917 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.69 -8.91 57.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.804 -0.634 . . . . 10.0 112.258 -178.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 17.8 ttp -101.08 14.71 31.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.169 0.509 . . . . 10.0 110.75 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -76.42 160.13 29.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.843 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -102.69 -24.16 13.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.176 0.513 . . . . 10.0 110.029 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 67.7 m -129.0 140.84 39.8 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.716 -0.674 . . . . 10.0 109.625 178.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.0 -24.96 75.83 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.847 2.364 . . . . 10.0 112.846 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.83 -9.35 58.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.585 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -91.66 -6.93 51.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.854 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 19.4 mtt85 -58.97 155.94 12.52 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.148 0.499 . . . . 10.0 111.875 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 16.1 m -137.43 -16.29 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.514 -0.766 . . . . 10.0 111.047 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -84.87 -178.5 6.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.324 0.583 . . . . 10.0 111.799 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -143.02 177.22 8.51 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.218 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 32.9 tttm -60.88 133.74 56.39 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.203 0.525 . . . . 10.0 111.201 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 17.4 mt -84.94 69.93 10.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.612 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . 0.412 ' HA ' ' OE2' ' A' ' 385' ' ' GLU . 18.3 t-80 -81.09 -64.66 1.14 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.905 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -124.69 133.76 53.1 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.935 0.397 . . . . 10.0 111.288 -178.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.56 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . . . -119.99 123.3 43.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.626 179.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 53.6 tp -117.09 100.36 7.68 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.073 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -94.04 128.59 45.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.052 0.454 . . . . 10.0 110.579 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -55.99 -72.15 0.08 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.324 -0.853 . . . . 10.0 111.905 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.39 105.45 13.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.638 0.256 . . . . 10.0 110.681 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 27.4 m -68.38 -22.32 27.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.537 -0.302 . . . . 10.0 111.178 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 212' ' ' ASP . . . . . 0.556 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.2 m-20 -45.04 -64.08 0.79 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.026 0.828 . . . . 10.0 111.878 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 213' ' ' SER . . . . . 0.444 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 68.7 m -96.62 -37.08 10.5 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.801 0.667 . . . . 10.0 112.801 -178.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 73.4 mt -64.21 -38.62 82.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -178.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 12.7 mt -102.25 -50.82 3.52 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 216' ' ' ILE . . . . . 0.556 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 50.5 mm -73.62 -56.31 9.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.979 0.733 . . . . 10.0 112.979 -177.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 217' ' ' ASP . . . . . 0.444 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 79.0 m-20 -63.45 -45.74 89.47 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.133 0.42 . . . . 10.0 112.133 -178.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -93.26 28.91 2.05 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -66.97 -48.38 68.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.972 0.415 . . . . 10.0 111.644 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 220' ' ' ARG . . . . . 0.416 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -98.59 18.8 15.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.063 -179.007 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 85.0 m -84.57 113.0 46.41 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.319 -0.401 . . . . 10.0 110.465 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -92.82 135.1 1.25 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.806 2.337 . . . . 10.0 113.17 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 223' ' ' LEU . . . . . 0.637 ' O ' ' HA ' ' A' ' 374' ' ' SER . 96.9 mt -94.48 120.17 34.3 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 21.6 mt -113.99 132.76 62.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.241 0.46 . . . . 10.0 112.241 -178.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 27.9 mt . . . . . 0 C--N 1.327 -0.381 0 N-CA-C 108.767 -0.827 . . . . 10.0 108.767 177.802 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.279 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 374' ' ' SER . . . . . 0.637 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 1.4 t -156.41 142.55 18.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.115 0.483 . . . . 10.0 111.516 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 14.3 tt -146.9 147.39 17.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.794 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.96 142.37 30.54 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -56.74 -49.18 76.0 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 123.036 0.21 . . . . 10.0 111.215 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 378' ' ' GLN . . . . . 0.43 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.5 tm0? -57.07 -43.89 82.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.028 0.442 . . . . 10.0 110.715 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -73.54 -11.36 60.42 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.72 -0.673 . . . . 10.0 111.768 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -93.69 -44.88 7.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.911 0.386 . . . . 10.0 110.329 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -69.36 -21.7 63.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.136 -0.483 . . . . 10.0 111.313 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -72.88 -4.18 30.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.134 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 56.9 mt -97.42 8.57 44.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.937 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . 0.56 ' CD2' ' HB3' ' A' ' 206' ' ' ALA . 27.6 m-85 -99.17 146.44 26.15 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.818 0.342 . . . . 10.0 110.793 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 385' ' ' GLU . . . . . 0.412 ' OE2' ' HA ' ' A' ' 204' ' ' HIS . 34.4 mt-10 -70.37 -65.8 0.68 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.091 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -102.63 104.09 14.43 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 61.5 tp -110.72 110.61 21.33 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.641 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -131.92 165.66 23.41 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.783 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -163.84 162.7 35.31 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.403 -0.903 . . . . 10.0 112.409 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 390' ' ' MET . . . . . 0.417 ' SD ' ' HB1' ' A' ' 112' ' ' ALA . 63.3 mtm -107.82 156.85 18.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.989 0.424 . . . . 10.0 110.399 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 15.3 t -153.59 165.68 35.15 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.21 179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -101.9 -171.25 27.58 Favored Glycine 0 N--CA 1.441 -1.006 0 N-CA-C 110.613 -0.995 . . . . 10.0 110.613 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 393' ' ' THR . . . . . 0.482 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 3.1 m -74.67 66.26 1.43 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.536 0.684 . . . . 10.0 110.589 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -102.76 -45.72 4.92 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.125 -0.943 . . . . 10.0 110.274 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 395' ' ' ASP . . . . . 0.465 ' CG ' ' H ' ' A' ' 396' ' ' THR . 10.0 t70 56.78 -144.35 0.66 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.615 -0.721 . . . . 10.0 110.214 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 396' ' ' THR . . . . . 0.465 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 3.0 m 70.02 -79.88 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.851 0.686 . . . . 10.0 112.851 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -79.31 26.98 0.26 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 10.0 111.683 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 398' ' ' ALA . . . . . 0.449 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -66.21 -35.89 81.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.138 0.494 . . . . 10.0 110.992 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -72.76 -15.58 61.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.598 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -83.88 -21.32 31.99 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.651 -0.25 . . . . 10.0 111.047 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 401' ' ' PHE . . . . . 0.449 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 24.7 m-85 -59.61 -46.67 88.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.056 0.455 . . . . 10.0 110.546 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.55 -0.15 36.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.733 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.3 m -108.26 -43.71 4.3 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.772 0.286 . . . . 10.0 111.772 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 44.6 mt -86.41 -55.18 6.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 405' ' ' TYR . . . . . 0.43 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 60.8 m-85 -100.04 -4.81 29.14 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 31.4 mmtt 60.98 51.09 4.69 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.365 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 26.4 mt -117.65 149.77 40.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.896 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 408' ' ' ASP . . . . . 0.56 ' OD2' ' HD2' ' A' ' 13' ' ' ARG . 21.0 t70 -85.2 170.25 13.04 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 18.2 m -138.71 120.73 15.59 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.835 -0.541 . . . . 10.0 111.605 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 14.0 t -127.35 137.11 58.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.326 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 87.4 t -93.45 133.33 34.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.648 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 59.2 t -91.3 127.07 52.52 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.795 -0.446 . . . . 10.0 109.795 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.66 142.1 69.18 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.522 2.148 . . . . 10.0 112.634 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.41 ' HB ' ' O ' ' A' ' 416' ' ' ARG . 0.2 OUTLIER -64.1 151.55 42.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.584 -0.735 . . . . 10.0 111.604 -179.868 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -70.0 -26.85 64.27 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.178 0.514 . . . . 10.0 110.492 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 416' ' ' ARG . . . . . 0.509 ' HB2' ' O ' ' A' ' 578' ' ' GLN . 58.3 mtm180 -134.14 157.9 76.55 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.84 122.49 11.06 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.28 1.987 . . . . 10.0 111.445 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 3.8 mtm -76.53 100.42 5.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.034 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.6 pt -95.24 51.39 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.303 0.573 . . . . 10.0 110.602 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 30.4 ttp-105 -94.2 116.02 28.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.494 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -84.43 105.04 14.95 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.148 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -88.54 112.47 23.05 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 26.5 mt -93.06 150.62 39.53 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.547 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -62.68 163.69 20.75 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.52 2.147 . . . . 10.0 112.381 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -83.7 133.97 34.78 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.937 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 31.3 mt -105.88 94.72 5.33 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.148 0.499 . . . . 10.0 110.389 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 21.8 t -90.24 119.43 37.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.345 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 428' ' ' TYR . . . . . 0.514 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 3.3 m-85 -105.22 177.86 4.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.043 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 8.8 mmm -77.21 -77.62 0.14 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.862 -0.335 . . . . 10.0 111.409 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 41.4 p -86.09 165.65 16.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.972 0.415 . . . . 10.0 111.431 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.44 -40.17 95.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.691 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.97 82.01 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.129 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -60.96 -42.03 97.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.272 0.558 . . . . 10.0 109.972 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 434' ' ' LYS . . . . . 0.504 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 28.4 ttpt -65.79 -52.42 50.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.369 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 32.3 mm -61.04 -44.1 97.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.342 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.56 -36.99 74.77 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.72 0.295 . . . . 10.0 110.985 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.91 -37.36 70.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.312 179.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 81.1 mt -62.65 -45.59 98.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.155 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 37.8 mm -59.89 -39.95 81.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.6 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -65.66 -43.78 88.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.601 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -60.35 -40.75 91.86 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.167 0.508 . . . . 10.0 110.136 179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 71.9 mt -70.74 -42.48 77.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.724 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -60.07 -42.52 94.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.035 -0.529 . . . . 10.0 111.147 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -73.38 0.79 11.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.159 -0.473 . . . . 10.0 112.202 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 70.3 mtt-85 -117.41 -31.25 5.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.855 0.359 . . . . 10.0 110.917 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.19 -28.31 65.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.229 0.538 . . . . 10.0 109.859 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -80.82 -3.47 51.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.38 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -108.89 -38.85 5.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.876 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 121.05 18.6 3.8 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.722 -0.752 . . . . 10.0 113.004 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -98.5 125.51 42.68 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 122.541 -0.388 . . . . 10.0 111.081 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.12 144.96 48.18 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.767 2.311 . . . . 10.0 111.226 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 84.0 t -125.62 128.04 72.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.978 0.418 . . . . 10.0 111.464 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 58.2 tp -108.46 111.2 22.96 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.182 -0.673 . . . . 10.0 109.182 178.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 47.5 t -94.72 124.42 47.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.523 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -111.3 114.52 3.68 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.839 -0.696 . . . . 10.0 111.898 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 22.8 p -106.17 145.21 31.81 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.712 0.291 . . . . 10.0 110.882 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 23.1 pt -92.71 -2.63 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.781 0.324 . . . . 10.0 111.142 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 59.5 m -149.66 141.48 23.69 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.433 -0.348 . . . . 10.0 110.234 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 17.1 mt -61.69 -34.38 61.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-O 121.111 0.482 . . . . 10.0 110.603 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -56.89 -40.31 75.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.539 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.36 -33.53 69.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.475 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.5 m -62.44 -48.08 81.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.352 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -62.55 -37.78 87.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.203 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 55.8 tp -62.94 -54.85 32.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.341 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.5 p -65.7 -32.65 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.621 -0.263 . . . . 10.0 111.632 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 60.0 m -65.68 -37.56 86.82 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.777 0.322 . . . . 10.0 110.644 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -64.41 -48.47 75.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.523 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . 0.413 ' CD ' ' HZ1' ' A' ' 471' ' ' LYS . 20.9 mm-40 -61.91 -41.24 97.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.122 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 26.4 mt -60.91 -36.05 78.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.675 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.3 m -70.45 -34.89 72.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.11 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.413 ' HZ1' ' CD ' ' A' ' 468' ' ' GLU . 42.5 mtpt -63.98 -37.21 86.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.336 179.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.48 -16.68 51.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.129 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 81.47 29.02 41.43 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.307 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 60.9 mt -94.64 121.31 45.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 110.263 -0.273 . . . . 10.0 110.263 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -59.16 125.67 24.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.658 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 53.0 p-80 -148.6 151.59 35.29 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.762 -178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -134.8 141.06 46.32 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.4 t -105.81 131.29 55.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.818 0.342 . . . . 10.0 110.836 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 67.8 mt -73.08 105.53 4.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.107 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.89 123.84 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.48 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -82.58 -8.82 59.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.043 -0.526 . . . . 10.0 112.209 -178.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -92.85 -53.09 4.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.174 0.512 . . . . 10.0 110.014 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -102.49 96.61 7.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.37 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' HIS . . . . . 0.401 ' HA ' ' HB3' ' A' ' 487' ' ' GLU . 9.9 m170 -66.6 -15.48 63.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.685 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -57.98 -49.26 77.44 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.032 0.444 . . . . 10.0 110.6 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -72.56 -41.52 65.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.73 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.401 ' HB3' ' HA ' ' A' ' 484' ' ' HIS . 1.7 tt0 -55.36 -57.14 13.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.575 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -57.94 -34.2 69.64 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.571 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -67.88 -41.84 82.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.776 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 45.7 mt -69.5 -45.81 77.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.809 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 89.8 t -56.22 -38.38 54.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.402 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -60.82 -26.47 67.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.743 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -124.3 27.61 6.98 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.818 0.342 . . . . 10.0 110.721 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -73.72 -19.81 60.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.124 0.487 . . . . 10.0 110.943 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -90.58 10.39 74.74 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.669 -0.777 . . . . 10.0 112.023 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -67.26 140.29 95.33 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 110.269 -0.271 . . . . 10.0 110.269 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -51.9 123.91 13.47 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.616 2.211 . . . . 10.0 112.918 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 63.62 39.96 8.37 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.388 -0.824 . . . . 10.0 112.483 178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -109.03 118.86 37.89 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 37.1 t -97.07 112.81 29.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.029 0.442 . . . . 10.0 110.426 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.8 m -111.91 128.37 56.12 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.41 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 43.4 mt -109.34 124.76 66.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.896 0.379 . . . . 10.0 110.328 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -120.45 128.98 53.67 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.865 -179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 14.4 m -103.86 120.75 41.65 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.578 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 58.49 77.19 0.31 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.368 0.604 . . . . 10.0 110.453 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.56 133.3 34.45 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.449 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.67 -178.37 4.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.806 -0.633 . . . . 10.0 110.945 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -73.07 164.15 54.93 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.166 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 68.89 -75.44 0.07 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.116 0.567 . . . . 10.0 111.34 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 84.24 143.86 6.05 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.976 -0.631 . . . . 10.0 112.095 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.93 150.73 23.55 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.853 0.359 . . . . 10.0 111.463 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -75.67 95.93 3.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.014 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 71.4 mt -85.47 115.71 27.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.986 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 19.0 t -90.51 140.15 16.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.94 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 61.0 mt -67.91 128.85 38.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.302 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 87.28 9.11 73.59 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.438 -0.665 . . . . 10.0 111.438 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 91.8 -171.7 34.79 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 111.064 -0.814 . . . . 10.0 111.064 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 25.5 p -128.65 110.59 12.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.121 0.46 . . . . 10.0 110.441 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 61.7 p-90 -59.31 -25.32 64.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.568 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -41.63 91.44 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.451 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -73.23 -32.8 64.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.921 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -70.06 -47.49 61.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.194 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.8 m -68.14 -25.5 32.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.937 0.398 . . . . 10.0 110.232 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -80.52 -8.58 59.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.574 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -97.19 10.08 40.42 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.276 0.56 . . . . 10.0 110.645 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 70.8 mt -105.16 141.18 37.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.941 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 48.8 mp0 -73.99 -33.05 63.68 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.248 0.547 . . . . 10.0 109.769 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -137.96 82.08 26.18 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.547 -0.751 . . . . 10.0 109.692 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -78.18 95.01 1.06 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.835 2.357 . . . . 10.0 111.734 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 1.4 p -77.69 160.15 28.66 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.68 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.08 -44.12 70.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 10.0 111.437 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -63.55 -39.95 95.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.437 -0.347 . . . . 10.0 111.238 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.71 -42.37 95.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.669 0.271 . . . . 10.0 110.65 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 92.3 mt -59.88 -44.77 95.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.192 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.19 -36.97 69.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.149 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -64.26 -47.63 78.85 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.583 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 87.9 mt -64.04 -40.41 88.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.652 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -60.78 -37.63 82.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.826 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -65.32 -39.83 92.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.725 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.43 -40.02 67.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.013 -0.54 . . . . 10.0 109.978 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 56.8 t90 -57.69 -40.34 79.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.68 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 64.6 tp60 -56.43 -42.74 78.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.497 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.5 -44.67 93.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.451 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -69.93 -37.49 75.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.8 -0.637 . . . . 10.0 110.525 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 17.6 t-80 -61.26 -51.18 70.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.855 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -68.19 -31.36 70.84 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.639 -0.71 . . . . 10.0 111.312 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -63.67 -36.24 83.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.161 0.505 . . . . 10.0 110.179 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 71.7 t -78.74 -40.1 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.466 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 19.4 tp -59.3 -48.02 83.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.543 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -78.48 2.32 19.38 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.613 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -101.15 -5.06 26.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.808 0.337 . . . . 10.0 110.979 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 116.71 3.31 18.47 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.639 -0.791 . . . . 10.0 112.861 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 75.04 -162.5 53.81 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.993 -0.622 . . . . 10.0 112.632 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 44.3 tp -73.89 120.5 19.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.875 0.369 . . . . 10.0 110.576 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -94.47 123.28 37.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.999 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 36.7 mm -103.2 129.63 54.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.264 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 557' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 10.7 mt -123.84 118.22 53.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.923 0.392 . . . . 10.0 110.207 178.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.16 118.27 5.81 Favored Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 111.28 -0.728 . . . . 10.0 111.28 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 18.8 p -68.89 -38.83 79.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.144 0.497 . . . . 10.0 110.195 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 28.0 mp0 -144.34 158.86 43.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.124 -0.944 . . . . 10.0 109.638 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -104.89 -160.12 0.74 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.62 -0.881 . . . . 10.0 108.62 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -152.32 150.92 30.26 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.769 -0.372 . . . . 10.0 110.552 178.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -51.14 -47.54 62.04 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 123.882 0.739 . . . . 10.0 110.377 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 564' ' ' SER . . . . . 0.428 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.7 OUTLIER -69.2 104.45 2.2 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.225 178.918 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -69.86 -19.99 63.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.105 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 16.1 ttm180 -59.01 -40.92 86.43 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.3 0.572 . . . . 10.0 109.771 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 48.0 mt -79.09 -36.33 18.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.718 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.59 -54.79 41.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.642 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -61.97 -40.1 94.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.149 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -65.0 -31.55 72.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.816 0.341 . . . . 10.0 110.884 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 37.2 tp -76.06 -31.28 58.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.136 0.493 . . . . 10.0 110.355 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 9.6 ttp180 -76.81 -36.4 56.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.66 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.15 36.61 2.37 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 121.071 -0.585 . . . . 10.0 114.137 -178.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -83.89 -44.02 14.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 117.134 0.467 . . . . 10.0 110.095 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 5.9 m -81.76 175.55 10.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.072 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 67.5 45.93 73.87 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.435 -0.888 . . . . 10.0 111.689 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -70.64 118.28 13.24 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.354 -0.239 . . . . 10.0 110.354 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 578' ' ' GLN . . . . . 0.62 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 9.7 tt0 62.45 30.48 17.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.471 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 82.11 51.93 4.25 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.836 -0.62 . . . . 10.0 112.266 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.41 -167.62 1.21 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.375 -0.231 . . . . 10.0 110.375 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -87.03 175.44 8.11 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.252 0.549 . . . . 10.0 111.87 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 153.65 164.62 12.83 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.546 -0.752 . . . . 10.0 111.924 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.0 p -148.06 125.41 11.59 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 110.368 -0.234 . . . . 10.0 110.368 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.17 128.08 54.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.169 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 585' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 1.2 ttm180 -138.62 120.61 15.54 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -111.14 155.53 22.74 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.022 0.439 . . . . 10.0 110.61 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 587' ' ' TYR . . . . . 0.504 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 56.6 m-85 -129.27 166.17 19.97 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.852 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 15.8 tp -161.69 158.31 25.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.533 -0.303 . . . . 10.0 110.274 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 589' ' ' SER . . . . . 0.451 ' OG ' ' HD3' ' A' ' 434' ' ' LYS . 0.7 OUTLIER -123.34 143.82 49.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.306 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 590' ' ' MET . . . . . 0.513 ' SD ' ' HE1' ' A' ' 595' ' ' MET . 92.0 mmm -71.39 -11.64 61.0 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.361 -0.381 . . . . 10.0 111.252 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -108.76 7.64 26.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.538 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -81.66 158.24 24.35 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.341 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -67.38 -30.05 69.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.816 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 13.4 tp -66.89 -25.14 66.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.698 0.285 . . . . 10.0 111.53 -179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.513 ' HE1' ' SD ' ' A' ' 590' ' ' MET . 4.1 tpt -74.2 0.65 13.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.128 0.489 . . . . 10.0 111.127 -179.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -94.52 1.07 55.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.269 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 41.5 pt -72.99 -7.79 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-O 120.637 0.255 . . . . 10.0 111.664 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -81.07 -7.67 59.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.61 -0.268 . . . . 10.0 110.842 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.4 -64.56 0.38 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.498 0.719 . . . . 10.0 111.196 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 4.0 m -77.64 116.59 18.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.795 0.331 . . . . 10.0 110.473 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -62.71 -26.04 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.125 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 76.0 mmt-85 -60.45 -29.44 69.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.21 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 59.9 t -66.68 -51.66 53.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 604' ' ' SER . . . . . 0.548 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 0.7 OUTLIER -63.25 -38.05 89.65 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.989 179.063 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -61.48 -38.69 96.2 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.922 -0.581 . . . . 10.0 112.507 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 42.5 tpp -74.29 -33.52 63.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.955 0.407 . . . . 10.0 110.679 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 51.2 mtt -68.68 -17.91 64.17 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.047 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 608' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 604' ' ' SER . 63.7 mtt180 -77.6 -5.46 50.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.155 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -91.92 8.46 37.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.986 0.422 . . . . 10.0 110.306 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 25.0 tp -73.15 -16.33 61.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 10.0 111.186 -179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 98.79 -43.78 1.82 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.981 -0.628 . . . . 10.0 111.671 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 70.62 -54.97 0.64 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.687 0.795 . . . . 10.0 112.596 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt 59.64 76.13 0.45 Allowed Pre-proline 0 N--CA 1.463 0.219 0 O-C-N 123.448 0.467 . . . . 10.0 110.485 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 614' ' ' PRO . . . . . 0.514 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 32.3 Cg_exo -58.38 96.95 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.454 2.769 . . . . 10.0 113.064 -178.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 130.17 -13.66 5.72 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.778 -0.725 . . . . 10.0 111.92 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -117.16 142.54 46.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.86 0.362 . . . . 10.0 110.253 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -80.59 107.32 13.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.387 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.63 -30.31 49.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.962 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 41.5 74.25 0.11 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.564 0.746 . . . . 10.0 112.68 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 22.6 m170 -117.61 100.37 52.53 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -57.01 -29.28 82.24 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 123.415 2.744 . . . . 10.0 113.982 -178.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 68.3 p-90 -68.79 -20.4 64.33 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.746 -0.382 . . . . 10.0 111.075 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.88 -48.96 73.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.705 -0.48 . . . . 10.0 109.705 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.28 -39.27 82.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.42 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -69.68 -36.29 75.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.891 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -65.15 -44.7 87.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.402 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 75.7 mt -64.44 -42.99 96.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.024 -0.534 . . . . 10.0 110.254 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.81 -38.63 86.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.482 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -67.47 -39.92 85.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.141 179.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -65.69 -44.11 87.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.652 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -61.45 -42.32 98.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.109 0.481 . . . . 10.0 109.743 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -62.28 -30.38 71.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.632 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -64.7 -39.32 93.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.521 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 13.3 t -64.52 -43.13 96.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.428 ' OE2' ' HA ' ' A' ' 564' ' ' SER . 3.6 mm-40 -65.0 -35.7 82.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.865 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 27.9 m -62.92 -42.95 99.97 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.701 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -63.33 -41.74 98.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.394 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . 0.526 HD22 ' NH2' ' A' ' 642' ' ' ARG . 0.6 OUTLIER -59.01 -43.5 91.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.298 -0.865 . . . . 10.0 110.322 179.189 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -67.76 -39.3 84.18 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.869 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 640' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 27.0 t70 -60.06 -35.56 75.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.202 -0.453 . . . . 10.0 110.394 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 66.6 mt -83.29 -36.16 12.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.795 178.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 642' ' ' ARG . . . . . 0.526 ' NH2' HD22 ' A' ' 638' ' ' ASN . 1.7 ttp180 -57.74 -40.47 79.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.419 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 20.2 pttm -69.15 -28.34 66.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.312 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -66.9 -38.26 85.9 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.908 0.385 . . . . 10.0 110.181 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 26.8 mt -66.73 -38.41 86.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.878 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 646' ' ' LEU . . . . . . . . . . . . . 94.9 mt -64.0 -35.02 79.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.698 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 647' ' ' GLU . . . . . 0.444 ' CD ' ' HZ3' ' A' ' 804' ' ' LYS . 3.6 mm-40 -63.73 -19.81 65.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.969 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -100.57 -45.86 5.39 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.323 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -72.1 -28.47 63.32 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.029 0.751 . . . . 10.0 113.029 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -67.16 -22.79 65.75 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.05 0.452 . . . . 10.0 110.554 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 18.7 t -68.88 -48.87 68.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -68.18 -29.52 68.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.437 -0.801 . . . . 10.0 109.579 178.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -60.12 -51.53 69.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.615 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -60.92 -45.83 93.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.769 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -61.32 -42.78 99.24 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.458 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 4.3 ttp-105 -63.39 -42.55 98.82 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.924 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -62.21 -44.35 96.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.592 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.73 -48.68 76.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.592 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.45 -34.64 58.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.599 -0.273 . . . . 10.0 111.547 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -64.98 -44.34 89.64 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.0 m -61.62 -41.75 97.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.014 -0.539 . . . . 10.0 109.921 179.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -65.05 -46.64 80.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.727 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 23.8 ttt-85 -65.08 -43.62 91.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.724 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -66.61 -35.12 79.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.734 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -62.65 -51.2 68.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.081 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 666' ' ' LEU . . . . . 0.485 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 54.4 mt -65.28 -28.81 69.6 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.227 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 27.9 tp -71.21 -40.76 70.95 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.962 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.8 -41.8 74.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.812 -178.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 33.0 m -82.6 158.7 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.38 . . . . 10.0 111.223 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 50.8 m -102.97 -34.04 9.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.752 0.31 . . . . 10.0 111.111 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -90.31 117.07 28.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.848 0.356 . . . . 10.0 110.409 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 8.1 p -123.21 -1.01 6.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.656 0.741 . . . . 10.0 109.947 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 673' ' ' SER . . . . . 0.416 ' OG ' ' HD3' ' A' ' 760' ' ' ARG . 0.3 OUTLIER -54.15 -39.09 66.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.868 -1.06 . . . . 10.0 111.846 -179.209 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -59.44 -48.19 82.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.833 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 1.8 m -64.68 -44.27 90.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.664 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 44.4 mm -57.72 -48.34 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.689 -0.687 . . . . 10.0 111.438 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -66.53 -39.83 88.8 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.605 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 46.3 m -64.42 -46.01 85.09 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.867 0.321 . . . . 10.0 111.867 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 37.9 pt -71.67 -25.29 24.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.472 -0.491 . . . . 10.0 110.642 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 3.4 ttm-85 -58.55 -39.41 80.16 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.848 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -63.23 -43.76 97.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.667 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -70.56 -36.9 73.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.129 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 69.1 t -59.5 -52.21 63.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 120.928 0.394 . . . . 10.0 110.429 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -63.41 -38.75 92.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.919 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 10.2 tttm -58.02 -52.53 65.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.24 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -61.46 -37.69 84.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.033 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 35.8 m -64.14 -41.58 97.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.543 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 94.2 mt -70.53 -42.44 78.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.241 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -56.3 -30.35 62.4 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.042 0.449 . . . . 10.0 111.725 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -66.33 -25.26 66.74 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.77 0.656 . . . . 10.0 112.77 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -120.86 -24.14 5.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.917 0.389 . . . . 10.0 111.445 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 71.3 mt -127.65 103.76 21.77 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.4 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -68.58 128.79 17.69 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.027 1.818 . . . . 10.0 111.338 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -54.79 123.03 12.73 Favored 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 122.695 2.263 . . . . 10.0 112.784 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 61.55 78.76 0.28 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.251 -0.886 . . . . 10.0 111.406 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 17.5 p -145.93 -167.72 2.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.134 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 79.4 mt -85.65 152.54 23.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.64 0.257 . . . . 10.0 110.51 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.73 -31.49 68.35 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.741 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -76.63 -3.42 37.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.591 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.45 3.63 35.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.055 0.455 . . . . 10.0 110.238 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 701' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -100.9 107.78 19.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.939 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -82.34 82.48 7.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.207 0.527 . . . . 10.0 109.582 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 703' ' ' ILE . . . . . 0.539 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 46.8 mm -58.6 -50.82 85.95 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.443 -0.799 . . . . 10.0 111.65 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 704' ' ' PRO . . . . . 0.539 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.2 Cg_exo -57.23 -42.94 57.47 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 121.91 1.74 . . . . 10.0 112.078 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -60.45 -42.96 99.21 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.128 -0.558 . . . . 10.0 111.993 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 47.5 tp -67.73 -39.95 84.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.97 0.414 . . . . 10.0 110.135 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -64.37 -49.29 72.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.482 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -58.29 -35.92 72.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.005 0.431 . . . . 10.0 110.26 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -66.35 -52.36 47.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.673 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 93.8 mt -65.69 -38.66 89.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.751 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -78.33 0.02 27.13 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.847 0.684 . . . . 10.0 112.847 -178.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -127.33 -53.58 1.37 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.846 0.355 . . . . 10.0 111.69 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 713' ' ' ASP . . . . . 0.555 ' O ' ' HE2' ' A' ' 828' ' ' LYS . 0.9 OUTLIER -76.15 -39.08 55.82 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.591 -178.461 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -100.6 -14.67 18.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.607 0.225 . . . . 10.0 111.607 -179.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.48 33.06 18.72 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.337 0.589 . . . . 10.0 110.678 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 49.3 tp -115.45 114.09 24.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.171 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -83.53 115.43 22.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.881 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 50.2 mt -133.14 129.52 20.96 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.121 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -86.04 61.6 5.01 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 123.116 2.544 . . . . 10.0 112.035 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 31.3 mt -60.62 -36.95 73.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.274 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -62.69 -30.86 71.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.972 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.12 -39.31 29.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.157 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 34.0 m0 -61.06 -48.36 82.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.155 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 55.2 tp -69.0 -20.02 64.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.682 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -87.61 -46.01 9.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.762 0.315 . . . . 10.0 111.384 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -81.86 -31.69 31.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.464 -0.334 . . . . 10.0 111.698 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -123.16 76.59 51.68 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 116.622 -0.263 . . . . 10.0 110.959 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.5 -18.87 60.54 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.38 2.053 . . . . 10.0 111.784 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.09 -15.95 63.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.301 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 67.3 mt -66.43 -23.35 66.28 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.766 0.317 . . . . 10.0 110.456 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 57.19 -101.98 0.14 Allowed 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 115.528 -0.76 . . . . 10.0 111.303 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -144.8 -47.02 0.24 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.022 0.439 . . . . 10.0 109.907 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -59.5 -51.07 71.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.118 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 3.1 m -62.69 -31.69 72.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.126 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 8.3 mt -60.74 -42.01 96.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.898 0.38 . . . . 10.0 110.198 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -62.69 -43.44 98.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.707 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -62.07 -39.28 91.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.35 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 27.4 mmm-85 -64.48 -46.41 83.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.317 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 90.2 mt -61.94 -43.47 97.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.278 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 54.1 tp -61.5 -52.67 63.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.912 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -58.8 -41.03 85.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.124 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -62.7 -40.75 98.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.967 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 24.3 p -64.46 -30.13 71.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.903 0.382 . . . . 10.0 110.453 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 744' ' ' ILE . . . . . 0.448 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 78.1 mt -73.28 -47.95 44.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 10.0 109.898 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -49.24 78.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.105 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 76.1 t -60.89 -38.12 78.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.064 0.459 . . . . 10.0 110.401 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -65.5 -42.94 91.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.041 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 748' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 27.0 mt-30 -63.02 -37.36 86.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.367 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 -59.59 -34.97 73.41 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.355 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -76.75 -36.83 56.84 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -61.4 -35.64 78.06 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.016 -0.993 . . . . 10.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -68.88 -14.6 63.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.759 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.47 -37.57 5.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.754 0.312 . . . . 10.0 111.639 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.7 t -84.15 -42.75 17.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.864 0.364 . . . . 10.0 111.364 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 126.07 130.69 3.46 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.905 -0.878 . . . . 10.0 110.905 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 756' ' ' ALA . . . . . 0.584 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -56.35 -54.22 48.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.749 0.309 . . . . 10.0 111.603 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -64.1 -38.1 89.82 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.089 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 14.3 tpt -64.86 -43.85 91.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.318 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 70.0 mmm -60.26 -43.97 95.7 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 116.06 -0.518 . . . . 10.0 111.151 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . 0.584 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 15.6 mmp_? -55.23 -41.78 72.52 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.244 0.545 . . . . 10.0 111.06 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -72.97 -35.2 66.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.265 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -66.84 -45.24 78.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.273 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -58.15 -47.07 84.47 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.641 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 764' ' ' LYS . . . . . 0.485 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 83.0 tttt -61.52 -45.72 92.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.785 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -59.88 -48.31 86.72 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.01 -0.614 . . . . 10.0 111.992 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 55.8 t -63.05 -44.63 99.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.617 0.246 . . . . 10.0 110.879 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 21.4 ttt -60.11 -47.91 83.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.813 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 48.0 mt -63.04 -43.01 99.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.644 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -60.39 -48.27 82.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.926 0.393 . . . . 10.0 110.538 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 11.9 m -62.43 -44.17 97.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.735 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 4.4 tt -61.35 -47.33 86.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.622 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 772' ' ' ASP . . . . . 0.562 ' O ' ' HG3' ' A' ' 776' ' ' LYS . 1.9 t70 -62.03 -47.39 84.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.091 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 29.6 m -59.15 -48.06 82.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.424 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 74.5 mt -65.91 -30.35 70.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.979 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -65.48 -40.88 93.64 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 772' ' ' ASP . 51.5 mttm -63.01 -39.14 93.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.913 -0.585 . . . . 10.0 109.767 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.73 -42.96 94.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.416 178.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 778' ' ' HIS . . . . . 0.483 ' O ' ' HG2' ' A' ' 782' ' ' MET . 47.1 t60 -63.49 -41.02 98.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.371 -0.831 . . . . 10.0 110.575 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 39.5 mt -56.26 -50.59 70.9 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 123.335 0.397 . . . . 10.0 110.421 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -65.62 -44.04 87.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.78 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.2 73.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.671 -179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 782' ' ' MET . . . . . 0.483 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 91.6 mmm -61.0 -41.98 97.56 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.909 0.385 . . . . 10.0 110.929 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -75.49 -33.35 60.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.583 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -60.86 -39.26 88.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.932 0.396 . . . . 10.0 110.257 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.1 tp -76.23 -32.16 58.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.576 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -65.63 -38.96 90.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.617 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.529 179.336 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo . . . . . 0 CA--C 1.526 0.109 0 N-CA-C 113.533 0.551 . . . . 10.0 113.533 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 800' ' ' LYS . . . . . 0.538 ' NZ ' ' HB2' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -78.64 -47.06 17.8 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.859 -0.336 . . . . 10.0 110.354 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -61.92 -40.89 97.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.545 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -64.09 -43.73 94.49 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 92.0 t80 -60.6 -43.34 97.52 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.219 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 804' ' ' LYS . . . . . 0.444 ' HZ3' ' CD ' ' A' ' 647' ' ' GLU . 94.2 mttt -58.3 -50.85 72.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.847 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -59.29 -45.9 90.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.864 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.2 -41.8 93.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.531 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 26.7 m -65.51 -34.76 79.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.904 -0.589 . . . . 10.0 111.146 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 21.6 m-30 -65.81 -43.2 89.35 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.975 0.417 . . . . 10.0 110.042 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 32.2 m -65.93 -36.34 83.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.428 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 29.2 ttm -65.49 -37.59 87.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.25 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -67.98 -43.04 79.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.21 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 812' ' ' ALA . . . . . 0.425 ' O ' ' HG2' ' A' ' 816' ' ' GLU . . . -59.47 -49.14 78.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.965 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.89 -32.33 73.57 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.941 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 29.5 ttp -65.82 -44.55 85.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.008 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.53 -36.48 83.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.511 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 816' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 812' ' ' ALA . 18.0 mm-40 -63.37 -42.03 98.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.299 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 12.8 m -74.09 -29.82 62.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.523 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 50.6 tp -60.46 -58.47 8.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.757 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 40.4 pttt -60.73 -32.63 71.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.541 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -64.57 -59.01 4.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.645 -0.707 . . . . 10.0 111.322 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -60.87 -39.74 90.36 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.339 0.496 . . . . 10.0 112.339 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 54.7 t -57.66 -50.24 78.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.841 0.353 . . . . 10.0 110.66 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.1 -38.72 72.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.904 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 38.6 m -61.93 -40.1 94.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.626 0.25 . . . . 10.0 110.615 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 74.7 m -63.94 -41.26 97.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.709 0.29 . . . . 10.0 110.769 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 87.7 mt -69.76 -19.63 63.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.235 0.54 . . . . 10.0 110.871 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 16.9 m -92.42 -36.82 12.91 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.753 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 828' ' ' LYS . . . . . 0.555 ' HE2' ' O ' ' A' ' 713' ' ' ASP . 44.1 mttm -69.66 -28.99 66.34 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.966 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 5.7 p -66.82 108.15 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.688 0.756 . . . . 10.0 109.908 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -98.73 99.88 11.03 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.75 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 C--N 1.322 -0.6 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.991 179.423 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.8 t80 . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.96 0.409 . . . . 10.0 110.635 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 130.38 178.84 15.64 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.903 -0.665 . . . . 10.0 111.972 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.2 m -68.64 116.58 9.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.801 0.334 . . . . 10.0 110.181 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.515 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 17.3 mmt180 -67.54 155.16 39.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.042 -0.527 . . . . 10.0 111.345 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.3 m120 73.65 -49.56 0.69 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.264 -0.88 . . . . 10.0 112.318 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -90.53 -71.26 0.63 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.824 0.675 . . . . 10.0 112.824 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -65.2 -18.25 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 -177.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.51 -52.74 64.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.684 0.278 . . . . 10.0 111.159 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 mt -67.06 -33.4 75.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.946 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 12.4 ttp-105 -66.78 -45.05 79.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.384 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.54 -28.41 64.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.129 0.49 . . . . 10.0 109.996 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.55 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 45.3 mtt -76.22 -36.23 58.66 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.842 179.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -60.97 -35.64 77.31 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -60.37 -38.0 82.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.432 -0.803 . . . . 10.0 109.532 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -77.1 -35.36 22.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.848 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.9 t -58.13 -36.16 55.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.95 178.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.5 -37.44 87.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.729 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.3 mt -68.3 -44.0 84.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.716 -0.674 . . . . 10.0 109.704 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 77.6 mt -59.78 -40.57 82.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.774 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -63.64 -38.42 91.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.377 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.56 -28.32 65.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.006 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 53.4 mtt -84.11 -17.53 39.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.138 -0.483 . . . . 10.0 111.61 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.491 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 17.9 tt0 -57.46 -54.62 53.11 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-O 119.271 -0.395 . . . . 10.0 111.646 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 38.2 Cg_exo -61.05 -28.25 85.74 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.755 1.637 . . . . 10.0 111.516 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -69.51 -43.99 71.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.613 -0.722 . . . . 10.0 109.924 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 25.9 mmt -69.37 -29.03 66.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.355 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -62.68 -27.24 69.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.768 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -79.97 -16.45 55.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.709 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp -84.01 147.8 27.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.301 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 p -76.6 165.56 24.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.103 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.54 -43.17 84.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.865 0.364 . . . . 10.0 111.449 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -68.59 -28.08 66.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.922 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -69.79 -33.09 71.9 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.669 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.5 mt -61.94 -40.38 95.32 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -67.23 -32.4 73.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.14 -0.936 . . . . 10.0 109.552 178.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.97 -35.99 92.84 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.474 -0.785 . . . . 10.0 111.687 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -65.6 -37.3 86.23 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 28.1 m -61.38 -47.35 86.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.282 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.82 -30.02 70.1 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.236 0.541 . . . . 10.0 110.144 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -66.26 -45.66 79.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.441 -0.799 . . . . 10.0 110.564 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -59.64 -37.95 80.07 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.048 0.452 . . . . 10.0 110.252 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -57.95 -41.74 83.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.729 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.16 -41.47 61.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.994 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -60.48 -36.37 78.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.35 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.39 -38.13 89.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.771 0.319 . . . . 10.0 111.035 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -70.37 -28.12 64.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.421 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -69.16 -33.57 73.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.368 179.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 132.19 16.77 1.34 Allowed Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.532 -0.842 . . . . 10.0 113.069 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -77.3 149.55 35.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.926 0.393 . . . . 10.0 110.145 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.1 t -86.86 131.82 33.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.19 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.54 HD12 ' O ' ' A' ' 118' ' ' LEU . 18.8 tp -58.8 -39.87 82.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.135 0.493 . . . . 10.0 110.864 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.402 ' HG3' ' ND2' ' A' ' 95' ' ' ASN . 14.6 mp0 -68.0 -10.49 54.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.39 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -97.91 -13.52 21.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.301 0.572 . . . . 10.0 110.112 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.5 mt -91.6 -7.06 51.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.887 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.487 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 75.2 mt -49.99 -51.52 60.84 Favored Pre-proline 0 CA--C 1.541 0.622 0 N-CA-C 113.192 0.812 . . . . 10.0 113.192 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.487 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 62.2 Cg_exo -52.08 -51.17 11.73 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 122.085 1.856 . . . . 10.0 113.209 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -71.25 -42.75 68.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.65 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.05 -49.72 76.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.806 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -63.84 -35.2 79.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.321 -0.399 . . . . 10.0 111.025 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.28 -45.58 90.79 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 120.872 0.367 . . . . 10.0 110.494 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 70.1 t -61.74 -47.14 94.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.469 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 63.4 t -61.73 -41.97 92.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.955 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.451 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 7.0 ttm180 -59.43 -49.36 78.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.927 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.432 ' OE1' ' HA ' ' A' ' 73' ' ' GLU . 35.1 tp10 -65.83 -40.21 91.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.917 0.389 . . . . 10.0 110.39 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.71 -32.46 71.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.136 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 17.2 m -68.27 -33.5 74.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.416 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.1 mtmm -72.35 -24.07 61.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.25 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 67.7 mtt180 -97.16 -50.35 4.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 96.8 t -67.5 -61.52 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.713 0.292 . . . . 10.0 111.24 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -82.75 -59.62 2.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.849 0.357 . . . . 10.0 110.937 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 131.08 -27.95 3.74 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.535 -0.626 . . . . 10.0 111.535 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -90.69 138.4 31.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.897 0.379 . . . . 10.0 110.594 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -80.86 139.69 35.8 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.596 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.27 109.0 2.93 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -53.35 147.03 11.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.799 -0.637 . . . . 10.0 111.967 -178.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.07 -35.54 77.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.318 -0.855 . . . . 10.0 111.165 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.2 m -65.62 -28.94 45.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.83 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -75.02 -30.56 61.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.22 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.5 mt -63.31 -36.26 83.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.235 -0.439 . . . . 10.0 109.866 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.9 mt -64.98 -47.94 75.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.83 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -64.75 -39.36 96.59 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.908 -0.663 . . . . 10.0 111.961 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.9 -35.2 91.7 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.021 -0.609 . . . . 10.0 112.301 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.55 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 18.5 ttm -71.03 -34.47 71.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.04 0.447 . . . . 10.0 110.008 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 68.7 t -67.56 -37.04 78.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.505 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.35 6.28 2.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.533 -0.758 . . . . 10.0 112.915 -178.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . 0.402 ' ND2' ' HG3' ' A' ' 61' ' ' GLU . 50.0 t30 -88.82 -20.75 24.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.301 0.572 . . . . 10.0 109.882 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -117.31 -176.95 3.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.405 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 387' ' ' LEU . 6.7 ttt85 -76.36 74.95 3.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.121 0.486 . . . . 10.0 111.037 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -142.81 154.66 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.235 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 36.3 mm -108.61 124.2 64.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.013 -0.736 . . . . 10.0 109.013 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -100.75 111.54 23.79 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.744 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.43 125.39 29.88 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.914 -0.772 . . . . 10.0 108.914 178.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 47.9 ttm -130.56 147.6 52.26 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.006 0.431 . . . . 10.0 110.793 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.512 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 13.0 mmm180 -76.59 153.93 34.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.964 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.32 99.25 1.91 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.022 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 139.42 -23.78 2.82 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.471 -0.871 . . . . 10.0 112.839 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -68.78 -20.48 64.35 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.932 0.396 . . . . 10.0 111.073 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.16 70.48 1.32 Allowed Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 121.039 -0.6 . . . . 10.0 113.065 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.3 ptmm? -68.34 -32.79 73.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.329 . . . . 10.0 110.974 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -36.02 80.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 10.0 111.192 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 24.2 tp -78.07 -18.32 55.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.212 0.529 . . . . 10.0 110.474 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 60.2 m -82.11 -29.43 31.71 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.365 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.44 -23.89 67.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.563 -0.744 . . . . 10.0 112.205 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.18 -23.92 66.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.234 0.457 . . . . 10.0 112.234 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 58.3 mt -70.65 -59.26 3.89 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.156 0.428 . . . . 10.0 112.156 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.36 -28.25 63.15 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.929 1.752 . . . . 10.0 111.883 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.72 -50.19 65.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.459 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.437 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 63.0 t80 -60.87 -45.89 92.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.026 0.441 . . . . 10.0 110.504 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.54 ' O ' HD12 ' A' ' 60' ' ' LEU . 23.9 tp -59.47 -54.61 44.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.865 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -70.5 -20.54 62.83 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.413 0.523 . . . . 10.0 112.413 -178.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.416 ' HB3' ' HB3' ' A' ' 173' ' ' ASP . . . -71.9 -29.79 64.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.729 0.3 . . . . 10.0 110.763 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 65.4 mt -56.8 -25.53 55.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.791 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 73.1 p -69.22 -25.15 64.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.887 0.375 . . . . 10.0 111.35 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 82.15 -1.13 87.81 Favored Glycine 0 CA--C 1.519 0.318 0 C-N-CA 121.019 -0.61 . . . . 10.0 112.624 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -74.13 -33.95 63.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.92 0.39 . . . . 10.0 110.813 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 115.8 131.57 4.91 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.493 -0.86 . . . . 10.0 113.341 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 73.9 t -106.22 112.96 41.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -94.13 105.41 17.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.887 0.375 . . . . 10.0 110.481 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 55.4 t -91.73 116.91 33.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.165 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 82.8 t -98.11 112.54 30.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.323 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.27 158.47 15.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.528 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 16.0 m -66.74 -24.11 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -154.81 170.69 21.04 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.965 -0.383 . . . . 10.0 109.965 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -78.54 -24.24 45.77 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.177 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -62.49 -55.04 31.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.956 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.9 mt -71.11 -29.25 65.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.558 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.67 -53.53 56.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.782 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.21 -30.09 64.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.459 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -63.55 -54.74 31.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.296 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . 0.426 ' HA ' ' HB3' ' A' ' 142' ' ' ASN . 0.5 OUTLIER -75.87 -20.02 58.41 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.711 -0.396 . . . . 10.0 112.034 -178.402 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.65 -35.74 81.54 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -84.47 -27.94 27.13 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.189 -0.914 . . . . 10.0 110.05 178.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . 0.426 ' HB3' ' HA ' ' A' ' 139' ' ' ASP . 38.8 t30 -67.82 -47.57 68.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.093 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -86.48 -4.92 59.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.541 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.494 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 56.1 ttm-85 -58.82 -49.86 91.14 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 27.6 Cg_exo -63.6 -7.3 12.35 Favored 'Trans proline' 0 C--N 1.36 1.171 0 C-N-CA 122.32 2.013 . . . . 10.0 113.031 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 19.8 tp -100.35 -50.14 4.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.948 0.404 . . . . 10.0 110.346 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -65.83 -50.6 64.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.667 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -67.12 -21.15 65.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.885 0.374 . . . . 10.0 111.119 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -69.4 -34.63 74.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.312 0.577 . . . . 10.0 109.613 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . 0.411 HD11 ' CE1' ' A' ' 117' ' ' TYR . 39.5 mt -89.26 -22.65 22.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.262 -0.881 . . . . 10.0 110.72 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.7 4.44 11.74 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.21 -0.995 . . . . 10.0 113.831 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 36.6 mt -88.86 134.15 34.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.949 0.375 . . . . 10.0 110.135 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 7.0 p -83.4 128.1 34.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.388 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 4.8 t -104.52 111.87 35.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.858 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -107.91 145.03 16.18 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 111.647 -0.581 . . . . 10.0 111.647 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.4 tp -122.08 127.36 75.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 120.798 0.332 . . . . 10.0 110.153 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -112.21 115.08 28.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.122 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 92.2 mt -107.97 148.29 37.14 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.31 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' PRO . . . . . 0.496 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 19.2 Cg_endo -58.91 112.46 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 122.71 2.273 . . . . 10.0 112.691 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.75 -1.53 48.74 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.689 -0.767 . . . . 10.0 112.927 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' MET . . . . . 0.5 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 49.9 ttm -59.2 138.31 88.31 Favored Pre-proline 0 C--N 1.326 -0.424 0 C-N-CA 122.195 0.198 . . . . 10.0 110.745 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -53.68 144.42 53.49 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.812 2.341 . . . . 10.0 112.654 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . 0.459 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.18 -49.08 86.7 Favored Pre-proline 0 CA--C 1.54 0.584 0 N-CA-C 113.202 0.816 . . . . 10.0 113.202 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.459 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 31.9 Cg_exo -60.38 -32.78 94.38 Favored 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 121.771 1.647 . . . . 10.0 112.26 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.13 -37.85 63.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.577 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.5 ' HE2' ' O ' ' A' ' 161' ' ' MET . 60.6 mttm -60.49 -40.5 91.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.708 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -64.23 -27.97 69.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.116 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -78.12 -18.92 55.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.971 0.415 . . . . 10.0 110.779 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -96.27 -39.64 9.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.932 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -73.08 -27.02 61.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.327 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . 0.46 ' HA ' ' NE ' ' A' ' 201' ' ' ARG . . . -82.99 -3.23 56.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.959 0.409 . . . . 10.0 110.784 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -80.25 169.64 17.5 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.408 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . 0.416 ' HB3' ' HB3' ' A' ' 120' ' ' ALA . 11.9 m-20 -64.9 -47.25 78.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.199 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.8 mp -124.04 130.33 73.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.142 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.7 m -118.49 112.19 19.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.853 0.359 . . . . 10.0 111.16 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -88.73 137.54 32.23 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.492 -0.558 . . . . 10.0 109.492 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -174.63 174.88 46.8 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.219 -0.991 . . . . 10.0 112.898 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.59 149.06 21.86 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.608 0.242 . . . . 10.0 110.777 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -58.4 -38.02 76.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.729 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -59.19 -52.26 66.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.364 -179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . 0.496 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.5 tp10 -68.18 -38.02 81.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.836 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -57.99 -37.59 74.54 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.99 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -73.54 -43.35 37.23 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.929 -0.653 . . . . 10.0 111.848 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -65.51 -38.84 90.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.695 0.283 . . . . 10.0 110.628 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 185' ' ' ASP . . . . . 0.432 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 20.2 m-20 -60.54 -44.13 96.44 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.008 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -61.94 -39.97 93.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.568 -0.742 . . . . 10.0 110.449 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 75.8 mt -66.98 -44.1 81.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.509 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 56.9 mtm-85 -63.81 -41.69 97.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.781 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.44 -31.22 72.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.267 0.556 . . . . 10.0 110.88 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -80.1 -14.87 58.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.163 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 35.6 mtp -103.66 17.08 24.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.963 0.411 . . . . 10.0 111.099 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -80.35 162.24 24.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.333 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -104.13 -25.12 13.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.342 0.592 . . . . 10.0 109.927 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -128.6 139.3 35.18 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.56 -0.746 . . . . 10.0 109.357 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.58 -22.7 73.35 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.528 2.152 . . . . 10.0 111.983 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 48.0 mp0 -71.83 -15.88 62.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.14 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -84.61 -17.78 37.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.272 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 24.6 mtt85 -55.36 137.85 47.0 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 123.481 0.488 . . . . 10.0 111.53 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 22.6 m -110.15 -20.38 6.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.998 -0.547 . . . . 10.0 111.287 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -90.74 -175.09 4.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.339 0.59 . . . . 10.0 111.552 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 201' ' ' ARG . . . . . 0.46 ' NE ' ' HA ' ' A' ' 171' ' ' ALA . 11.2 mtm180 -140.29 -174.41 3.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.611 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 26.5 mttm -55.61 137.83 48.24 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.239 0.542 . . . . 10.0 111.804 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 18.5 mt -86.37 66.65 9.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.619 -0.719 . . . . 10.0 109.692 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -74.68 -72.7 0.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.661 -0.7 . . . . 10.0 112.235 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 205' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 386' ' ' LYS . 29.1 t80 -122.33 135.91 54.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.008 0.432 . . . . 10.0 111.778 -177.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.51 ' HB3' ' CD1' ' A' ' 384' ' ' TYR . . . -128.07 123.74 35.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.369 -0.832 . . . . 10.0 109.499 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 64.4 tp -119.83 110.52 16.86 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.334 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -100.54 130.62 49.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.355 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -58.47 -65.38 0.66 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.798 -0.637 . . . . 10.0 111.984 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 210' ' ' GLU . . . . . 0.458 ' OE2' ' HA ' ' A' ' 391' ' ' THR . 17.6 tp10 -112.75 110.39 20.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.006 0.432 . . . . 10.0 110.482 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 28.4 m -82.91 -18.83 10.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.237 -0.438 . . . . 10.0 112.083 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 212' ' ' ASP . . . . . 0.465 ' OD1' ' HD2' ' A' ' 566' ' ' ARG . 7.2 t70 -51.87 -72.22 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.23 19.24 2.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.749 0.648 . . . . 10.0 112.749 -177.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 36.3 mt -125.04 -50.52 2.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.624 -0.431 . . . . 10.0 112.002 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 18.8 mt -82.7 -30.31 29.25 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 35.0 mm -98.43 -50.99 10.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.785 -0.366 . . . . 10.0 111.466 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.56 -46.54 72.42 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.02 0.378 . . . . 10.0 112.02 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -95.89 31.97 1.99 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.687 0.28 . . . . 10.0 111.602 -178.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -72.91 -51.94 16.61 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.826 0.346 . . . . 10.0 111.789 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 220' ' ' ARG . . . . . 0.474 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -93.8 22.06 5.95 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -178.085 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 4.1 m -88.74 108.99 26.46 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.94 -0.392 . . . . 10.0 109.94 178.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 222' ' ' PRO . . . . . 0.474 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 87.0 Cg_endo -93.47 134.16 0.98 Allowed 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.054 2.503 . . . . 10.0 113.789 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 223' ' ' LEU . . . . . 0.571 ' O ' ' HA ' ' A' ' 374' ' ' SER . 86.5 mt -94.04 110.46 22.15 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.875 -0.787 . . . . 10.0 108.875 178.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.72 125.59 61.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 120.809 0.338 . . . . 10.0 111.32 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 54.0 mt . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 178.49 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.403 0 N-CA-C 109.683 -0.488 . . . . 10.0 109.683 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 374' ' ' SER . . . . . 0.571 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 7.5 t -155.55 147.82 23.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.809 0.338 . . . . 10.0 111.031 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.3 tt -157.06 147.08 11.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.021 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 4.0 p -97.31 148.77 22.8 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -57.68 -41.75 82.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.712 0.291 . . . . 10.0 110.889 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -33.06 72.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.375 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 -90.01 -8.44 51.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.775 0.321 . . . . 10.0 111.119 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -87.61 -43.52 11.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.113 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -72.96 -11.25 60.5 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.267 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 44.5 mtp180 -77.86 -9.72 59.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.023 0.439 . . . . 10.0 110.304 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 30.3 mt -94.77 -8.25 38.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.502 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . 0.51 ' CD1' ' HB3' ' A' ' 206' ' ' ALA . 18.5 m-85 -84.96 132.89 34.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.684 0.278 . . . . 10.0 111.208 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -64.15 -56.09 17.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.197 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 386' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 205' ' ' TYR . 69.1 mttt -110.56 113.14 25.53 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . 0.572 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 41.5 tp -122.25 124.68 44.34 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.257 -0.428 . . . . 10.0 110.082 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -140.64 160.04 40.88 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.595 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -166.53 164.21 37.51 Favored Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.381 -0.914 . . . . 10.0 112.368 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 62.4 mtm -119.03 171.65 8.11 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.877 -0.416 . . . . 10.0 109.877 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 391' ' ' THR . . . . . 0.458 ' HA ' ' OE2' ' A' ' 210' ' ' GLU . 1.9 t -162.55 158.31 23.32 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.881 0.372 . . . . 10.0 110.782 179.093 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -81.76 -171.32 45.62 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.916 -0.659 . . . . 10.0 111.843 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 393' ' ' THR . . . . . 0.512 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 1.9 m -73.56 79.59 1.47 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.228 0.537 . . . . 10.0 111.136 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -119.89 -60.86 1.67 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.56 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 395' ' ' ASP . . . . . 0.466 ' CG ' ' H ' ' A' ' 396' ' ' THR . 9.9 t70 58.8 -145.84 0.54 Allowed 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.262 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 396' ' ' THR . . . . . 0.466 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 5.3 m 69.56 -79.53 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.101 0.56 . . . . 10.0 112.169 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -86.26 26.49 1.04 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.129 0.49 . . . . 10.0 110.444 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -69.86 -29.72 67.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 10.0 111.238 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -64.13 -23.87 67.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.063 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 400' ' ' GLU . . . . . 0.464 ' HA ' ' OE1' ' A' ' 400' ' ' GLU . 5.0 mm-40 -68.93 -24.06 64.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.875 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 401' ' ' PHE . . . . . 0.428 ' HB3' ' HB2' ' A' ' 407' ' ' LEU . 39.2 m-85 -64.09 -31.81 73.14 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 178.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.23 -27.41 26.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.262 -0.881 . . . . 10.0 110.539 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 2.6 m -73.01 -39.54 65.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.806 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 17.4 mt -98.96 -53.66 7.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 113.451 0.908 . . . . 10.0 113.451 -177.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -99.64 -2.0 36.62 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.802 0.667 . . . . 10.0 112.802 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt 63.16 29.8 16.05 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.45 0.469 . . . . 10.0 111.659 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 407' ' ' LEU . . . . . 0.428 ' HB2' ' HB3' ' A' ' 401' ' ' PHE . 5.3 mt -84.94 138.58 32.41 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.617 -0.265 . . . . 10.0 111.065 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 408' ' ' ASP . . . . . 0.515 ' OD2' ' HD2' ' A' ' 13' ' ' ARG . 22.0 t70 -81.41 160.09 24.14 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 6.8 m -114.4 115.5 27.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.986 0.422 . . . . 10.0 111.733 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.61 138.28 54.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.016 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 44.7 t -104.32 125.55 59.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.73 0.3 . . . . 10.0 110.752 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 94.4 t -84.0 127.66 66.03 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.497 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.32 136.6 47.88 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.665 2.244 . . . . 10.0 112.41 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.8 149.87 45.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.651 -0.704 . . . . 10.0 111.016 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -58.4 -50.23 74.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.146 0.498 . . . . 10.0 110.066 179.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -114.34 158.71 39.12 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.94 114.12 2.16 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.239 1.959 . . . . 10.0 111.333 178.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 54.0 ttp -68.55 113.44 6.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.092 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 34.3 mt -98.67 73.12 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.335 0.588 . . . . 10.0 109.827 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -102.04 116.48 32.77 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.024 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -84.96 99.23 10.85 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.71 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.23 110.52 16.78 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.734 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 51.4 mt -100.55 132.28 22.58 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.101 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.86 144.7 54.28 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.936 2.424 . . . . 10.0 113.544 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.83 138.83 48.57 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.506 -0.77 . . . . 10.0 109.825 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 15.4 mt -113.56 118.54 34.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.991 0.424 . . . . 10.0 110.549 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 91.3 t -99.7 122.23 51.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.598 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 428' ' ' TYR . . . . . 0.478 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 5.0 m-85 -109.76 176.36 5.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.252 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -80.25 -79.28 0.15 Allowed 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.972 -0.291 . . . . 10.0 110.99 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 70.1 p -82.24 160.23 23.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.737 0.303 . . . . 10.0 110.993 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -62.5 -33.52 75.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.371 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.79 80.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.595 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.51 -42.77 99.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.247 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.09 -50.08 73.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.566 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 51.4 mm -62.88 -44.3 99.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.598 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.6 -41.88 86.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.615 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.23 -36.97 85.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.339 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 90.6 mt -64.24 -47.92 87.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.769 178.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 46.6 mm -59.78 -40.24 82.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.081 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -62.05 -44.57 96.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.443 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -63.58 -36.62 84.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.609 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 96.4 mt -72.24 -42.75 66.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.445 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -48.52 -53.93 16.28 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.971 0.73 . . . . 10.0 112.971 -179.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -62.49 -41.84 99.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.967 0.413 . . . . 10.0 111.866 -178.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.41 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 76.2 mtt-85 -71.26 -35.79 71.51 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.18 0.437 . . . . 10.0 112.18 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 24.8 m -66.43 -33.89 76.72 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.258 0.551 . . . . 10.0 110.146 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -70.69 -46.14 63.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.37 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.63 -44.89 76.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.357 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 120.9 32.45 1.08 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.43 -0.891 . . . . 10.0 112.97 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 450' ' ' GLN . . . . . 0.41 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 61.9 tt0 -104.04 125.82 33.41 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.871 0.335 . . . . 10.0 110.16 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.38 136.51 47.31 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.553 2.168 . . . . 10.0 111.697 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 59.5 t -124.57 122.61 64.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.04 0.448 . . . . 10.0 111.62 -178.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 52.2 tp -108.33 110.0 21.46 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 19.9 t -89.61 113.83 26.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.464 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -93.66 123.78 7.56 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.79 -0.719 . . . . 10.0 111.664 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 34.2 p -122.9 130.47 52.89 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.591 0.234 . . . . 10.0 110.695 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 30.0 pt -95.73 -8.76 9.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.103 0.478 . . . . 10.0 110.296 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.79 126.13 45.13 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.769 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 47.0 mt -57.73 -37.09 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-O 121.051 0.453 . . . . 10.0 111.517 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -56.19 -42.95 77.94 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.142 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . 0.495 ' HZ1' ' CD ' ' A' ' 560' ' ' GLU . 0.8 OUTLIER -72.91 -28.93 62.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.314 -178.922 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.5 m -62.44 -47.65 83.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.247 0.546 . . . . 10.0 109.685 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -68.45 -35.4 77.54 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.718 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 50.7 tp -63.79 -52.45 60.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.799 -0.637 . . . . 10.0 111.356 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 8.8 p -67.16 -31.62 54.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.847 0.356 . . . . 10.0 110.812 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 5.6 t -65.59 -38.96 90.98 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.72 -0.474 . . . . 10.0 109.72 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -62.35 -51.05 69.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.41 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -60.58 -41.19 94.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.39 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.64 -38.42 87.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.761 0.315 . . . . 10.0 110.755 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.0 m -68.51 -36.88 79.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.326 0.584 . . . . 10.0 110.058 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -67.64 -23.31 65.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.854 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -95.5 -3.09 47.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.009 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 72.65 14.15 77.91 Favored Glycine 0 C--N 1.329 0.169 0 C-N-CA 121.013 -0.613 . . . . 10.0 112.481 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 94.5 mt -78.4 120.86 30.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.837 0.351 . . . . 10.0 110.23 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -65.93 117.34 8.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.019 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -145.56 158.21 43.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.171 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . 0.482 ' ND2' HD12 ' A' ' 490' ' ' ILE . 8.1 t30 -132.1 144.76 50.95 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.255 179.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 17.2 t -104.63 132.12 52.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.967 -0.382 . . . . 10.0 109.967 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 88.4 mt -86.31 93.84 9.19 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.122 0.486 . . . . 10.0 110.425 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -85.37 119.81 26.15 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.413 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -64.62 -25.06 67.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.901 -0.59 . . . . 10.0 112.179 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -69.68 -23.1 63.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.042 0.449 . . . . 10.0 110.701 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -120.06 64.84 0.82 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.644 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -24.36 67.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.593 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.38 -33.22 75.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.085 0.469 . . . . 10.0 110.05 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -89.88 -40.49 12.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.955 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.01 -51.92 62.43 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.659 -0.7 . . . . 10.0 111.515 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -56.46 -32.47 64.97 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 112.4 0.518 . . . . 10.0 112.4 -178.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -73.49 -37.52 65.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.033 0.444 . . . . 10.0 110.754 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' ILE . . . . . 0.482 HD12 ' ND2' ' A' ' 477' ' ' ASN . 28.8 mt -76.55 -41.43 34.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.329 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 66.6 t -57.22 -34.75 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-O 121.073 0.463 . . . . 10.0 110.744 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -63.43 -22.34 66.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.57 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 -120.03 22.44 11.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.64 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -71.6 -16.66 62.3 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.997 0.427 . . . . 10.0 111.144 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -95.39 16.44 61.26 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.854 -0.688 . . . . 10.0 111.862 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -74.39 141.09 76.44 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 110.134 -0.321 . . . . 10.0 110.134 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.38 125.6 19.7 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.452 2.101 . . . . 10.0 112.51 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.24 29.8 4.48 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.697 -0.683 . . . . 10.0 112.35 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -105.66 114.61 28.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.832 0.348 . . . . 10.0 110.341 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 23.4 t -98.7 118.4 45.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.198 -0.455 . . . . 10.0 109.892 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.62 138.18 54.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.061 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 41.2 mt -109.98 129.36 65.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.727 -0.471 . . . . 10.0 109.727 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -121.42 129.45 53.01 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.818 0.342 . . . . 10.0 111.066 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 7.4 m -104.89 119.55 39.28 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.464 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 66.8 t30 59.21 77.3 0.32 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.953 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -78.03 123.61 27.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.482 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -70.51 172.74 7.96 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.172 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -65.64 152.95 51.49 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.044 -0.598 . . . . 10.0 112.578 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 67.78 -81.91 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.162 0.585 . . . . 10.0 111.502 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 87.33 149.15 15.23 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.967 -0.635 . . . . 10.0 112.37 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.96 151.07 31.39 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 122.666 0.387 . . . . 10.0 111.527 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -76.27 103.65 6.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.447 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 66.8 mt -84.97 111.29 20.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.209 -0.45 . . . . 10.0 109.98 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 18.4 t -80.5 132.49 31.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.736 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 65.4 mt -67.42 130.39 42.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.703 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 94.32 -11.42 70.41 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.986 -0.626 . . . . 10.0 111.786 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 117.13 -170.78 13.56 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 110.914 -0.874 . . . . 10.0 110.914 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 5.1 p -129.19 99.49 5.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 117.206 0.503 . . . . 10.0 110.993 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 20.0 p-90 -58.28 -28.48 65.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.88 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -62.88 -31.38 72.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.871 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -86.48 -34.26 20.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.057 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -64.76 -40.76 95.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.716 -0.675 . . . . 10.0 111.169 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.9 m -73.42 -19.9 18.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.979 0.419 . . . . 10.0 110.708 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -87.31 -6.81 58.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.728 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -91.47 3.57 54.65 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.486 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 16.5 mt -97.83 150.33 21.39 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.26 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -74.83 -49.08 21.89 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -126.63 90.59 49.41 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.535 -0.542 . . . . 10.0 109.535 179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.3 113.46 2.26 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.765 2.31 . . . . 10.0 112.504 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -104.18 149.0 25.66 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.525 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.38 -37.17 64.68 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.689 0.281 . . . . 10.0 111.465 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -58.19 -36.28 72.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.87 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -81.95 -40.49 22.18 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.793 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 76.7 mt -58.81 -48.04 87.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.353 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -72.41 -29.07 63.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.81 0.338 . . . . 10.0 110.859 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -69.59 -50.74 41.66 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 94.2 mt -62.81 -36.23 74.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.141 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -59.78 -42.16 92.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.023 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -70.06 -45.29 67.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.566 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.19 -47.08 84.54 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.331 0.586 . . . . 10.0 110.065 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -62.46 -40.66 97.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.334 -0.848 . . . . 10.0 110.427 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -55.21 -42.51 73.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.854 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 61.9 t -65.79 -47.81 84.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.437 179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 10.0 mtp180 -62.67 -37.84 88.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.572 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -60.71 -49.05 79.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.326 -0.852 . . . . 10.0 111.058 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -70.15 -27.34 64.47 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.537 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -65.27 -35.55 81.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.106 0.479 . . . . 10.0 109.991 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 95.6 t -73.46 -33.97 41.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.576 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 88.6 mt -58.88 -50.4 74.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.322 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -69.07 -24.78 64.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.916 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -72.12 -23.42 61.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.24 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 122.46 5.15 8.69 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.362 -0.923 . . . . 10.0 113.477 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 79.24 -169.03 53.61 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.732 -0.747 . . . . 10.0 112.678 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 52.9 tp -69.2 123.06 20.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.865 0.364 . . . . 10.0 110.693 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -101.59 123.23 45.27 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.965 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 21.8 mm -106.89 131.49 56.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.335 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 25.5 mt -119.24 124.41 73.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.054 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . 0.531 ' HA2' ' CD2' ' A' ' 586' ' ' PHE . . . -101.68 125.6 8.61 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.991 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 2.0 p -83.02 -30.41 28.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.24 0.543 . . . . 10.0 110.428 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . 0.495 ' CD ' ' HZ1' ' A' ' 461' ' ' LYS . 0.5 OUTLIER -153.6 152.75 31.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.043 -0.98 . . . . 10.0 109.134 179.477 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 37.4 mtt-85 -101.16 158.76 15.79 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.195 -0.298 . . . . 10.0 110.195 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -87.41 152.58 22.13 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.012 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.25 -45.25 95.31 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 3.9 p -89.22 128.61 35.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.487 -0.779 . . . . 10.0 109.874 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 565' ' ' ARG . . . . . 0.433 ' HB3' ' CG2' ' A' ' 396' ' ' THR . 16.2 tpt180 -70.91 -21.59 62.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.535 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 566' ' ' ARG . . . . . 0.465 ' HD2' ' OD1' ' A' ' 212' ' ' ASP . 3.2 mtm180 -54.65 -52.6 61.79 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.954 0.407 . . . . 10.0 110.796 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 46.5 mt -80.03 -30.75 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.54 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -62.42 -40.34 96.23 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.77 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -69.13 -31.81 70.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.791 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -65.12 -28.22 69.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.998 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 35.7 tp -74.4 -26.96 60.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.109 0.48 . . . . 10.0 110.375 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 20.9 ttp180 -84.82 -27.47 26.76 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.518 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -84.03 29.64 3.79 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.991 -0.623 . . . . 10.0 113.499 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -82.17 -44.33 16.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 117.001 0.401 . . . . 10.0 110.211 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 1.2 m -87.97 172.45 9.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.938 -0.573 . . . . 10.0 110.201 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 69.38 42.3 74.66 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.568 -0.825 . . . . 10.0 112.337 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -82.36 135.88 35.09 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 64.61 18.02 11.18 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.131 0.491 . . . . 10.0 110.018 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 80.84 43.92 8.66 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.696 -0.684 . . . . 10.0 111.825 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -99.29 -163.84 1.07 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.513 -0.18 . . . . 10.0 110.513 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -93.73 173.1 7.85 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.232 0.539 . . . . 10.0 111.791 -179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 159.29 166.69 18.75 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.761 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 p -147.6 138.37 23.37 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.761 0.281 . . . . 10.0 110.326 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 12.6 m -123.06 132.08 53.97 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.605 -0.271 . . . . 10.0 110.681 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -146.21 128.31 15.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.091 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 586' ' ' PHE . . . . . 0.531 ' CD2' ' HA2' ' A' ' 558' ' ' GLY . 18.1 m-85 -114.84 146.96 40.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.039 0.447 . . . . 10.0 110.646 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -126.5 135.38 51.25 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 63.9 mt -133.91 160.0 39.0 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.697 0.284 . . . . 10.0 110.699 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 25.5 p -130.88 164.75 24.56 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.003 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 78.5 mmm -76.22 -2.52 31.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.92 0.391 . . . . 10.0 111.117 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -98.01 1.93 48.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.366 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -88.41 142.69 27.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.78 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -65.26 -13.73 59.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.547 -0.751 . . . . 10.0 112.34 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.38 -23.95 67.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.918 0.39 . . . . 10.0 110.858 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 19.5 mmt -77.52 -3.79 42.35 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.916 0.389 . . . . 10.0 111.159 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -92.4 -15.33 27.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.771 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 29.1 pt -67.3 -14.29 17.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-O 120.999 0.428 . . . . 10.0 111.241 -179.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -76.53 -10.65 59.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.046 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.83 -55.93 0.65 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.458 0.703 . . . . 10.0 110.781 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 7.3 m -93.91 103.64 15.73 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -16.52 39.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.871 -0.604 . . . . 10.0 112.113 -178.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 4.4 mmt180 -63.0 -32.78 74.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.696 0.284 . . . . 10.0 110.552 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 50.7 t -68.0 -48.89 72.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.281 -0.418 . . . . 10.0 109.938 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.1 -38.47 85.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.32 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -64.6 -26.57 71.0 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.946 -0.57 . . . . 10.0 112.489 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 58.2 tpp -68.93 -18.04 64.04 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.113 0.482 . . . . 10.0 110.572 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 59.7 mtt -76.58 -14.98 59.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.257 -0.428 . . . . 10.0 110.522 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 36.5 mtt-85 -72.07 -12.97 61.46 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.23 0.538 . . . . 10.0 110.358 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 10.6 mmmt -82.93 1.99 36.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.889 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 5.2 mp -75.91 -14.87 60.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.572 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 92.35 -31.73 5.89 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.973 -0.632 . . . . 10.0 111.774 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 612' ' ' MET . . . . . 0.401 ' HG3' ' HA ' ' A' ' 428' ' ' TYR . 0.0 OUTLIER 69.78 -66.8 0.25 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 123.539 0.736 . . . . 10.0 111.69 179.763 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp 57.42 78.32 0.37 Allowed Pre-proline 0 CA--C 1.53 0.198 0 O-C-N 123.524 0.515 . . . . 10.0 111.131 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 614' ' ' PRO . . . . . 0.478 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 52.3 Cg_exo -56.56 119.12 6.13 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.142 2.561 . . . . 10.0 112.506 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 101.74 -9.32 56.88 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.893 -0.67 . . . . 10.0 111.891 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -111.05 120.11 41.26 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.992 0.425 . . . . 10.0 110.347 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -79.28 96.93 6.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.618 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.2 tp -72.24 -23.22 21.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.841 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 46.98 83.65 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.797 0.685 . . . . 10.0 112.524 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -116.79 94.03 42.87 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.273 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -61.44 -29.22 84.87 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.102 2.535 . . . . 10.0 113.447 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 70.1 p-90 -65.36 -25.75 67.71 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.886 -0.326 . . . . 10.0 110.996 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 73.1 t -67.85 -42.36 85.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 1.8 m -62.74 -38.85 92.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.445 -0.798 . . . . 10.0 110.081 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -68.97 -39.18 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.177 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -61.68 -38.4 87.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.231 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.76 -43.64 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.935 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 628' ' ' ALA . . . . . 0.435 ' O ' ' HG3' ' A' ' 632' ' ' ARG . . . -60.33 -42.21 95.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.411 179.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 629' ' ' ASN . . . . . 0.406 ' O ' ' HG3' ' A' ' 633' ' ' LYS . 61.3 t30 -67.65 -35.86 79.69 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.144 179.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -64.75 -41.87 95.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.975 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -62.76 -37.45 86.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.083 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 632' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 628' ' ' ALA . 12.7 mtp180 -61.77 -34.62 76.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.277 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 633' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 629' ' ' ASN . 57.5 mttm -64.91 -38.93 92.61 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 92.1 t -62.22 -49.56 83.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.053 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -62.41 -30.95 71.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.292 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.4 m -69.43 -23.78 63.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.282 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -73.28 -35.68 66.21 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -65.0 -42.29 94.61 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.63 -0.713 . . . . 10.0 109.521 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -55.7 -44.84 77.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.308 -0.86 . . . . 10.0 110.4 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -59.6 -43.37 93.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.821 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 52.3 mt -64.57 -47.6 88.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.224 179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 642' ' ' ARG . . . . . 0.497 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 75.4 mtm-85 -60.28 -43.34 96.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.945 -0.57 . . . . 10.0 110.314 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 18.5 ttpt -55.21 -45.99 75.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.914 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -64.93 -41.5 95.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.944 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 88.9 mt -65.99 -41.39 91.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.926 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 646' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 97.5 mt -59.07 -42.47 90.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.879 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -66.43 -13.59 60.96 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.002 0.371 . . . . 10.0 112.002 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -102.27 -38.72 7.53 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.946 0.403 . . . . 10.0 111.162 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -83.41 -25.5 31.25 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 -178.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -65.27 -31.34 72.44 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.021 0.439 . . . . 10.0 110.319 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 651' ' ' VAL . . . . . 0.417 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 13.2 t -62.98 -47.28 93.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.8 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.12 -26.54 64.95 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.539 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -63.18 -48.23 79.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.598 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.79 -44.61 95.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.555 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 655' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 42.3 mt-30 -61.56 -44.05 97.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.364 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 24.9 ttp-105 -63.02 -42.44 99.8 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.857 -0.61 . . . . 10.0 109.952 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -63.23 -44.91 93.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.956 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.83 -49.64 69.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.769 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.3 tp -65.93 -36.9 78.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 C-N-CA 121.103 -0.239 . . . . 10.0 111.271 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 6.1 m-30 -68.32 -40.08 81.75 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.937 -0.394 . . . . 10.0 109.937 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 5.1 t -60.47 -49.46 77.48 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.066 -0.516 . . . . 10.0 109.698 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -58.88 -47.77 83.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.781 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.487 ' O ' ' HB2' ' A' ' 667' ' ' LEU . 43.8 ttt-85 -60.91 -39.23 88.57 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.042 -0.527 . . . . 10.0 111.571 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -73.45 -43.35 60.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.562 0.22 . . . . 10.0 111.487 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -58.45 -37.62 75.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.095 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 61.2 mt -88.7 -4.43 58.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.834 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 663' ' ' ARG . 20.3 tp -87.15 -46.96 9.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.075 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -68.41 -41.71 80.05 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.066 -0.516 . . . . 10.0 111.623 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 21.7 m -72.67 164.2 3.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.072 0.463 . . . . 10.0 111.423 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 53.9 m -115.96 -38.72 3.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.331 -179.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -80.12 84.63 5.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.136 0.493 . . . . 10.0 110.579 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 9.5 p -95.01 -5.46 10.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.567 0.699 . . . . 10.0 109.716 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -39.16 69.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.074 -0.966 . . . . 10.0 111.93 -179.308 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -58.54 -50.47 73.67 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.097 0.475 . . . . 10.0 110.551 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -44.49 89.41 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.811 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 36.0 mm -56.7 -51.63 64.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.755 -0.657 . . . . 10.0 111.954 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -67.52 -35.75 79.7 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 52.8 m -65.43 -46.6 79.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.618 0.247 . . . . 10.0 111.483 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 48.1 pt -74.76 -20.73 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.92 -0.312 . . . . 10.0 110.732 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 48.5 ttm-85 -60.48 -40.84 92.73 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.957 0.408 . . . . 10.0 110.179 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -62.96 -38.26 90.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.662 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -72.78 -46.79 51.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.223 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 94.2 t -58.62 -46.11 90.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-O 120.831 0.348 . . . . 10.0 111.05 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -62.53 -42.24 99.4 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.465 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -64.07 -43.2 96.17 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.651 -0.249 . . . . 10.0 110.438 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.7 87.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.976 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 8.8 m -68.37 -37.32 80.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.563 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.04 -44.32 50.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.797 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -31.11 62.26 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.037 0.535 . . . . 10.0 111.931 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -66.62 -28.17 68.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.852 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -110.17 -22.09 11.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.739 0.304 . . . . 10.0 111.599 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 28.1 mt -125.85 100.26 31.08 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.515 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.48 130.28 26.22 Favored 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.507 2.138 . . . . 10.0 110.766 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -48.11 109.04 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 123.056 2.504 . . . . 10.0 113.529 -178.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.06 88.91 0.07 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.661 -0.699 . . . . 10.0 111.551 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 11.9 p -154.67 -168.71 2.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.215 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 32.3 mt -72.56 136.64 45.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.206 -0.294 . . . . 10.0 110.206 179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -59.86 -31.71 70.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.873 -178.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -76.33 -4.56 42.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.974 0.416 . . . . 10.0 111.48 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 13.1 mmt -100.95 8.79 42.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.334 0.588 . . . . 10.0 109.784 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 701' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -102.5 125.09 49.1 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.298 -0.865 . . . . 10.0 110.194 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -82.14 77.49 8.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.431 0.634 . . . . 10.0 109.334 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 703' ' ' ILE . . . . . 0.505 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 32.8 mm -63.36 -49.45 79.0 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.175 -0.92 . . . . 10.0 111.16 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 704' ' ' PRO . . . . . 0.505 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 51.7 Cg_exo -56.44 -45.88 34.26 Favored 'Trans proline' 0 C--N 1.359 1.13 0 C-N-CA 121.866 1.711 . . . . 10.0 112.008 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -64.22 -41.76 98.19 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.962 -0.637 . . . . 10.0 111.965 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.46 ' O ' ' HG ' ' A' ' 710' ' ' LEU . 60.0 tp -64.7 -43.44 93.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.487 0.184 . . . . 10.0 110.702 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -61.15 -47.41 86.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.525 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -66.09 -35.04 79.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.393 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.5 -46.85 88.24 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.254 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 710' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 706' ' ' LEU . 63.1 mt -60.58 -36.74 79.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.776 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -73.22 -21.08 60.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.989 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -99.15 -42.28 7.13 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.523 0.564 . . . . 10.0 112.523 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -96.02 -23.36 16.85 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.699 1.0 . . . . 10.0 113.699 -177.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -120.34 1.23 10.72 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.504 0.927 . . . . 10.0 113.504 -177.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 22.8 t70 57.76 31.31 20.27 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 121.554 0.692 . . . . 10.0 110.22 179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 14.8 tp -125.96 128.17 47.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.155 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -104.02 105.19 15.28 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.898 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 82.3 mt -121.04 104.05 41.87 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.938 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.56 73.84 3.94 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 122.536 2.157 . . . . 10.0 111.655 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 57.3 mt -55.73 -43.14 72.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.42 -0.809 . . . . 10.0 111.932 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -64.91 -21.99 66.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.679 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -80.51 -17.21 52.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.977 0.418 . . . . 10.0 110.453 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 20.0 m0 -101.75 -43.87 5.71 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.533 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 16.1 tp -57.17 -27.6 62.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.415 -178.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -86.73 -10.5 53.52 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.841 0.311 . . . . 10.0 111.841 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 42.8 mttp -111.02 -45.9 3.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.663 0.268 . . . . 10.0 111.285 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -116.3 95.15 44.52 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 121.178 0.513 . . . . 10.0 110.336 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -72.97 8.91 1.51 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.456 2.104 . . . . 10.0 112.346 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -79.45 -8.47 59.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.132 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 63.7 mt -65.43 -40.24 93.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.242 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 53.93 -97.57 0.07 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.597 -0.728 . . . . 10.0 110.833 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 732' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' A' ' 736' ' ' ARG . 0.2 OUTLIER -144.55 -57.63 0.36 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.21 -48.75 76.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.981 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 2.3 m -60.14 -33.1 71.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.154 0.502 . . . . 10.0 110.376 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.99 -43.57 98.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.733 -0.667 . . . . 10.0 109.483 178.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 736' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 732' ' ' GLU . 71.0 mtt-85 -65.07 -47.77 76.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.199 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -57.94 -39.91 79.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.474 -0.784 . . . . 10.0 111.335 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 27.9 mmm-85 -62.11 -40.27 95.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.854 0.359 . . . . 10.0 110.45 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 92.2 mt -67.61 -44.35 86.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.526 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 29.1 tp -66.35 -43.14 86.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.016 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.96 -42.7 94.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.803 0.335 . . . . 10.0 110.928 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -64.88 -40.61 95.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.317 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 2.3 p -66.38 -44.6 82.67 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.865 -0.334 . . . . 10.0 110.632 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.6 -38.87 83.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.05 -54.76 42.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.392 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.41 ' HA ' ' HD3' ' A' ' 749' ' ' ARG . 97.0 t -63.65 -34.12 65.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.987 0.423 . . . . 10.0 110.576 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -60.39 -49.95 75.54 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.36 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -65.16 -31.75 73.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.556 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 749' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 746' ' ' VAL . 65.9 mtp180 -67.2 -41.34 85.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.87 -0.605 . . . . 10.0 109.695 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -66.08 -39.97 90.48 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -59.09 -39.12 81.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.053 -0.976 . . . . 10.0 111.725 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.43 -21.25 65.26 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.457 0.54 . . . . 10.0 112.457 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.0 t -87.63 -27.93 5.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.883 0.373 . . . . 10.0 111.463 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 6.6 t -96.77 -42.12 11.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.033 0.444 . . . . 10.0 111.259 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 125.46 130.81 3.52 Favored Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 111.158 -0.777 . . . . 10.0 111.158 -179.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 756' ' ' ALA . . . . . 0.491 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -55.12 -47.12 75.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 10.0 111.707 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.13 -38.57 91.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.163 0.506 . . . . 10.0 110.663 -179.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.5 tpt -69.4 -42.31 75.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.839 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 76.8 mmm -61.12 -39.54 90.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.948 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . 0.491 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.8 mmp_? -60.81 -39.95 90.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.266 0.555 . . . . 10.0 110.011 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 10.9 m-70 -71.11 -33.4 70.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.927 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -67.04 -46.85 73.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.687 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 79.5 mt-10 -59.6 -44.88 93.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.335 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -61.46 -41.08 96.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.173 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -66.81 -43.66 91.1 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.15 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 48.7 t -60.69 -41.45 88.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 120.678 0.275 . . . . 10.0 110.906 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 8.9 mtp -57.64 -49.12 77.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.254 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 60.4 mt -66.65 -40.41 88.67 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.235 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -53.21 -57.12 11.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.751 -0.659 . . . . 10.0 111.312 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 3.7 m -68.72 -35.78 77.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.346 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.26 -54.27 43.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.977 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -62.19 -37.58 85.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.298 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 49.6 m -65.75 -42.45 90.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.816 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 62.9 mt -77.41 -23.83 50.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.611 -0.268 . . . . 10.0 110.908 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -66.14 -51.06 61.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.645 -0.252 . . . . 10.0 110.658 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.441 ' HG3' ' N ' ' A' ' 777' ' ' GLU . 13.5 ptpt -62.45 -34.24 76.41 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.805 0.336 . . . . 10.0 110.324 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 777' ' ' GLU . . . . . 0.441 ' N ' ' HG3' ' A' ' 776' ' ' LYS . 0.9 OUTLIER -70.34 -39.92 74.4 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 178.845 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -60.65 -32.42 71.6 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.929 -0.578 . . . . 10.0 109.986 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 85.0 mt -65.69 -45.81 81.4 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -67.96 -42.4 80.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.125 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.77 -42.93 94.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.936 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 85.1 mmm -64.39 -38.27 90.45 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.024 0.44 . . . . 10.0 109.979 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.58 -40.77 93.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.066 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -64.84 -41.92 95.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.216 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.7 tp -71.59 -35.52 70.56 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.706 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -57.25 -39.36 75.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.145 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.754 179.841 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo . . . . . 0 C--O 1.232 0.22 0 N-CA-C 113.479 0.53 . . . . 10.0 113.479 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 800' ' ' LYS . . . . . 0.416 ' O ' ' HG3' ' A' ' 804' ' ' LYS . 27.4 mtpt -74.28 -46.82 38.79 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.638 -0.504 . . . . 10.0 109.638 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -65.38 -37.94 88.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.538 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -66.33 -41.28 89.85 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -57.54 -44.16 84.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.491 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 804' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 800' ' ' LYS . 95.6 mttt -62.51 -47.24 84.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.857 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 39.3 ttp85 -61.03 -47.6 85.63 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.427 -0.351 . . . . 10.0 111.238 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.26 -47.25 86.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.467 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 8.3 p -65.77 -39.21 90.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.495 -0.321 . . . . 10.0 111.501 -179.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -65.05 -35.65 81.85 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.873 0.368 . . . . 10.0 110.272 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 19.4 m -68.56 -40.79 80.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.206 0.527 . . . . 10.0 109.754 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 13.4 ttm -62.69 -38.42 90.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.609 -0.723 . . . . 10.0 110.241 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -65.28 -44.11 89.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.666 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.78 -49.05 77.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.612 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -61.65 -34.91 76.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.693 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 32.9 ttp -64.59 -43.61 93.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.216 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 97.3 mt -65.97 -40.59 91.38 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.409 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 816' ' ' GLU . . . . . 0.404 ' HA ' ' HE2' ' A' ' 819' ' ' LYS . 37.9 mm-40 -62.94 -39.43 94.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.591 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 19.9 m -76.58 -27.2 55.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.508 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 36.7 tp -62.76 -57.11 12.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.729 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 819' ' ' LYS . . . . . 0.404 ' HE2' ' HA ' ' A' ' 816' ' ' GLU . 53.9 pttt -61.32 -30.06 70.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.478 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -61.73 -56.53 18.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.817 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.55 -31.3 71.29 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.587 -0.278 . . . . 10.0 111.498 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 822' ' ' VAL . . . . . 0.63 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 36.6 t -60.63 -56.95 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 39.5 mm -63.44 -37.28 79.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 121.073 0.463 . . . . 10.0 110.03 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 824' ' ' SER . . . . . 0.495 ' O ' ' HB2' ' A' ' 828' ' ' LYS . 29.4 t -59.78 -53.83 53.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.37 179.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 98.0 m -59.99 -38.69 83.33 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.557 -0.292 . . . . 10.0 111.727 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 826' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 94.4 mt -62.03 -29.06 70.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.92 0.39 . . . . 10.0 111.423 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 1.7 m -97.0 -27.92 14.4 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.237 0.541 . . . . 10.0 110.095 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 828' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 824' ' ' SER . 2.0 ttpt -69.8 -19.63 63.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.127 -0.942 . . . . 10.0 111.415 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.8 p -53.2 130.09 14.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 CA-C-O 121.213 0.53 . . . . 10.0 111.183 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 36.3 mm-40 -86.0 113.66 22.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.728 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.816 -179.107 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.5 t80 . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 120.692 0.282 . . . . 10.0 110.7 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.66 163.65 10.68 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 111.569 -0.612 . . . . 10.0 111.569 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.72 117.64 5.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.789 0.328 . . . . 10.0 110.207 179.558 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -58.21 142.93 46.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.037 -0.528 . . . . 10.0 111.214 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 77.12 -63.16 0.38 Allowed 'General case' 0 N--CA 1.465 0.277 0 O-C-N 124.158 0.911 . . . . 10.0 111.595 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -69.29 -66.51 0.57 Allowed 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.215 0.82 . . . . 10.0 113.215 -177.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -72.57 -26.27 61.66 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -178.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 m -56.81 -45.09 82.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 10.0 111.366 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.3 mt -69.47 -28.81 66.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.398 -0.365 . . . . 10.0 111.731 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -71.71 -49.07 42.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.765 0.317 . . . . 10.0 110.549 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 20' ' ' ARG . 3.0 ttp85 -66.63 -37.04 84.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.406 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.595 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -64.12 -32.99 74.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.251 179.38 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.0 tpp180 -62.1 -36.17 80.92 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.645 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.9 -41.03 97.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.104 -0.498 . . . . 10.0 109.868 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 22.7 t -67.57 -36.79 77.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.999 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 70.2 t -59.49 -37.3 69.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.08 178.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -62.95 -43.1 99.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.894 -0.594 . . . . 10.0 109.944 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.4 mt -62.07 -47.12 94.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.268 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 60.5 mt -60.39 -35.9 65.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.804 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -69.38 -34.43 74.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.056 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.472 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -77.61 -26.56 50.74 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.062 0.458 . . . . 10.0 110.744 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 45.8 mtt -79.06 -10.5 59.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.136 -0.483 . . . . 10.0 111.263 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.466 ' CD ' ' HD3' ' A' ' 72' ' ' ARG . 5.8 mt-10 -57.79 -56.89 29.88 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 119.147 -0.454 . . . . 10.0 111.632 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.472 ' HD2' ' O ' ' A' ' 30' ' ' ALA . 50.7 Cg_exo -56.0 -32.31 85.56 Favored 'Trans proline' 0 C--N 1.36 1.141 0 C-N-CA 121.803 1.669 . . . . 10.0 112.022 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -67.05 -46.62 73.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.704 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 24.6 mmt -68.51 -35.6 77.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.823 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -63.13 -29.3 70.68 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.207 0.527 . . . . 10.0 110.253 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -74.34 -31.73 62.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.89 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.4 mp -74.83 136.95 41.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.962 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.6 p -78.55 175.93 9.89 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.894 -0.322 . . . . 10.0 110.497 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -55.64 -51.9 65.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.213 0.449 . . . . 10.0 112.213 -178.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -63.87 -29.6 70.77 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.069 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -67.93 -39.41 83.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.677 0.275 . . . . 10.0 110.308 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -66.04 -40.14 90.75 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -60.75 -38.85 86.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.17 -0.923 . . . . 10.0 109.815 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.01 -26.14 74.11 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.466 -0.788 . . . . 10.0 112.038 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -65.48 -38.78 90.78 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.049 -0.352 . . . . 10.0 110.049 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 17.1 m -62.76 -40.23 96.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.198 0.523 . . . . 10.0 109.75 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.77 -35.76 77.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.06 178.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -62.59 -41.91 99.24 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.077 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -62.96 -39.63 95.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.231 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -59.99 -46.62 88.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.052 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.68 -38.94 80.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.782 -0.644 . . . . 10.0 111.077 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -61.39 -47.61 85.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.97 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.2 mt -62.97 -35.0 78.71 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.146 0.498 . . . . 10.0 110.704 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.61 -42.63 95.41 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.485 -0.78 . . . . 10.0 111.138 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.484 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -83.98 -51.08 7.42 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.005 0.372 . . . . 10.0 112.005 -179.156 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 171.28 88.13 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.254 -0.975 . . . . 10.0 113.006 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -149.07 148.72 30.02 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.8 t -95.79 131.44 42.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.6 tp -58.77 -41.82 87.52 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.098 0.475 . . . . 10.0 110.636 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -69.46 -11.42 60.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.377 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -93.45 -20.04 20.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.282 0.563 . . . . 10.0 110.371 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 67.3 mt -82.2 -10.78 59.02 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.756 -0.657 . . . . 10.0 111.557 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 67.4 mt -46.9 -53.33 27.17 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.5 Cg_exo -54.11 -54.06 5.33 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.736 1.624 . . . . 10.0 113.067 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -68.08 -43.67 78.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 10.0 112.108 -178.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.18 -50.28 72.43 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.805 -178.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -63.08 -33.0 74.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.772 -179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.78 -45.4 86.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.484 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.5 t -61.93 -46.68 95.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.134 -0.485 . . . . 10.0 110.211 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 45.3 t -60.82 -45.77 97.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.208 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.466 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 5.3 ttm180 -59.45 -43.74 93.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.593 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 -62.88 -47.43 83.35 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.116 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.5 -30.33 71.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.849 -0.614 . . . . 10.0 111.124 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.9 m -61.78 -35.62 78.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.756 0.313 . . . . 10.0 111.185 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.494 ' O ' ' HA3' ' A' ' 80' ' ' GLY . 51.2 mtmt -76.41 -28.85 56.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.532 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -88.28 -43.81 11.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.352 -0.386 . . . . 10.0 111.931 -178.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 90.4 t -77.11 -62.81 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.828 0.347 . . . . 10.0 111.694 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -83.05 -41.6 18.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.384 -178.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' A' ' 76' ' ' LYS . . . 100.33 29.58 6.65 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.888 -0.672 . . . . 10.0 111.868 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 47.1 ttm -144.27 127.95 17.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.701 0.286 . . . . 10.0 110.39 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 82' ' ' ARG . 29.4 ttp85 -71.48 126.23 29.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.202 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.38 117.46 3.84 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.803 -0.443 . . . . 10.0 109.803 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -57.06 147.16 25.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.315 0.578 . . . . 10.0 111.636 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -63.89 -32.52 74.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.198 -0.91 . . . . 10.0 111.79 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.67 -26.64 31.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.033 0.444 . . . . 10.0 110.728 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.424 HE22 HD21 ' A' ' 110' ' ' LEU . 92.9 mt-30 -74.14 -31.05 62.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.265 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.45 -37.65 88.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.153 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.0 mt -65.04 -49.53 69.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.426 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -64.51 -44.68 94.82 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.733 -0.667 . . . . 10.0 112.554 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.33 -31.23 80.17 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.082 -0.58 . . . . 10.0 112.566 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.595 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 16.3 ttm -70.14 -37.74 75.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.763 0.316 . . . . 10.0 110.69 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 91.8 t -72.87 -29.14 28.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.149 0.5 . . . . 10.0 110.198 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 mt -70.63 -5.57 30.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.715 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -80.41 -25.74 38.86 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.03 -0.729 . . . . 10.0 109.03 178.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -93.96 177.49 5.97 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.319 -0.855 . . . . 10.0 110.179 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.567 ' HG2' ' CD2' ' A' ' 407' ' ' LEU . 13.7 ttt85 -86.57 75.36 9.73 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.097 -0.501 . . . . 10.0 109.708 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 85.6 m -147.94 174.94 11.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.114 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 40.9 mm -112.72 134.39 55.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.619 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -112.36 119.73 39.28 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.869 0.366 . . . . 10.0 111.375 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -89.89 106.05 18.21 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.417 ' O ' ' HA3' ' A' ' 392' ' ' GLY . 35.4 ttm -103.3 151.47 22.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.095 0.474 . . . . 10.0 110.665 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.498 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 0.2 OUTLIER -85.52 149.68 25.21 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.758 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.78 107.28 5.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.982 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 133.66 -25.66 3.56 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.775 -0.726 . . . . 10.0 112.705 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.603 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 1.2 mm-40 -74.31 -21.17 59.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.818 0.342 . . . . 10.0 110.983 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.33 85.39 1.87 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.638 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.494 ' HD2' ' SD ' ' A' ' 390' ' ' MET . 8.4 mtmt -62.97 -65.88 0.62 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.925 0.393 . . . . 10.0 111.852 -179.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -60.09 -30.03 68.98 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.162 0.43 . . . . 10.0 112.162 -178.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.424 HD21 HE22 ' A' ' 87' ' ' GLN . 35.0 tp -68.01 -25.82 65.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.787 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 60.6 m -89.69 -28.95 19.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.008 0.432 . . . . 10.0 111.07 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.12 -11.46 49.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.976 -0.556 . . . . 10.0 112.492 -179.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 14.9 p -74.98 -23.73 58.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.797 0.332 . . . . 10.0 111.622 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 38.1 mt -68.24 -57.87 8.34 Favored Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -65.46 -26.64 54.93 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.888 1.725 . . . . 10.0 112.098 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -67.67 -48.44 66.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.822 -0.627 . . . . 10.0 110.784 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.421 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 55.2 t80 -60.85 -45.4 94.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.644 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 32.0 tp -59.87 -52.34 65.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.02 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -70.49 -20.62 62.84 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 111.971 0.36 . . . . 10.0 111.971 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -73.52 -27.59 61.45 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.497 -0.32 . . . . 10.0 110.743 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 69.3 mt -57.49 -35.5 70.29 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.985 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -20.84 66.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.71 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.41 25.76 75.19 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.926 -0.654 . . . . 10.0 112.677 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -96.41 -10.88 26.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.736 0.303 . . . . 10.0 110.932 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 94.3 112.66 2.41 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.728 -0.749 . . . . 10.0 113.343 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.5 t -88.21 113.57 25.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.428 -0.582 . . . . 10.0 109.428 178.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -89.52 100.4 13.2 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.971 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 29.8 t -91.59 114.44 28.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.975 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 54.8 t -97.69 118.49 44.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.508 -179.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.43 148.54 34.15 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.629 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.66 -31.55 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 112.191 0.441 . . . . 10.0 112.191 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -149.92 166.09 30.65 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.667 0.27 . . . . 10.0 110.801 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -72.64 -23.47 60.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.696 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -55.8 -54.56 43.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.691 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.3 mt -73.72 -35.87 65.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.564 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.64 -52.3 64.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.077 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -69.28 -39.47 78.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.601 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.1 ttp85 -53.83 -55.64 24.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.134 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.93 -28.94 61.76 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.741 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.81 85.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.967 0.413 . . . . 10.0 110.783 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -90.54 -32.17 16.43 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.051 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -68.42 -42.62 78.68 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.933 0.397 . . . . 10.0 111.291 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -89.51 2.91 53.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.222 -0.444 . . . . 10.0 111.105 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.452 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 56.3 ttm-85 -63.62 -48.18 81.08 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.79 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' PRO . . . . . 0.452 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 16.3 Cg_exo -68.73 8.73 0.52 Allowed 'Trans proline' 0 C--N 1.361 1.216 0 C-N-CA 122.21 1.94 . . . . 10.0 112.618 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.425 ' H ' ' C ' ' A' ' 144' ' ' ARG . 11.7 tp -111.59 -57.84 2.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.138 -0.483 . . . . 10.0 109.863 179.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -71.11 -49.43 44.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.65 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.13 -13.51 62.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.23 0.538 . . . . 10.0 110.601 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -78.62 -39.81 36.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.901 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 92.4 mt -81.86 -37.75 26.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.405 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 139.26 29.15 0.22 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.075 -1.06 . . . . 10.0 113.277 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 88.8 mt -119.94 123.2 42.97 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.62 127.43 32.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.19 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 14.7 t -104.68 107.02 21.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.474 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -105.31 143.23 15.64 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.841 -0.695 . . . . 10.0 111.999 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.4 tp -117.02 123.71 72.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.051 0.453 . . . . 10.0 110.544 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -101.69 115.19 29.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.134 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 85.2 mt -103.99 144.86 29.54 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.035 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' PRO . . . . . 0.469 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 23.5 Cg_endo -62.06 112.52 1.55 Allowed 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.623 2.215 . . . . 10.0 111.937 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 96.99 8.7 56.7 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.874 -0.679 . . . . 10.0 112.434 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 43.3 ttm -68.31 135.93 91.18 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.428 -0.212 . . . . 10.0 110.428 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -50.45 144.29 24.97 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.799 2.333 . . . . 10.0 112.573 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . 0.422 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.46 -48.24 90.58 Favored Pre-proline 0 CA--C 1.54 0.573 0 N-CA-C 113.359 0.874 . . . . 10.0 113.359 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.422 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.4 Cg_exo -57.1 -33.36 95.65 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 121.789 1.659 . . . . 10.0 112.584 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.44 -38.99 48.29 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.412 ' HZ1' ' CG ' ' A' ' 185' ' ' ASP . 54.7 mttm -59.61 -42.99 93.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.797 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -58.81 -32.9 69.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.437 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -75.72 -38.33 58.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.893 0.378 . . . . 10.0 110.417 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.27 -38.69 88.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.628 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -79.58 -24.28 42.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.194 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -75.24 -11.82 60.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.139 0.495 . . . . 10.0 110.285 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -72.69 173.33 9.18 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.471 -0.786 . . . . 10.0 110.28 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -77.36 -36.01 54.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.088 0.47 . . . . 10.0 109.826 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 76.1 mt -130.02 128.3 64.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.911 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 9.4 m -119.4 117.54 28.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.915 0.388 . . . . 10.0 111.527 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -94.29 133.06 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.638 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -167.61 164.68 38.12 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.126 -1.035 . . . . 10.0 113.131 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.56 150.11 28.33 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 122.275 0.23 . . . . 10.0 110.972 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -57.98 -41.07 82.2 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -51.81 66.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.506 -0.315 . . . . 10.0 111.261 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . 0.469 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 4.4 tp10 -64.33 -36.96 85.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.954 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.28 -34.84 72.75 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.019 0.438 . . . . 10.0 110.543 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -77.66 -41.16 20.48 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 111.298 -0.721 . . . . 10.0 111.298 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -62.44 -39.47 93.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.339 . . . . 10.0 110.485 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 185' ' ' ASP . . . . . 0.412 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 34.2 m-20 -61.26 -41.78 97.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.579 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -64.16 -35.96 82.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.178 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 62.5 mt -68.95 -42.88 76.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.666 -0.697 . . . . 10.0 110.29 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 62.3 mtm-85 -67.04 -41.36 86.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.559 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.82 -39.92 90.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.758 -0.656 . . . . 10.0 110.731 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -83.86 7.97 16.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.694 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.98 5.27 13.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.909 0.385 . . . . 10.0 110.736 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -78.34 168.32 20.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.629 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -110.45 -24.29 10.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.208 0.528 . . . . 10.0 110.271 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.89 138.36 30.41 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.46 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -59.05 -23.31 68.2 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.628 2.218 . . . . 10.0 112.377 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -77.49 -7.07 55.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.246 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -94.36 0.2 55.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.8 0.333 . . . . 10.0 110.476 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 43.6 mtt85 -62.88 158.84 18.04 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.151 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 16.7 m -134.8 -19.21 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.908 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -84.93 175.77 8.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.218 0.532 . . . . 10.0 111.654 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.43 -179.19 5.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.6 -0.727 . . . . 10.0 109.67 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -61.73 129.75 42.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.026 0.441 . . . . 10.0 111.05 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 22.3 mt -84.11 63.51 7.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.387 0.613 . . . . 10.0 110.154 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -80.3 -53.42 6.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.738 -0.665 . . . . 10.0 112.03 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -130.97 137.58 49.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.981 0.42 . . . . 10.0 111.416 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.592 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . . . -133.13 121.3 22.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.416 -0.811 . . . . 10.0 109.703 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 57.7 tp -122.91 113.48 19.16 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 9.0 p -97.0 139.34 19.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.594 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.73 -27.61 62.15 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.591 -179.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 210' ' ' GLU . . . . . 0.545 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 4.4 tp10 -145.76 134.09 21.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.113 0.482 . . . . 10.0 110.954 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 3.4 m -102.37 -17.95 6.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.335 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -60.04 -68.41 0.29 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.52 -0.764 . . . . 10.0 111.574 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.58 22.57 1.28 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.561 0.578 . . . . 10.0 112.561 -178.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 45.4 mt -138.05 -66.22 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 112.545 0.572 . . . . 10.0 112.545 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 27.0 mt -70.28 -46.05 65.12 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.495 0.554 . . . . 10.0 112.495 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 50.8 mm -85.51 -47.36 16.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.882 -0.327 . . . . 10.0 111.759 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.98 -59.63 2.79 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -178.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -85.38 46.59 1.31 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.005 0.431 . . . . 10.0 111.78 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -76.51 -53.19 8.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.389 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 220' ' ' ARG . . . . . 0.447 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 0.2 OUTLIER -105.85 46.68 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.227 0.537 . . . . 10.0 110.837 -179.08 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 2.9 m -107.55 102.44 44.52 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.583 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -88.83 132.44 2.41 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.802 2.335 . . . . 10.0 113.578 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 223' ' ' LEU . . . . . . . . . . . . . 96.7 mt -82.62 93.12 7.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.147 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 29.2 mt -92.74 125.8 45.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.051 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 2.6 mt . . . . . 0 C--N 1.326 -0.431 0 N-CA-C 109.416 -0.587 . . . . 10.0 109.416 179.655 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.705 0.288 . . . . 10.0 110.735 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 374' ' ' SER . . . . . . . . . . . . . 8.8 t -164.22 161.84 22.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.239 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.6 tt -157.73 148.46 9.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.38 . . . . 10.0 110.489 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.14 143.06 29.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.619 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -56.06 -50.64 70.4 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 123.126 0.266 . . . . 10.0 111.356 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -53.45 -47.64 69.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.101 -0.499 . . . . 10.0 111.402 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -67.18 -31.11 71.28 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.202 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -70.27 -41.42 73.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.509 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -72.78 -19.26 61.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.047 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 72.1 mtp180 -77.12 -5.85 50.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.735 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 47.1 mt -96.79 7.58 46.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.798 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . 0.592 ' CD2' ' HB3' ' A' ' 206' ' ' ALA . 21.2 m-85 -99.51 151.36 21.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.733 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -78.95 -76.36 0.2 Allowed 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 76.1 mttt -90.41 90.3 7.97 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 57.7 tp -95.73 109.55 21.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.768 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -125.66 154.08 42.88 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.692 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -155.24 143.97 10.5 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.539 -0.839 . . . . 10.0 112.192 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 390' ' ' MET . . . . . 0.494 ' SD ' ' HD2' ' A' ' 108' ' ' LYS . 33.4 ttm -114.0 128.93 56.61 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 5.7 t -122.75 -175.35 3.14 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 121.147 -0.221 . . . . 10.0 110.574 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 392' ' ' GLY . . . . . 0.417 ' HA3' ' O ' ' A' ' 102' ' ' MET . . . -103.4 165.54 15.8 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 110.979 -0.848 . . . . 10.0 110.979 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 393' ' ' THR . . . . . 0.451 ' OG1' ' HA ' ' A' ' 103' ' ' ARG . 1.0 OUTLIER -62.17 103.46 0.38 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.845 0.355 . . . . 10.0 111.074 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -151.61 -27.97 0.18 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.471 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 18.2 t70 54.39 -118.93 1.38 Allowed 'General case' 0 CA--C 1.535 0.377 0 O-C-N 123.374 0.421 . . . . 10.0 110.318 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 4.7 m 64.74 -96.66 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -81.62 36.87 0.45 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.912 0.387 . . . . 10.0 111.452 -178.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -64.5 -20.14 66.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.081 0.467 . . . . 10.0 110.961 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -81.74 -24.73 35.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.128 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -65.44 -38.3 89.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.733 0.302 . . . . 10.0 110.983 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -57.97 -47.26 83.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.171 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 4.9 m -75.83 -9.19 58.4 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.503 0.557 . . . . 10.0 112.503 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.2 m -102.77 -53.24 2.9 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.01 0.374 . . . . 10.0 112.01 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 60.3 mt -82.58 -50.41 15.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 112.809 0.67 . . . . 10.0 112.809 -177.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -94.97 -8.82 35.82 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm 62.09 43.34 8.91 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.834 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 407' ' ' LEU . . . . . 0.567 ' CD2' ' HG2' ' A' ' 97' ' ' ARG . 14.6 mt -117.66 140.92 49.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.36 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -88.98 128.85 35.71 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 110.067 -0.345 . . . . 10.0 110.067 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 2.1 m -87.13 101.2 13.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.984 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 38.2 t -96.57 133.86 36.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.607 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 15.3 t -88.68 122.23 39.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.934 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 48.6 t -87.22 130.15 48.95 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.219 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.83 150.21 86.06 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.719 2.279 . . . . 10.0 112.336 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 17.4 p -79.83 157.73 26.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.881 -0.599 . . . . 10.0 111.426 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -66.75 -40.46 88.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.334 0.588 . . . . 10.0 109.708 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 69.5 mtm180 -125.49 153.47 72.51 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.764 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -63.46 117.93 4.87 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.368 2.045 . . . . 10.0 111.413 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 30.9 mtm -66.33 114.14 5.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.557 -179.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 419' ' ' ILE . . . . . 0.455 ' HB ' ' HA ' ' A' ' 581' ' ' ALA . 0.7 OUTLIER -96.37 41.89 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.317 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -81.37 101.11 9.61 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.441 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -76.98 100.16 5.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.482 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -80.03 131.51 35.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.797 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 40.2 mt -116.04 149.14 42.87 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -62.47 169.21 8.54 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 122.85 2.367 . . . . 10.0 113.712 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -86.54 116.12 24.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.374 -0.83 . . . . 10.0 109.857 179.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 25.2 mt -92.28 88.22 6.37 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.181 0.515 . . . . 10.0 110.273 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 15.8 t -83.38 125.18 40.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.474 -0.785 . . . . 10.0 110.11 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 428' ' ' TYR . . . . . 0.548 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 10.2 m-85 -111.99 179.5 3.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.511 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 4.3 mmt -70.53 -75.86 0.11 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.909 0.385 . . . . 10.0 111.923 -178.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 41.1 p -90.58 165.62 13.65 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.71 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 431' ' ' GLU . . . . . 0.408 ' HG3' ' HE2' ' A' ' 434' ' ' LYS . 8.0 tt0 -67.32 -26.88 66.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.547 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -61.1 -44.5 97.26 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.031 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -63.21 -40.83 98.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.572 -0.74 . . . . 10.0 110.21 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 434' ' ' LYS . . . . . 0.439 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 39.7 ttpt -59.72 -50.54 73.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.468 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 48.5 mm -65.44 -43.7 94.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.859 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -39.69 89.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.746 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.87 -33.92 76.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.026 0.441 . . . . 10.0 110.441 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 89.1 mt -66.23 -45.49 89.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.688 178.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.38 -36.38 74.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.348 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -64.04 -45.54 88.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.378 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -61.76 -40.77 96.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.469 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 78.7 mt -72.13 -38.03 61.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.901 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 14.2 tttm -53.01 -38.68 62.55 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.918 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 444' ' ' GLU . . . . . 0.49 ' O ' ' HE2' ' A' ' 448' ' ' LYS . 61.8 mm-40 -78.0 -45.05 24.83 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.918 0.39 . . . . 10.0 111.959 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 43.1 mtt-85 -68.14 -29.89 68.89 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 -177.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 1.6 p -68.69 -35.05 76.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.134 0.492 . . . . 10.0 110.268 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.97 -15.01 49.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.49 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 448' ' ' LYS . . . . . 0.49 ' HE2' ' O ' ' A' ' 444' ' ' GLU . 0.2 OUTLIER -90.46 -31.44 16.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.627 179.804 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 105.57 23.55 7.49 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.766 -0.731 . . . . 10.0 112.964 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -104.64 127.76 28.27 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.896 0.348 . . . . 10.0 110.887 -179.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 451' ' ' PRO . . . . . 0.414 ' HB3' ' O ' ' A' ' 496' ' ' TYR . 38.2 Cg_endo -68.25 140.01 47.64 Favored 'Trans proline' 0 C--O 1.237 0.466 0 C-N-CA 122.625 2.217 . . . . 10.0 111.372 178.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 77.4 t -125.28 130.78 72.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.086 0.47 . . . . 10.0 111.695 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 55.8 tp -114.66 106.61 14.44 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 40.9 t -92.73 117.82 36.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.508 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -96.89 127.75 9.31 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.597 -0.811 . . . . 10.0 111.738 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 10.1 p -120.61 137.0 54.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.589 0.233 . . . . 10.0 110.556 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 34.5 pt -93.6 -25.61 4.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.053 0.454 . . . . 10.0 110.486 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 4.0 p -115.62 133.54 55.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.102 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 20.5 mt -62.79 -32.84 57.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.256 0.55 . . . . 10.0 110.22 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -59.57 -35.03 73.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.606 -0.724 . . . . 10.0 110.577 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . 0.545 ' HZ3' ' CD ' ' A' ' 560' ' ' GLU . 0.0 OUTLIER -77.91 -32.33 51.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.773 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.4 m -61.25 -42.55 98.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.049 0.452 . . . . 10.0 110.089 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -70.68 -35.45 72.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.179 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.64 -51.6 54.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.79 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 14.2 p -62.51 -35.44 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.71 0.29 . . . . 10.0 110.743 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 60.3 m -65.71 -39.74 91.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.574 -0.284 . . . . 10.0 110.407 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -58.46 -43.26 88.79 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.957 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -71.44 -35.42 70.92 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.64 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 47.5 mt -65.6 -44.22 87.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.553 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 3.1 m -67.8 -30.31 69.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.202 0.525 . . . . 10.0 109.886 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -66.1 -38.78 89.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.395 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -84.96 -3.09 58.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.986 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 72.83 36.24 57.91 Favored Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.88 -0.6 . . . . 10.0 112.483 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 88.5 mt -104.42 123.61 58.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 120.622 0.249 . . . . 10.0 110.67 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -64.21 139.37 58.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.403 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -159.8 145.04 15.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.918 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -117.17 125.47 51.25 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 4.5 t -100.08 140.23 19.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.158 -179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 90.3 mt -94.02 151.61 19.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.101 -0.5 . . . . 10.0 109.752 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -161.71 130.12 4.29 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -58.18 -19.6 34.52 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -80.46 -6.83 58.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.938 0.399 . . . . 10.0 110.723 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' PHE . . . . . 0.43 ' O ' ' HG3' ' A' ' 487' ' ' GLU . 54.6 m-85 -131.07 45.96 2.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.45 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 9.2 m80 -51.32 -41.1 60.31 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.896 -179.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -63.64 -30.91 71.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.846 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -81.81 -38.12 26.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.918 0.39 . . . . 10.0 110.395 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 483' ' ' PHE . 53.8 mt-10 -55.6 -37.41 68.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.27 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -54.66 -41.48 70.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.592 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.26 -29.14 42.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.986 0.422 . . . . 10.0 111.092 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.1 mt -73.22 -53.3 18.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.308 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 68.6 t -60.48 -35.49 63.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.949 0.404 . . . . 10.0 111.239 -179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -64.08 -26.33 68.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.363 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -115.8 19.07 15.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.822 0.344 . . . . 10.0 110.888 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.74 -17.32 62.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.056 0.455 . . . . 10.0 111.045 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -93.89 8.65 73.5 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.851 -0.69 . . . . 10.0 112.086 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' TYR . . . . . 0.414 ' O ' ' HB3' ' A' ' 451' ' ' PRO . 61.7 t80 -68.72 138.55 90.76 Favored Pre-proline 0 C--N 1.325 -0.465 0 N-CA-C 110.271 -0.27 . . . . 10.0 110.271 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.84 128.13 29.16 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.642 2.228 . . . . 10.0 112.682 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.61 14.18 8.23 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.561 -0.745 . . . . 10.0 112.808 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.92 133.76 34.59 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.879 0.371 . . . . 10.0 110.351 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 25.9 t -111.62 113.45 44.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.375 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.9 m -111.79 134.17 53.53 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.502 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 80.1 mt -111.63 117.62 55.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.787 0.327 . . . . 10.0 110.133 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -97.9 121.3 39.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.087 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 2.7 m -98.94 109.72 22.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.868 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 55.81 67.33 1.02 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.391 0.615 . . . . 10.0 111.002 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 38.6 tpp -76.3 128.57 35.15 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.699 -0.682 . . . . 10.0 111.136 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -76.68 179.75 5.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.789 -0.642 . . . . 10.0 111.448 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -68.59 160.82 51.44 Favored Glycine 0 CA--C 1.52 0.402 0 CA-C-N 116.029 -0.532 . . . . 10.0 113.357 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.545 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 99.1 mtt180 65.15 -82.72 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.54 0.736 . . . . 10.0 111.895 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 81.07 155.75 13.26 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.961 -0.638 . . . . 10.0 112.717 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.05 154.28 41.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.77 0.319 . . . . 10.0 111.009 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -75.66 109.9 9.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.367 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 45.9 mt -78.47 118.42 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.157 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 2.7 t -86.65 128.65 39.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.805 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 60.7 mt -74.05 133.31 42.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.33 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 83.78 15.72 69.76 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.274 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 95.43 -170.54 28.53 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.629 -0.796 . . . . 10.0 111.475 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 2.8 p -134.1 94.58 3.27 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.944 0.372 . . . . 10.0 110.896 -179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 21.9 p-90 -56.57 -30.07 62.75 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.826 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -61.25 -40.66 94.9 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.986 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.37 -24.55 39.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.972 0.415 . . . . 10.0 110.873 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -77.43 -46.87 21.27 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.98 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 33.8 m -69.62 -26.41 30.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.861 0.362 . . . . 10.0 110.94 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -84.79 -5.61 59.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.432 . . . . 10.0 110.78 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -89.65 -9.73 48.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.481 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 11.2 mt -82.16 158.33 23.67 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.311 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.99 -28.87 32.39 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 178.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -146.75 92.35 5.07 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.461 -0.791 . . . . 10.0 109.759 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.5 92.48 1.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.449 2.1 . . . . 10.0 112.688 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -75.09 153.96 38.09 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.205 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -57.11 -35.68 69.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.979 0.419 . . . . 10.0 110.915 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -66.81 -43.95 82.46 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.15 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -69.12 -40.63 78.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.925 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.19 -44.08 94.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.32 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.55 -39.78 94.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.355 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -59.95 -53.37 58.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.736 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 94.0 mt -63.66 -39.1 84.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.74 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -61.97 -41.19 97.73 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.263 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.48 86.01 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.372 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . 0.584 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 40.7 m-20 -60.69 -46.21 91.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.777 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 541' ' ' TRP . . . . . 0.415 ' CZ2' ' HD2' ' A' ' 545' ' ' HIS . 70.6 t90 -58.58 -41.03 84.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.318 -0.856 . . . . 10.0 110.558 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -58.37 -43.54 88.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.622 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.84 -45.03 96.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.149 0.499 . . . . 10.0 110.019 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 544' ' ' ARG . . . . . 0.584 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 14.6 mtm180 -63.68 -38.96 93.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.547 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 545' ' ' HIS . . . . . 0.415 ' HD2' ' CZ2' ' A' ' 541' ' ' TRP . 6.3 t-80 -66.25 -39.41 89.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.094 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -66.24 -40.03 89.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.157 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -58.85 -43.44 90.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.876 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 65.1 t -62.57 -35.89 72.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.79 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 99.7 mt -64.33 -43.66 93.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.005 0.431 . . . . 10.0 110.225 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -71.14 -29.49 65.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.673 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -70.02 -35.74 74.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.951 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 129.49 18.08 1.67 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.484 -0.865 . . . . 10.0 113.04 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 75.31 -169.94 54.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.828 -0.701 . . . . 10.0 112.55 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . 0.426 ' HB3' ' OG ' ' A' ' 575' ' ' SER . 54.3 tp -75.5 126.08 30.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.928 0.394 . . . . 10.0 110.115 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -95.36 120.53 35.75 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.936 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 35.1 mm -98.04 128.3 49.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.596 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 557' ' ' ILE . . . . . 0.405 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 17.1 mt -119.34 125.75 74.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.384 . . . . 10.0 110.186 178.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -107.41 117.23 5.17 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.625 -0.798 . . . . 10.0 112.094 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 3.4 p -70.71 -48.12 56.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.539 0.685 . . . . 10.0 109.757 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . 0.545 ' CD ' ' HZ3' ' A' ' 461' ' ' LYS . 0.9 OUTLIER -140.55 140.07 35.13 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.608 -1.178 . . . . 10.0 108.676 178.754 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 77.8 mtt-85 -78.65 164.05 24.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.824 0.345 . . . . 10.0 110.18 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -86.98 153.26 21.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.198 -0.455 . . . . 10.0 109.839 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.89 -44.1 81.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.122 0.487 . . . . 10.0 110.026 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 58.7 m -99.53 142.23 31.28 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.488 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 565' ' ' ARG . . . . . 0.446 ' O ' ' HG3' ' A' ' 565' ' ' ARG . 0.0 OUTLIER -68.84 -27.88 66.23 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.538 -179.555 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -59.98 -51.22 70.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.107 0.479 . . . . 10.0 110.391 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 13.2 mt -72.59 -25.36 22.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.269 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -69.51 -50.62 43.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.069 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 17.1 m-20 -62.7 -37.67 87.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.03 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -58.86 -33.02 69.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.918 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 39.5 tp -78.49 -35.21 46.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.876 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -74.11 -30.43 62.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.898 0.38 . . . . 10.0 111.114 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.61 17.52 14.61 Favored Glycine 0 CA--C 1.521 0.426 0 C-N-CA 121.082 -0.58 . . . . 10.0 114.015 -178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -72.17 -41.59 66.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 117.595 0.697 . . . . 10.0 110.557 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 575' ' ' SER . . . . . 0.426 ' OG ' ' HB3' ' A' ' 554' ' ' LEU . 19.4 t -87.61 161.27 17.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.475 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 73.43 36.32 55.01 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.147 -0.549 . . . . 10.0 112.794 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -61.61 130.44 45.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.442 0.163 . . . . 10.0 111.027 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 578' ' ' GLN . . . . . 0.603 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 17.5 tt0 64.03 19.7 11.87 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.635 0.584 . . . . 10.0 111.23 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 87.41 51.34 3.33 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.634 -0.793 . . . . 10.0 112.821 179.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -105.76 -168.83 1.5 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.847 -0.208 . . . . 10.0 110.484 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 581' ' ' ALA . . . . . 0.455 ' HA ' ' HB ' ' A' ' 419' ' ' ILE . . . -88.45 155.23 19.79 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.122 0.487 . . . . 10.0 111.72 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 173.72 177.47 42.95 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.734 -0.667 . . . . 10.0 111.612 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.9 p -153.87 134.43 13.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.823 0.312 . . . . 10.0 110.614 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.88 124.05 49.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.596 -0.274 . . . . 10.0 111.078 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 585' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 3.6 tpm_? -131.19 115.92 17.0 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.951 -0.389 . . . . 10.0 109.951 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -114.5 151.14 33.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.015 0.436 . . . . 10.0 111.285 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 587' ' ' TYR . . . . . 0.439 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 86.4 m-85 -132.54 169.25 16.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.378 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 10.8 tp -168.22 162.16 12.65 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.169 0.293 . . . . 10.0 110.24 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -113.59 157.31 22.25 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.019 -0.363 . . . . 10.0 110.019 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 590' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 70.6 mmm -71.87 -14.21 61.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.162 0.506 . . . . 10.0 111.276 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -121.26 24.18 10.13 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.673 -0.694 . . . . 10.0 109.314 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -74.14 169.04 18.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.194 -0.912 . . . . 10.0 111.373 -179.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -69.18 -34.46 74.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 10.8 tp -69.87 -21.64 63.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.236 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 3.5 mmt -75.59 -5.86 47.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.097 0.475 . . . . 10.0 110.832 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -93.27 -11.08 33.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.461 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 19.0 pt -74.53 -8.79 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 121.138 0.495 . . . . 10.0 110.539 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -79.19 -10.15 59.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.522 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 72.88 -53.86 0.7 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.923 0.764 . . . . 10.0 111.512 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 31.1 t -89.58 134.84 33.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.498 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -85.01 -4.3 59.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.151 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.66 -33.93 75.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.327 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 21.4 t -65.39 -50.81 70.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.216 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 604' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 0.2 OUTLIER -63.42 -38.96 93.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.848 179.946 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -68.5 -30.37 73.14 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.822 -0.704 . . . . 10.0 112.639 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 41.0 tpp -81.42 -38.35 26.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.712 0.291 . . . . 10.0 111.27 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 46.9 mtt -66.63 -16.85 64.49 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.545 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 608' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 604' ' ' SER . 33.6 mtt180 -68.45 -15.58 63.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.896 0.379 . . . . 10.0 110.936 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -87.04 23.44 1.77 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.277 -0.42 . . . . 10.0 111.2 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 49.0 tp -93.08 -14.58 27.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.076 0.465 . . . . 10.0 110.589 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 611' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 92.13 -48.88 2.71 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.992 -0.623 . . . . 10.0 111.919 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 612' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.0 OUTLIER 73.55 -55.01 0.68 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.647 0.779 . . . . 10.0 112.01 179.057 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 15.3 mmtp 59.35 80.74 0.26 Allowed Pre-proline 0 N--CA 1.464 0.273 0 O-C-N 123.475 0.484 . . . . 10.0 111.847 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 614' ' ' PRO . . . . . 0.548 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 21.4 Cg_endo -62.9 95.29 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.629 2.22 . . . . 10.0 112.103 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 140.16 -24.2 2.69 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.21 -0.904 . . . . 10.0 111.03 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -114.38 113.56 24.69 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.73 -0.47 . . . . 10.0 109.73 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -66.32 110.4 3.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.827 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 4.5 tp -67.99 -30.4 48.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.734 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 43.55 74.85 0.11 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.615 0.766 . . . . 10.0 112.643 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -120.44 99.53 47.88 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.66 -26.43 72.71 Favored 'Trans proline' 0 N--CA 1.475 0.403 0 C-N-CA 123.494 2.796 . . . . 10.0 114.584 -178.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 43.3 p-90 -63.06 -24.72 68.04 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.837 -0.345 . . . . 10.0 111.523 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 65.9 t -63.2 -45.83 97.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-O 120.996 0.427 . . . . 10.0 110.115 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 51.6 m -62.08 -36.18 80.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.484 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -67.85 -38.27 82.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.289 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -64.68 -45.71 85.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.836 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 98.6 mt -65.46 -37.57 80.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.136 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -57.92 -41.01 81.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.002 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -70.75 -38.94 73.52 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.895 -0.409 . . . . 10.0 109.895 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.41 89.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.343 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -63.12 -42.24 99.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.076 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -61.9 -32.45 72.83 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.159 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 633' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 637' ' ' ARG . 43.1 mttm -63.75 -37.54 87.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.425 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 40.0 t -61.83 -47.81 91.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.99 -40.84 97.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.721 179.254 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 28.3 m -61.56 -35.3 77.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.349 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 637' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 633' ' ' LYS . 72.4 mtt180 -67.22 -48.71 67.03 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -60.46 -42.49 96.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.512 -0.767 . . . . 10.0 110.445 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -56.21 -44.32 79.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.745 -0.662 . . . . 10.0 110.762 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.6 -42.67 99.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.298 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 71.3 mt -58.77 -53.41 47.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.231 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 642' ' ' ARG . . . . . 0.461 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 0.0 OUTLIER -69.02 -27.92 66.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.643 0.259 . . . . 10.0 110.711 -179.792 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -66.78 -38.4 86.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.259 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -68.07 -32.01 72.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.033 0.444 . . . . 10.0 110.141 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 95.5 mt -71.53 -26.29 62.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.384 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 646' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 89.2 mt -62.69 -32.85 74.01 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.383 179.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -64.48 -13.53 52.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.855 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -107.3 -46.22 3.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.115 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -73.3 -29.28 62.6 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 -177.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -64.87 -34.78 79.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.038 0.447 . . . . 10.0 109.835 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 16.7 t -65.02 -43.07 96.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.738 -0.665 . . . . 10.0 109.917 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -64.06 -39.8 94.88 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.025 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -61.15 -43.57 98.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.174 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -61.32 -51.44 68.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.418 -0.81 . . . . 10.0 110.968 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -61.92 -42.89 99.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.797 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 656' ' ' ARG . . . . . 0.406 ' O ' ' HB2' ' A' ' 660' ' ' TYR . 2.6 ttp-105 -62.5 -36.12 81.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.325 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -63.9 -48.3 77.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.632 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.53 -50.22 68.19 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.851 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.48 -35.99 76.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 111.901 0.334 . . . . 10.0 111.901 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 660' ' ' TYR . . . . . 0.406 ' HB2' ' O ' ' A' ' 656' ' ' ARG . 2.9 m-30 -70.6 -35.62 73.09 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 9.9 t -62.23 -50.66 70.87 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -57.3 -43.59 83.34 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.431 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 38.7 ttt-85 -63.05 -41.84 99.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.613 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -65.82 -43.11 89.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.606 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -58.45 -50.1 74.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.245 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 26.8 mt -70.02 -16.12 63.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.171 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 12.1 tp -83.8 -46.04 12.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.662 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -68.73 -41.98 78.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.855 -0.611 . . . . 10.0 112.161 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 27.0 m -74.86 150.93 6.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.038 0.447 . . . . 10.0 111.191 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 1.5 m -94.29 -42.21 9.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.451 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -84.32 126.26 33.03 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.564 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 5.6 p -127.49 -0.68 3.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.004 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 673' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 677' ' ' ASN . 0.8 OUTLIER -52.65 -45.51 66.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.348 -0.842 . . . . 10.0 112.364 -178.66 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -62.34 -46.25 89.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.591 0.234 . . . . 10.0 111.586 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 3.9 m -63.57 -46.84 84.05 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.767 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 36.4 mm -65.27 -37.96 81.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.99 0.424 . . . . 10.0 110.856 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . 0.442 ' HB2' ' O ' ' A' ' 673' ' ' SER . 5.5 t30 -68.53 -40.23 80.83 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.58 -0.282 . . . . 10.0 111.316 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 29.0 m -62.77 -42.27 99.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.748 0.308 . . . . 10.0 111.142 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 27.1 pt -77.44 -21.04 14.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.677 -0.409 . . . . 10.0 110.844 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 10.7 mtm-85 -59.53 -46.37 89.05 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.04 0.448 . . . . 10.0 110.144 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -65.81 -44.59 85.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.565 -0.743 . . . . 10.0 110.931 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -62.62 -47.4 83.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.245 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 41.2 t -61.18 -44.95 99.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.767 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -62.74 -42.36 99.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.655 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 54.8 tttm -63.25 -48.32 78.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.559 -0.292 . . . . 10.0 110.325 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.85 -40.6 84.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.209 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 30.0 m -64.72 -43.33 93.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.195 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.68 -39.92 84.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.353 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -61.85 -18.17 59.1 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.254 -0.43 . . . . 10.0 112.143 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -79.26 -14.2 59.18 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.852 0.358 . . . . 10.0 111.495 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -127.14 -24.54 3.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.958 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 69.4 mt -129.72 101.03 18.81 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.579 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.12 140.39 71.45 Favored 'Trans proline' 0 N--CA 1.464 -0.233 0 C-N-CA 122.518 2.145 . . . . 10.0 111.494 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -52.28 113.8 1.37 Allowed 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.897 2.398 . . . . 10.0 112.823 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 56.71 67.77 0.95 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.391 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 6.0 p -118.9 -172.32 2.27 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.914 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 35.9 mt -83.5 154.89 23.64 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.769 -0.456 . . . . 10.0 109.769 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -57.71 -34.32 69.34 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 120.937 0.399 . . . . 10.0 111.69 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -74.34 -6.3 47.29 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.288 -0.414 . . . . 10.0 111.882 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.22 8.75 40.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.839 0.352 . . . . 10.0 110.234 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 701' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -101.43 108.13 19.64 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.966 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -83.72 82.78 8.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.364 0.602 . . . . 10.0 109.414 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 703' ' ' ILE . . . . . 0.486 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 43.0 mm -60.86 -50.22 85.95 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.201 -0.909 . . . . 10.0 111.956 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 704' ' ' PRO . . . . . 0.486 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 47.7 Cg_exo -56.27 -47.45 24.28 Favored 'Trans proline' 0 C--N 1.36 1.138 0 C-N-CA 122.052 1.834 . . . . 10.0 112.561 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -60.67 -40.67 98.3 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.448 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 61.1 tp -70.47 -45.89 64.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.389 0.138 . . . . 10.0 111.006 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -59.19 -51.23 70.87 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.357 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -59.71 -35.72 75.08 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.826 0.346 . . . . 10.0 110.771 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -65.5 -45.92 81.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.277 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 79.5 mt -64.87 -38.19 90.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.135 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.88 -36.22 72.69 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.695 0.628 . . . . 10.0 112.695 -179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -92.68 -44.48 8.54 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -177.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 713' ' ' ASP . . . . . 0.663 ' O ' ' HE3' ' A' ' 828' ' ' LYS . 0.8 OUTLIER -89.27 -31.51 17.83 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 -177.547 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -106.15 -4.22 20.55 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.057 -0.657 . . . . 10.0 112.079 -178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 25.6 t70 57.67 28.72 16.19 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.326 0.584 . . . . 10.0 110.526 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 43.8 tp -118.96 129.79 55.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.09 -0.505 . . . . 10.0 111.662 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -97.68 128.13 44.14 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.492 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 11.8 mt -140.0 122.11 9.87 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 120.782 0.325 . . . . 10.0 111.695 -179.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -81.81 60.86 7.72 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.859 2.373 . . . . 10.0 111.675 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 52.8 mt -63.48 -42.63 96.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.383 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -67.04 -31.67 72.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.207 0.527 . . . . 10.0 110.474 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -88.7 6.86 36.55 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.905 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -106.11 -54.1 2.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.857 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 77.8 mt -63.68 -23.45 67.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.756 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 725' ' ' ASP . . . . . 0.467 ' OD1' ' HG3' ' A' ' 726' ' ' LYS . 0.0 OUTLIER -78.59 -11.79 59.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.942 -179.76 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 726' ' ' LYS . . . . . 0.467 ' HG3' ' OD1' ' A' ' 725' ' ' ASP . 50.6 mttp -111.71 -48.63 3.05 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.01 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -120.64 94.71 48.93 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.26 0.553 . . . . 10.0 110.817 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.27 -3.62 14.11 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.456 2.104 . . . . 10.0 111.851 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.44 -12.31 61.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.012 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 730' ' ' LEU . . . . . 0.476 HD23 ' NH1' ' A' ' 738' ' ' ARG . 32.2 mt -66.48 -34.69 78.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.154 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 53.42 -104.09 0.19 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.142 -0.936 . . . . 10.0 111.318 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.16 -56.34 0.86 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.05 -179.104 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -58.0 -54.41 47.25 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.513 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.28 -31.27 71.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.114 0.483 . . . . 10.0 110.539 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 39.9 tp -65.69 -46.76 77.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.802 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 22.8 mtt180 -63.49 -36.33 83.4 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.966 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -60.37 -45.2 94.34 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.404 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 738' ' ' ARG . . . . . 0.476 ' NH1' HD23 ' A' ' 730' ' ' LEU . 16.7 mmm-85 -63.35 -41.71 98.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.513 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 90.7 mt -62.53 -51.84 67.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.694 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 36.4 tp -62.08 -44.37 96.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.418 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -61.01 -41.23 96.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.745 0.307 . . . . 10.0 111.407 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 23.8 tp60 -60.59 -42.98 97.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.187 -179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -39.82 95.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.965 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 75.3 mt -62.45 -44.01 98.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.765 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -46.5 87.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.24 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 88.3 t -65.53 -40.2 87.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.126 0.488 . . . . 10.0 110.155 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -59.69 -43.39 94.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.78 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 748' ' ' GLN . . . . . 0.493 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 24.5 mt-30 -59.1 -44.2 91.94 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.02 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.45 -39.94 89.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.475 -0.329 . . . . 10.0 110.77 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -68.36 -34.92 76.93 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.975 0.417 . . . . 10.0 109.879 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -72.42 -39.38 67.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.07 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 752' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 45.9 mt-10 -53.39 -39.83 64.56 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 13.3 t -75.17 -30.93 23.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.315 -0.402 . . . . 10.0 112.003 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 50.5 t -85.42 -46.52 17.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.245 0.545 . . . . 10.0 111.098 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.03 132.11 3.94 Favored Glycine 0 N--CA 1.441 -0.995 0 N-CA-C 110.404 -1.078 . . . . 10.0 110.404 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 756' ' ' ALA . . . . . 0.6 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -56.84 -51.81 67.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 117.001 0.4 . . . . 10.0 111.646 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 757' ' ' GLU . . . . . 0.467 ' H ' ' CD ' ' A' ' 757' ' ' GLU . 11.2 mp0 -59.15 -39.27 81.89 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.076 -0.511 . . . . 10.0 111.132 -179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 16.1 tpt -73.56 -38.68 65.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.725 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 7.8 tpt -60.59 -36.49 78.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.794 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -61.81 -37.54 84.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.33 0.586 . . . . 10.0 109.491 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -71.07 -34.48 71.22 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.527 -0.761 . . . . 10.0 109.414 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -68.1 -51.61 44.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.272 -0.876 . . . . 10.0 110.304 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -56.84 -44.48 82.14 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.933 0.397 . . . . 10.0 110.145 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 43.6 tttp -60.44 -50.41 73.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.343 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.27 -42.23 99.72 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.494 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 44.7 t -62.49 -49.19 84.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.424 0.154 . . . . 10.0 110.588 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 18.7 ttt -59.56 -43.3 93.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.657 0.265 . . . . 10.0 110.877 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 84.4 mt -64.28 -51.78 61.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.604 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 769' ' ' GLN . . . . . 0.407 ' HG3' ' N ' ' A' ' 770' ' ' THR . 13.9 pt20 -63.43 -37.29 86.71 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.796 0.295 . . . . 10.0 111.796 -178.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 770' ' ' THR . . . . . 0.407 ' N ' ' HG3' ' A' ' 769' ' ' GLN . 12.6 m -68.39 -34.84 76.76 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.665 -0.495 . . . . 10.0 109.665 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.8 tt -62.14 -50.05 73.4 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.84 -34.05 75.27 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.034 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 773' ' ' SER . . . . . 0.409 ' HA ' ' NZ ' ' A' ' 776' ' ' LYS . 72.7 m -61.63 -52.87 62.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.467 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 16.9 mt -78.02 -22.74 48.8 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.887 -0.325 . . . . 10.0 111.675 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 31.1 t-105 -63.94 -50.37 68.9 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.952 -0.299 . . . . 10.0 110.821 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.409 ' NZ ' ' HA ' ' A' ' 773' ' ' SER . 10.9 ptpp? -62.25 -35.25 78.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.919 0.39 . . . . 10.0 110.434 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -67.28 -41.66 85.11 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 73.5 t60 -61.74 -38.16 86.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.002 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 63.6 mt -66.0 -49.02 69.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.117 179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -61.52 -45.25 95.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.543 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.32 94.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.997 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 37.9 ttm -64.39 -42.86 95.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.766 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 783' ' ' ASP . . . . . 0.441 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 38.5 t70 -64.88 -41.13 95.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.209 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -62.97 -35.35 79.86 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.681 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 13.7 tp -78.37 -35.45 47.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.809 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -59.07 -38.04 78.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.597 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 787' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 C-N-CA 120.998 -0.281 . . . . 10.0 111.157 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo . . . . . 0 CA--C 1.529 0.231 0 N-CA-C 113.535 0.552 . . . . 10.0 113.535 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 800' ' ' LYS . . . . . 0.451 ' NZ ' ' HB2' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -91.0 -48.42 6.99 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.89 -0.324 . . . . 10.0 110.65 -179.674 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 -63.55 -38.88 92.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.219 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -65.11 -40.23 94.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.065 0.46 . . . . 10.0 109.922 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -60.56 -42.52 96.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.06 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -65.98 -39.72 90.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.571 -0.74 . . . . 10.0 110.601 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 41.3 ttp85 -61.34 -45.31 94.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.015 0.436 . . . . 10.0 110.431 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -65.66 -46.97 77.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.279 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 3.5 p -64.59 -37.54 87.92 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.608 -0.269 . . . . 10.0 111.652 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -64.74 -45.79 84.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.757 0.313 . . . . 10.0 110.2 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 13.2 m -64.82 -42.29 95.09 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.01 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 38.5 ttm -60.84 -37.29 81.56 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.866 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -70.23 -41.45 73.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.442 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.21 -50.05 74.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.669 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.41 -33.83 75.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.387 179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 11.6 ttt -63.82 -47.83 79.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.515 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 91.2 mt -62.46 -41.45 98.76 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.929 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -63.09 -44.25 96.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.848 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 12.1 m -73.46 -29.82 62.78 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.896 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 55.0 tp -62.56 -56.79 14.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.976 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 43.5 pttt -62.24 -28.87 70.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.674 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -62.35 -67.05 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.32 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . 0.516 ' HA ' ' OG ' ' A' ' 824' ' ' SER . 1.3 mm-40 -61.43 -28.61 69.39 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 -178.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 5.6 t -60.23 -41.05 85.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 178.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 22.4 mm -76.56 -46.49 31.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.251 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 824' ' ' SER . . . . . 0.516 ' OG ' ' HA ' ' A' ' 821' ' ' GLU . 0.1 OUTLIER -63.47 -42.25 98.59 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 121.029 -0.268 . . . . 10.0 111.372 -179.42 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 97.5 m -59.42 -39.56 83.9 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.7 0.286 . . . . 10.0 111.194 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 76.3 mt -67.73 -17.97 64.74 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.099 0.476 . . . . 10.0 110.612 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 3.9 m -100.77 -29.52 12.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.157 179.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 828' ' ' LYS . . . . . 0.663 ' HE3' ' O ' ' A' ' 713' ' ' ASP . 77.7 mttt -70.1 -16.22 63.09 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.276 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.2 p -59.75 131.45 24.35 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.334 0.587 . . . . 10.0 111.055 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -97.88 96.9 8.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.823 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.636 179.68 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 86.9 t80 . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 121.003 0.43 . . . . 10.0 111.173 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.99 173.33 12.95 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.886 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.31 129.28 40.47 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.138 -0.319 . . . . 10.0 110.138 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.428 ' C ' ' H ' ' A' ' 15' ' ' ASP . 6.3 mmt180 -61.85 139.52 58.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.897 -178.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.8 m120 72.35 -19.16 0.3 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.057 0.943 . . . . 10.0 112.046 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.428 ' H ' ' C ' ' A' ' 13' ' ' ARG . 22.2 t70 -102.9 -64.85 1.04 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.825 0.345 . . . . 10.0 111.586 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -70.07 -27.73 64.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.441 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.7 p -55.67 -62.44 1.69 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.765 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.8 mt -62.69 -36.59 83.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.523 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.0 ttp-105 -63.87 -48.84 75.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.576 -0.283 . . . . 10.0 110.914 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.2 mtp180 -65.85 -38.12 88.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.922 0.391 . . . . 10.0 110.042 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 41.8 mtt -62.29 -41.64 98.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.431 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.401 ' HD3' ' O ' ' A' ' 22' ' ' ARG . 15.5 tpp180 -61.75 -36.52 81.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.308 -0.406 . . . . 10.0 109.91 179.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -63.76 -37.64 88.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.205 -0.452 . . . . 10.0 109.899 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.5 t -72.79 -37.35 54.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.849 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 36.3 t -57.84 -36.13 54.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.663 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -59.9 -40.27 88.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.182 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.1 mt -66.04 -41.88 90.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.912 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.97 -37.61 78.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.414 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -66.56 -25.21 66.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.018 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -93.17 -17.58 23.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.983 0.421 . . . . 10.0 111.073 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 18.3 mtt -88.02 -25.51 23.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.022 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.473 ' OE1' ' HD3' ' A' ' 72' ' ' ARG . 20.2 tt0 -56.78 -49.7 92.27 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 116.166 -0.47 . . . . 10.0 112.01 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.47 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 51.2 Cg_exo -55.53 -28.96 67.28 Favored 'Trans proline' 0 C--N 1.363 1.323 0 C-N-CA 122.138 1.892 . . . . 10.0 112.474 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.66 -40.78 66.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.995 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 23.6 mmt -67.59 -29.86 69.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.483 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 23.0 mt-10 -62.89 -32.15 73.35 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.224 0.535 . . . . 10.0 110.251 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -78.13 -24.8 47.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.112 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.9 mp -72.86 142.28 47.95 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.251 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 p -75.56 172.02 13.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.712 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -58.35 -43.71 88.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.101 0.477 . . . . 10.0 110.689 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -67.93 -34.54 76.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.245 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.94 -36.05 82.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.547 -0.297 . . . . 10.0 110.822 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.4 mt -61.55 -46.62 89.15 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.04 -0.726 . . . . 10.0 109.04 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -65.69 -35.7 81.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.289 -0.869 . . . . 10.0 109.643 178.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.76 -36.7 92.32 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.622 -0.717 . . . . 10.0 111.311 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -67.18 -39.29 86.39 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.491 -0.559 . . . . 10.0 109.491 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.7 m -60.73 -45.97 92.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.738 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.48 -35.16 79.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.803 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -62.22 -42.43 99.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.311 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -59.64 -40.21 86.89 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.3 -0.409 . . . . 10.0 109.982 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.7 tpp180 -62.68 -43.31 99.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.767 -0.652 . . . . 10.0 109.955 179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' A' ' 56' ' ' LYS . . . -67.84 -42.09 81.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.633 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 55.8 mtp180 -61.57 -40.0 93.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.74 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 33.2 mt -62.92 -34.17 76.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.168 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.59 -34.87 76.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.158 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 56.0 mmtt -76.9 -43.88 33.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.077 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 145.77 78.3 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.725 -0.75 . . . . 10.0 112.335 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -130.62 144.94 51.77 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.647 -0.501 . . . . 10.0 109.647 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.5 t -85.75 131.52 34.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.5 tp -56.17 -42.38 76.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.036 0.446 . . . . 10.0 111.038 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -66.75 -16.22 64.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.537 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -88.4 -14.88 36.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.042 0.448 . . . . 10.0 110.536 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.4 mt -87.49 -9.93 53.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.4 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.504 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 76.4 mt -47.3 -53.29 29.75 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 113.399 0.888 . . . . 10.0 113.399 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.504 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 52.1 Cg_exo -54.37 -56.82 2.18 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.905 1.737 . . . . 10.0 113.199 -179.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -65.06 -43.41 92.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.89 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.72 80.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.569 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -65.25 -34.0 77.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.851 -179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.04 -44.66 83.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.451 -0.341 . . . . 10.0 110.562 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.7 t -62.54 -48.6 87.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.436 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 71.4 t -61.9 -39.74 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.502 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.473 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 5.4 ttt180 -58.46 -46.13 87.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.454 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -68.9 -42.77 76.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.628 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.34 -36.79 76.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.489 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.9 m -63.19 -34.06 76.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.708 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.403 ' O ' ' HA3' ' A' ' 80' ' ' GLY . 11.2 mtmm -70.47 -30.5 67.33 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.732 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -89.47 -38.8 13.79 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 48.9 t -81.47 -64.54 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.793 0.33 . . . . 10.0 111.632 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -82.07 -33.28 29.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.739 0.304 . . . . 10.0 111.816 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . 0.403 ' HA3' ' O ' ' A' ' 76' ' ' LYS . . . 91.89 13.73 57.45 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.582 -0.818 . . . . 10.0 111.392 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 59.0 ttm -125.02 127.5 47.08 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.697 0.284 . . . . 10.0 110.267 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -78.63 131.73 36.8 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.241 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.91 117.38 4.97 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 179.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -58.82 154.89 14.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.194 0.521 . . . . 10.0 112.005 -178.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -43.05 94.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.285 -0.87 . . . . 10.0 111.275 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 m -65.77 -29.02 45.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.143 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -67.22 -34.16 76.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.076 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 92' ' ' MET . 68.2 mt -64.15 -37.13 86.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.705 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 53.2 mt -65.31 -49.99 67.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.732 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.94 -36.71 93.24 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.49 -0.777 . . . . 10.0 112.325 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.64 -33.46 86.72 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.134 -0.555 . . . . 10.0 112.308 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' ' 88' ' ' LEU . 56.1 mtt -74.07 -36.72 64.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.967 0.413 . . . . 10.0 110.146 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 95.9 t -64.35 -35.57 74.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.34 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 94.2 mt -77.39 -0.8 27.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.643 -0.708 . . . . 10.0 112.195 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -83.84 -32.27 25.35 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.267 0.556 . . . . 10.0 109.924 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -98.22 -178.93 4.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.274 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . 0.43 ' HA ' ' O ' ' A' ' 387' ' ' LEU . 21.9 ttt85 -80.5 71.73 7.36 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.455 ' SG ' ' HB3' ' A' ' 408' ' ' ASP . 14.6 m -141.32 162.93 34.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.432 -178.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 36.3 mm -110.36 127.27 67.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.468 -0.787 . . . . 10.0 108.988 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -101.25 105.66 16.78 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.886 0.374 . . . . 10.0 111.5 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -76.99 107.03 9.04 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.413 -0.588 . . . . 10.0 109.413 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 55.6 mtt -104.11 -177.44 3.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.059 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -116.55 141.37 48.28 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.847 0.356 . . . . 10.0 111.088 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.21 106.74 2.11 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.204 179.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 138.93 -41.82 1.31 Allowed Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.803 -0.713 . . . . 10.0 111.963 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.04 -73.04 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.845 0.355 . . . . 10.0 110.554 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 159.52 126.77 0.87 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.593 -0.813 . . . . 10.0 112.445 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.518 ' HZ2' ' CD ' ' A' ' 210' ' ' GLU . 13.8 mtmt -109.04 -60.68 1.72 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.906 0.384 . . . . 10.0 110.177 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -31.85 72.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.847 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.1 mp -72.75 -14.77 61.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.58 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 20.4 m -100.32 -30.59 11.78 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.266 0.555 . . . . 10.0 110.618 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.03 -9.81 34.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.415 -0.812 . . . . 10.0 112.504 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.92 -22.91 61.41 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.722 0.267 . . . . 10.0 111.722 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.407 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 54.9 mt -72.58 -56.79 3.68 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.214 0.45 . . . . 10.0 112.214 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . 0.407 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 35.5 Cg_endo -63.12 -31.13 75.64 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 122.15 1.9 . . . . 10.0 112.327 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.72 -45.92 77.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.51 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.418 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 62.9 t80 -63.06 -45.74 90.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.598 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 44.7 tp -60.39 -51.79 67.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.944 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -71.38 -14.94 62.33 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.862 0.319 . . . . 10.0 111.862 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -81.77 -22.85 36.97 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.685 0.279 . . . . 10.0 110.411 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.6 mt -61.9 -31.17 71.45 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.866 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.38 -19.36 61.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.239 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 73.33 9.19 76.95 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.193 -0.527 . . . . 10.0 113.117 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -76.33 -18.33 58.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.733 0.301 . . . . 10.0 110.867 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 103.16 127.97 6.24 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.637 -0.792 . . . . 10.0 113.243 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.1 t -105.84 118.74 53.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 178.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 39.5 m170 -101.09 101.74 12.55 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.853 0.359 . . . . 10.0 111.043 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 38.3 t -92.19 116.53 33.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.767 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 84.0 t -105.27 114.78 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.917 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -101.71 164.12 11.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.634 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.7 m -69.52 -26.95 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -148.32 175.18 11.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.718 0.294 . . . . 10.0 110.705 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -78.35 -25.44 46.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.68 -179.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.21 -56.13 26.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.724 0.297 . . . . 10.0 110.717 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.8 mt -65.78 -38.22 88.44 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.917 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.64 -51.62 69.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.798 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -70.47 -31.48 68.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.039 0.447 . . . . 10.0 110.693 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 138' ' ' ARG . 1.7 ttp180 -63.08 -57.51 10.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.806 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.23 -32.65 73.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.888 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -59.38 -39.4 83.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.903 0.382 . . . . 10.0 111.042 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -90.4 -28.5 18.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.209 -0.45 . . . . 10.0 111.391 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -73.17 -43.95 60.71 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.537 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -89.2 -1.36 58.05 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.865 0.364 . . . . 10.0 111.15 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.495 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 58.4 ttm-85 -61.62 -49.23 87.63 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' PRO . . . . . 0.458 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 18.3 Cg_exo -66.93 -1.26 5.77 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 122.163 1.909 . . . . 10.0 112.621 -179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.8 tp -101.93 -52.33 3.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.202 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -69.47 -45.49 68.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.165 -0.471 . . . . 10.0 111.586 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -70.1 -15.35 62.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.111 0.481 . . . . 10.0 110.941 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -73.78 -27.39 61.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.344 178.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 66.8 mt -98.93 -11.03 22.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.384 -0.825 . . . . 10.0 110.823 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 115.19 -5.64 21.71 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.293 -0.956 . . . . 10.0 114.149 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 82.7 mt -82.29 131.19 35.23 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.339 0.57 . . . . 10.0 110.639 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 11.0 p -86.3 134.42 33.75 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.217 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 40.4 t -106.83 127.34 62.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.409 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -123.22 134.89 9.67 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.764 -0.731 . . . . 10.0 111.969 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 5.4 tp -108.91 130.57 61.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.898 0.38 . . . . 10.0 110.305 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -111.89 102.3 10.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.111 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 161' ' ' MET . 97.0 mt -90.9 141.99 27.16 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.451 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.12 112.0 1.08 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.85 2.366 . . . . 10.0 112.41 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 100.12 18.68 21.32 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.995 -0.621 . . . . 10.0 112.447 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' MET . . . . . 0.507 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 8.2 ttp -82.07 140.13 46.14 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 109.881 -0.415 . . . . 10.0 109.881 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.88 153.17 32.4 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.509 2.139 . . . . 10.0 112.832 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . 0.435 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -54.2 -49.0 92.67 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.939 0.718 . . . . 10.0 112.939 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.435 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 50.5 Cg_exo -55.67 -36.35 94.68 Favored 'Trans proline' 0 C--N 1.36 1.158 0 C-N-CA 121.824 1.683 . . . . 10.0 112.155 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -70.63 -43.1 69.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.41 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' A' ' 161' ' ' MET . 62.5 mttm -61.34 -46.26 90.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.568 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -57.87 -39.34 77.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.059 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -68.91 -37.31 78.87 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.839 0.352 . . . . 10.0 111.204 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -74.09 -39.19 63.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.454 -179.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -75.8 -25.06 56.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.442 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.84 -5.97 54.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.872 0.368 . . . . 10.0 110.591 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -78.78 175.7 10.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.127 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -74.12 -44.42 53.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.821 0.344 . . . . 10.0 110.537 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 70.4 mt -126.69 123.87 63.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.931 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.2 m -112.92 128.12 56.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.998 0.428 . . . . 10.0 111.448 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -104.24 135.24 46.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.752 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.19 173.34 44.19 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.304 -0.951 . . . . 10.0 112.826 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.1 m -92.35 151.81 20.08 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.151 0.18 . . . . 10.0 110.538 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -56.85 -43.44 81.17 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -59.08 -51.94 67.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.687 0.28 . . . . 10.0 111.532 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -66.14 -37.4 85.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.986 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -59.67 -39.78 85.61 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.88 0.372 . . . . 10.0 110.913 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -74.97 -41.8 31.7 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.738 -0.744 . . . . 10.0 111.548 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -62.95 -36.76 84.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.033 0.445 . . . . 10.0 110.389 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 185' ' ' ASP . . . . . 0.441 ' CG ' ' HZ3' ' A' ' 166' ' ' LYS . 11.3 m-20 -60.35 -44.57 95.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.012 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -62.83 -38.14 89.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.339 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 74.8 mt -63.03 -48.16 79.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.776 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 40.9 mtm-85 -67.55 -37.76 83.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.799 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -61.62 -50.36 72.87 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.514 -0.766 . . . . 10.0 111.498 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.01 1.18 28.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.754 -0.657 . . . . 10.0 112.463 -178.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 22.5 ttp -108.47 11.01 27.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.113 0.482 . . . . 10.0 110.566 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -79.31 170.67 16.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.869 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -106.34 -30.32 9.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.952 0.406 . . . . 10.0 110.451 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.32 139.65 24.11 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.87 -24.31 78.9 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.831 2.354 . . . . 10.0 113.202 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -76.96 -16.02 59.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.68 0.276 . . . . 10.0 111.125 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -76.88 -9.95 59.04 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.345 -0.389 . . . . 10.0 110.646 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -54.87 155.54 4.31 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.787 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 11.4 m -133.26 -15.4 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.784 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -87.32 -175.2 5.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.305 0.574 . . . . 10.0 111.691 -179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -145.12 -171.23 3.61 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.36 -0.837 . . . . 10.0 108.861 179.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 24.5 tttm -65.44 131.54 46.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.008 0.432 . . . . 10.0 110.637 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 19.9 mt -83.85 60.7 5.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.337 0.589 . . . . 10.0 109.629 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -76.59 -60.22 2.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.512 -0.767 . . . . 10.0 112.868 -178.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -127.83 135.0 49.46 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 111.988 0.366 . . . . 10.0 111.988 -178.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.548 ' HB3' ' CD1' ' A' ' 384' ' ' TYR . . . -133.14 126.21 31.21 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.751 178.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 59.1 tp -123.07 116.06 22.86 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.117 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 15.5 m -99.19 141.54 16.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.204 0.526 . . . . 10.0 111.21 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -64.67 -72.6 0.14 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.127 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 210' ' ' GLU . . . . . 0.518 ' CD ' ' HZ2' ' A' ' 108' ' ' LYS . 31.1 mm-40 -109.02 109.51 20.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.768 0.318 . . . . 10.0 110.82 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 34.0 m -69.32 -20.96 24.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.944 0.402 . . . . 10.0 110.653 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.98 -46.05 82.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.58 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.33 -39.4 8.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.745 0.646 . . . . 10.0 112.745 -178.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 58.6 mt -74.34 -30.33 26.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 113.225 0.824 . . . . 10.0 113.225 -177.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 42.5 mt -112.7 -45.58 3.21 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.925 0.713 . . . . 10.0 112.925 -178.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 37.8 mm -79.02 -65.92 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.736 0.643 . . . . 10.0 112.736 -178.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.72 -61.22 2.75 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.734 0.642 . . . . 10.0 112.734 -177.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -90.78 74.85 6.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.983 0.421 . . . . 10.0 110.724 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -109.47 -51.38 2.88 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.251 -0.432 . . . . 10.0 111.575 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.31 3.14 36.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.036 -178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 1.5 m -67.85 112.72 11.35 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.54 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -91.91 126.77 0.93 Allowed 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 122.918 2.412 . . . . 10.0 113.15 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 223' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 374' ' ' SER . 58.1 mt -82.81 88.7 6.76 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.894 -0.593 . . . . 10.0 109.428 178.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 18.3 mt -94.6 113.28 28.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.88 -179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 4.0 mt . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.426 -179.903 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.225 0 N-CA-C 107.868 -1.16 . . . . 10.0 107.868 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 374' ' ' SER . . . . . 0.441 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 20.1 m -151.23 148.69 28.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.214 0.53 . . . . 10.0 112.228 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 16.6 tt -162.03 141.12 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.135 -0.939 . . . . 10.0 109.274 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 5.7 p -96.7 148.39 22.93 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.845 -0.428 . . . . 10.0 109.845 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -58.06 -42.08 84.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 10.0 111.094 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 378' ' ' GLN . . . . . 0.522 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 0.0 OUTLIER -60.95 -29.72 69.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.263 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -95.78 -8.66 33.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.763 0.316 . . . . 10.0 111.011 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -83.52 -50.0 8.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.191 0.519 . . . . 10.0 109.719 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -73.91 -4.92 37.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.636 0.731 . . . . 10.0 110.007 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 15.9 ttt180 -82.96 -4.24 58.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.102 -0.953 . . . . 10.0 109.829 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.403 HD12 HH21 ' A' ' 656' ' ' ARG . 29.5 mt -106.87 4.3 27.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.597 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . 0.548 ' CD1' ' HB3' ' A' ' 206' ' ' ALA . 17.3 m-85 -97.58 143.46 28.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.053 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -70.74 -74.36 0.15 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.295 0.569 . . . . 10.0 110.721 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -95.0 102.89 14.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.734 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 46.5 tp -109.96 118.49 36.59 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.99 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -132.15 161.6 32.94 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.324 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -162.75 163.05 35.02 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.41 -0.9 . . . . 10.0 112.371 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 390' ' ' MET . . . . . 0.617 ' O ' ' HB ' ' A' ' 391' ' ' THR . 27.8 mtm -124.48 178.85 5.19 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 110.096 -0.335 . . . . 10.0 110.096 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 391' ' ' THR . . . . . 0.617 ' HB ' ' O ' ' A' ' 390' ' ' MET . 1.4 t 167.52 -177.75 0.02 OUTLIER 'General case' 0 C--O 1.234 0.276 0 O-C-N 123.774 0.671 . . . . 10.0 109.914 178.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -92.04 143.5 16.58 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.389 -0.684 . . . . 10.0 111.389 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.4 108.28 0.41 Allowed 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.562 0.345 . . . . 10.0 111.671 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -145.86 -19.75 0.46 Allowed 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.062 0.393 . . . . 10.0 112.062 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 31.6 t70 59.41 -101.27 0.12 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 5.2 m 54.52 -104.28 0.21 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.946 0.498 . . . . 10.0 112.29 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -81.51 32.36 0.35 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.969 0.414 . . . . 10.0 111.518 -179.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 398' ' ' ALA . . . . . 0.549 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -67.1 -18.83 65.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.99 0.424 . . . . 10.0 110.781 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -74.11 -15.29 61.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.883 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -84.74 -24.6 28.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.979 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 401' ' ' PHE . . . . . 0.549 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 22.5 m-85 -56.57 -54.49 45.36 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.741 0.305 . . . . 10.0 111.629 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.7 m -76.47 -8.81 57.94 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 40.7 m -95.47 -47.46 6.26 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -178.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 20.0 mt -86.13 -74.13 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.264 0.468 . . . . 10.0 112.264 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 405' ' ' TYR . . . . . 0.522 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 68.7 m-85 -78.95 -8.04 58.55 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.482 0.549 . . . . 10.0 112.482 -177.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm 62.13 58.82 1.75 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.12 0.486 . . . . 10.0 110.763 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 2.4 mt -114.29 156.56 24.15 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.429 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 408' ' ' ASP . . . . . 0.455 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . 20.3 t0 -95.46 147.06 23.94 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.61 -0.885 . . . . 10.0 108.61 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 1.8 m -109.13 104.5 13.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.888 0.375 . . . . 10.0 111.324 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 5.9 t -114.71 129.01 71.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.667 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 61.5 t -90.48 123.59 42.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 110.04 -0.355 . . . . 10.0 110.04 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 50.1 t -90.73 126.65 55.17 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.842 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.17 150.39 88.42 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.556 2.171 . . . . 10.0 111.966 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 16.4 p -77.23 164.24 25.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.015 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -68.63 -35.59 77.5 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.764 -0.828 . . . . 10.0 108.764 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 55.7 mmt-85 -134.69 143.21 45.51 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 114.944 -1.025 . . . . 10.0 108.829 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -60.64 136.63 68.17 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.662 2.241 . . . . 10.0 112.896 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 73.8 mtm -84.92 130.35 34.66 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.324 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.1 mt -111.51 36.13 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.364 0.602 . . . . 10.0 109.962 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 420' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 420' ' ' ARG . 35.4 ttp180 -71.38 123.39 22.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.031 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 14.4 mttm -83.11 99.6 10.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.29 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 422' ' ' ASP . . . . . 0.53 ' OD1' ' HD2' ' A' ' 572' ' ' ARG . 9.0 m-20 -86.46 110.57 19.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.496 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 43.9 mt -94.61 157.28 37.35 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.358 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -71.42 176.29 8.21 Favored 'Trans proline' 0 C--O 1.238 0.489 0 C-N-CA 122.739 2.293 . . . . 10.0 112.894 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -86.63 115.76 24.3 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.445 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 9.9 mt -89.7 87.36 6.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.13 0.49 . . . . 10.0 109.792 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 427' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 588' ' ' LEU . 8.9 t -86.3 126.55 40.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.748 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 428' ' ' TYR . . . . . 0.416 ' O ' ' HG2' ' A' ' 590' ' ' MET . 5.3 m-85 -112.14 177.49 4.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.234 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 84.9 mmm -71.76 -77.04 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.633 0.254 . . . . 10.0 111.396 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 67.0 p -88.12 157.51 18.82 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.96 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -61.27 -30.45 70.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.468 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -60.13 -39.96 88.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.221 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -64.84 -41.2 95.92 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.034 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 434' ' ' LYS . . . . . 0.454 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 38.8 ttpt -59.19 -51.47 69.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.061 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 46.5 mm -63.1 -44.25 99.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.593 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 440' ' ' GLU . 24.7 tp60 -57.65 -45.17 85.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.866 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -63.11 -37.65 88.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.805 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 88.8 mt -59.67 -44.25 93.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.097 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 30.3 mm -62.09 -38.87 81.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.013 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 436' ' ' GLN . 5.9 mm-40 -65.05 -42.44 94.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.871 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . 0.592 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 15.2 t70 -67.71 -42.45 81.96 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 179.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 56.1 mt -58.07 -41.38 80.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.694 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -59.97 -40.9 90.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.15 0.5 . . . . 10.0 110.596 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 444' ' ' GLU . . . . . 0.461 ' CD ' ' HZ2' ' A' ' 448' ' ' LYS . 0.1 OUTLIER -64.95 -28.12 69.3 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.564 -0.744 . . . . 10.0 111.074 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.592 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 14.3 mmt180 -86.11 -43.11 13.33 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.908 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.54 -42.49 98.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.619 -0.264 . . . . 10.0 111.362 -179.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -71.83 -9.93 59.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.471 -0.332 . . . . 10.0 111.232 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 448' ' ' LYS . . . . . 0.461 ' HZ2' ' CD ' ' A' ' 444' ' ' GLU . 4.1 ttmm -104.69 -4.48 22.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.642 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 79.3 30.15 46.97 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.837 -0.697 . . . . 10.0 112.418 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -108.33 131.28 21.86 Favored Pre-proline 0 C--N 1.327 -0.391 0 O-C-N 122.796 -0.238 . . . . 10.0 111.027 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -69.63 143.71 52.36 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.684 2.256 . . . . 10.0 111.442 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 49.0 t -120.42 125.46 74.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.874 0.369 . . . . 10.0 111.676 -178.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 32.5 tp -113.1 105.82 13.92 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 39.6 t -93.4 122.66 45.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.452 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -105.24 91.64 0.78 Allowed Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.14 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.32 140.08 29.9 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.363 -0.236 . . . . 10.0 110.363 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 20.9 pt -77.76 -35.94 21.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 112.506 0.558 . . . . 10.0 112.506 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 7.4 p -122.99 159.45 28.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.95 0.405 . . . . 10.0 112.023 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 74.5 mt -64.72 -36.98 78.96 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -56.52 -46.63 80.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.988 -1.005 . . . . 10.0 110.327 178.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.13 -32.89 72.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.439 179.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 17.2 m -64.39 -44.44 91.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.134 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -68.85 -40.44 79.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.322 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.9 -53.83 54.02 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.417 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.63 -31.59 54.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-O 120.92 0.39 . . . . 10.0 110.877 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 35.4 t -68.63 -41.05 80.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.119 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -59.86 -48.85 80.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.592 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -64.24 -39.51 94.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.866 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 19.8 mt -62.92 -34.43 77.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.986 0.422 . . . . 10.0 110.628 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 7.9 m -71.83 -42.73 66.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.734 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -61.75 -39.5 91.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.372 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -72.76 -18.27 61.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.855 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 79.72 47.93 6.95 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.062 -0.589 . . . . 10.0 112.706 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 65.9 mt -118.77 128.43 75.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 110.396 -0.224 . . . . 10.0 110.396 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 21.5 mmtm -62.24 129.75 42.22 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 54.9 p-80 -161.0 149.49 16.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.759 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -127.53 157.72 39.37 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.209 -0.451 . . . . 10.0 109.842 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.6 t -121.6 130.76 74.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.662 0.268 . . . . 10.0 111.027 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 90.3 mt -83.5 90.08 7.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.599 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -85.16 126.65 33.81 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.433 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -61.23 -22.83 65.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.692 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -85.93 -2.45 58.28 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.066 0.46 . . . . 10.0 110.57 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -130.49 59.41 1.65 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.312 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -61.68 -33.82 74.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.056 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.49 74.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.864 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.54 -33.48 17.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.891 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.5 -57.38 9.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.6 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -54.2 -39.78 66.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.585 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -66.13 -35.75 81.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.246 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 47.9 mt -74.66 -41.99 48.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.493 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 95.6 t -60.41 -34.83 59.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.746 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -59.6 -28.4 67.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.634 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -124.39 26.94 7.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.922 0.391 . . . . 10.0 110.57 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -74.55 -21.9 59.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.17 0.51 . . . . 10.0 110.655 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -94.82 16.23 61.7 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.98 -0.629 . . . . 10.0 111.737 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -74.28 138.01 75.16 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 110.115 -0.328 . . . . 10.0 110.115 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.05 125.84 19.6 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.661 2.24 . . . . 10.0 112.952 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.5 22.33 6.43 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.067 0.766 . . . . 10.0 113.067 178.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -100.95 122.73 44.0 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 121.122 -0.231 . . . . 10.0 110.491 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 35.3 t -97.95 115.64 38.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.912 0.387 . . . . 10.0 110.44 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.9 m -115.33 121.88 44.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.572 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 47.7 mt -101.19 124.36 54.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.271 -0.422 . . . . 10.0 109.94 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -114.44 116.54 29.03 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.817 0.342 . . . . 10.0 111.182 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 21.4 m -81.13 113.94 19.63 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.586 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 63.83 81.46 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.326 -0.852 . . . . 10.0 110.883 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 53.4 tpp -60.95 122.46 14.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.248 -0.887 . . . . 10.0 110.957 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -87.69 166.73 14.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.886 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -65.56 157.7 47.4 Favored Glycine 0 N--CA 1.453 -0.187 0 C-N-CA 121.219 -0.515 . . . . 10.0 112.471 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 68.98 -93.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.977 0.511 . . . . 10.0 110.861 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 88.8 132.78 4.42 Favored Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 121.1 -0.572 . . . . 10.0 111.843 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.62 143.28 25.24 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.499 0.32 . . . . 10.0 110.926 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -64.67 98.6 0.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.646 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 70.4 mt -73.6 101.94 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.129 0.49 . . . . 10.0 109.819 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 514' ' ' VAL . . . . . 0.42 ' HB ' ' O ' ' A' ' 517' ' ' GLY . 6.3 t -71.67 132.02 33.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.865 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.463 HD12 ' OD1' ' A' ' 580' ' ' ASP . 34.0 mt -66.37 125.83 26.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.591 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 93.36 -0.81 68.81 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.101 -0.571 . . . . 10.0 111.847 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' GLY . . . . . 0.42 ' O ' ' HB ' ' A' ' 514' ' ' VAL . . . 106.2 -167.91 14.58 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 110.986 -0.846 . . . . 10.0 110.986 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.9 p -127.06 98.18 5.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 117.278 0.539 . . . . 10.0 110.991 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 52.9 p-90 -58.51 -29.47 66.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.877 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -62.25 -30.01 70.81 Favored 'General case' 0 C--N 1.334 -0.077 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.783 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -86.25 -34.42 20.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.467 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -65.89 -43.95 86.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.612 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.1 m -70.48 -20.07 22.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.94 0.4 . . . . 10.0 110.593 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -91.87 -0.1 57.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -90.29 -10.79 42.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.573 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 44.2 mt -96.04 154.0 17.47 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.834 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -72.62 -57.11 4.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.85 0.357 . . . . 10.0 110.152 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -119.2 88.6 37.76 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.975 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.05 103.3 1.16 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.996 2.464 . . . . 10.0 111.515 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 18.8 p -81.56 173.39 12.43 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.358 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.75 -43.23 80.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.484 0.183 . . . . 10.0 111.446 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -62.28 -41.02 98.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.887 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -68.24 -44.43 75.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.952 0.406 . . . . 10.0 110.408 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 90.3 mt -64.33 -42.48 95.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.254 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -64.89 -42.52 94.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.481 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -58.32 -51.6 69.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.344 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.83 -37.31 79.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.29 -0.413 . . . . 10.0 110.665 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -62.18 -47.68 83.41 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.977 0.418 . . . . 10.0 110.303 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -69.54 -37.82 77.24 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.504 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . 0.561 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 13.2 t70 -61.31 -49.13 78.28 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.238 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -60.43 -39.81 88.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.867 -1.061 . . . . 10.0 110.337 179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 -52.05 -48.61 64.52 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.308 0.38 . . . . 10.0 110.914 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 26.0 t -60.09 -47.44 91.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.91 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 544' ' ' ARG . . . . . 0.561 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 6.2 mtm180 -67.99 -35.73 78.82 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.925 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -64.29 -48.55 75.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.474 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.37 -31.23 71.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.458 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.5 94.76 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.434 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.43 -37.64 80.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.464 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.23 -45.82 89.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.048 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -70.18 -18.41 63.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.022 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -82.92 -28.46 29.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.961 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 129.97 6.34 4.06 Favored Glycine 0 CA--C 1.519 0.324 0 C-N-CA 120.445 -0.883 . . . . 10.0 113.302 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 84.12 -167.6 43.78 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.67 -0.776 . . . . 10.0 112.43 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 36.6 tp -71.67 119.56 16.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.908 0.385 . . . . 10.0 110.879 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -91.45 118.94 30.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.748 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 25.3 mm -103.22 134.99 42.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.289 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 40.6 mt -126.48 121.59 59.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.018 0.437 . . . . 10.0 110.691 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.38 115.71 4.99 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.115 -0.794 . . . . 10.0 111.115 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 20.5 p -71.51 -40.3 70.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.021 0.439 . . . . 10.0 111.266 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -137.55 151.27 48.21 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.036 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 561' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 561' ' ' ARG . 3.5 mmt85 -90.88 150.7 21.42 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -94.94 146.24 24.37 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.806 -0.358 . . . . 10.0 110.588 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -59.46 -51.95 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.05 117.27 16.71 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.233 -0.894 . . . . 10.0 110.127 179.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 565' ' ' ARG . . . . . 0.506 ' HA ' ' HB3' ' A' ' 568' ' ' ASP . 17.1 tpt180 -66.33 -26.62 67.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.125 -0.488 . . . . 10.0 110.216 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -58.87 -36.84 75.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.526 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 59.9 mt -92.75 -34.78 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.646 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 568' ' ' ASP . . . . . 0.506 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 2.2 t70 -60.89 -44.81 96.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.101 0.477 . . . . 10.0 110.693 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -69.55 -24.82 63.77 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.933 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -66.52 -26.83 67.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.747 0.308 . . . . 10.0 110.49 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 57.2 tp -73.13 -33.94 65.82 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 572' ' ' ARG . . . . . 0.53 ' HD2' ' OD1' ' A' ' 422' ' ' ASP . 13.5 ttp180 -76.66 -30.68 56.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.078 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.82 27.77 3.34 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 121.011 -0.614 . . . . 10.0 113.525 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.46 -54.92 5.85 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 179.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.78 172.63 10.65 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.994 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 85.11 47.39 5.27 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.692 -0.766 . . . . 10.0 111.573 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 577' ' ' ARG . . . . . 0.537 ' H ' ' HB3' ' A' ' 580' ' ' ASP . 54.4 mtt180 -108.53 121.16 44.39 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.185 -0.302 . . . . 10.0 110.185 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 59.46 28.99 18.5 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.701 0.63 . . . . 10.0 112.701 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 104.75 4.47 42.54 Favored Glycine 0 N--CA 1.454 -0.111 0 C-N-CA 120.292 -0.956 . . . . 10.0 113.866 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 580' ' ' ASP . . . . . 0.537 ' HB3' ' H ' ' A' ' 577' ' ' ARG . 0.9 OUTLIER -67.79 157.8 33.93 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.942 0.371 . . . . 10.0 110.253 179.23 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -92.7 -103.99 0.12 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.572 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 97.75 175.61 33.78 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.696 -0.764 . . . . 10.0 112.3 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -153.8 120.63 5.63 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.328 -0.249 . . . . 10.0 110.328 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.97 119.64 34.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.818 0.342 . . . . 10.0 110.864 -179.423 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -117.51 113.54 22.15 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.136 -0.483 . . . . 10.0 109.959 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -102.87 147.0 27.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.897 0.379 . . . . 10.0 111.035 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 587' ' ' TYR . . . . . 0.454 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 31.4 m-85 -135.33 158.14 45.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.474 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 588' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 427' ' ' VAL . 10.1 tp -165.78 163.26 18.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.239 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 589' ' ' SER . . . . . 0.497 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.6 OUTLIER -124.1 159.48 29.88 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.558 -0.292 . . . . 10.0 110.33 179.275 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 590' ' ' MET . . . . . 0.416 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 77.9 mmm -74.7 -17.95 60.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.222 0.534 . . . . 10.0 110.282 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -111.03 24.17 13.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.275 -0.875 . . . . 10.0 109.088 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 592' ' ' ASP . . . . . 0.497 ' HB2' ' O ' ' A' ' 589' ' ' SER . 0.9 OUTLIER -76.32 176.82 7.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.127 -0.942 . . . . 10.0 111.954 -178.71 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -82.32 -28.65 31.54 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.661 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 9.3 tp -70.62 -13.42 62.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.142 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 16.3 mmt -76.06 12.08 1.26 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.969 0.414 . . . . 10.0 111.559 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.505 ' HA ' ' NH1' ' A' ' 596' ' ' ARG . 10.9 mmm180 -110.87 -4.03 15.4 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.572 -0.286 . . . . 10.0 111.059 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 28.0 pt -82.82 -10.16 11.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 121.22 0.533 . . . . 10.0 110.459 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -87.8 3.85 46.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.53 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.42 -83.2 0.03 OUTLIER 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.281 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 3.2 m -69.96 125.47 26.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.864 0.364 . . . . 10.0 110.825 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -69.36 -15.95 63.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.984 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -64.94 -32.48 74.22 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.051 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.5 t -61.95 -55.35 24.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.21 0.528 . . . . 10.0 109.69 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 3.6 m -66.19 -35.52 80.65 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.675 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -65.57 -38.01 94.24 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.453 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 29.9 tpp -73.13 -26.07 61.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.098 0.475 . . . . 10.0 110.757 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 51.9 mtt -72.35 -12.6 61.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.73 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -76.13 -7.19 54.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.019 0.438 . . . . 10.0 110.725 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -83.25 9.37 10.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.085 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 6.3 mp -80.9 -16.01 54.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.014 0.435 . . . . 10.0 110.478 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 89.97 -48.61 3.25 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.0 -0.619 . . . . 10.0 112.562 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 69.3 -66.65 0.25 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.394 0.677 . . . . 10.0 111.387 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 613' ' ' LYS . . . . . 0.469 ' HZ3' ' CD ' ' A' ' 616' ' ' GLU . 30.3 ttmt 66.32 94.23 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.249 0 O-C-N 123.527 0.517 . . . . 10.0 110.686 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 614' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -50.29 107.85 0.19 Allowed 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 123.26 2.64 . . . . 10.0 112.994 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 118.82 -17.47 10.88 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.734 -0.746 . . . . 10.0 112.288 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 616' ' ' GLU . . . . . 0.469 ' CD ' ' HZ3' ' A' ' 613' ' ' LYS . 18.3 tt0 -93.8 132.68 37.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.953 0.406 . . . . 10.0 110.788 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -102.9 91.6 4.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.475 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 6.4 tp -66.75 -35.69 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.548 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 47.45 66.7 0.95 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.576 -0.738 . . . . 10.0 112.193 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 3.3 m170 -109.04 114.73 57.88 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.606 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.86 -15.88 40.85 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.158 2.572 . . . . 10.0 114.207 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -63.58 -29.02 70.33 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.75 -0.38 . . . . 10.0 110.494 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 23.4 t -69.44 -46.16 76.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 87.9 m -59.21 -44.08 92.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.015 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.47 -31.7 72.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.97 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -70.9 -40.84 71.94 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.944 -0.391 . . . . 10.0 109.944 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 97.2 mt -66.53 -49.11 77.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.434 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -58.66 -35.88 73.27 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.968 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -64.92 -41.05 95.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.935 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -69.53 -40.63 76.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.894 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -60.17 -44.17 95.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.314 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 52.9 ttt85 -65.67 -32.6 74.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.35 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 55.4 mttt -65.27 -35.95 82.6 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.649 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.47 -44.17 98.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 109.253 -0.647 . . . . 10.0 109.253 178.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -66.0 -39.12 90.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.383 -0.826 . . . . 10.0 110.096 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 19.7 m -64.62 -33.52 76.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.048 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -66.94 -36.5 82.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.28 0.562 . . . . 10.0 109.532 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -64.7 -36.83 85.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.309 -0.86 . . . . 10.0 110.007 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -59.04 -40.29 84.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.467 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -61.28 -41.35 96.81 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.077 0.465 . . . . 10.0 110.185 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 43.2 mt -66.35 -42.46 90.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.986 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 642' ' ' ARG . . . . . 0.594 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 2.1 mmm180 -62.68 -42.06 99.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.98 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -59.64 -40.7 88.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.336 -0.847 . . . . 10.0 110.687 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -63.17 -39.31 94.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.281 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 78.6 mt -69.5 -38.62 77.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.38 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 646' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 89.9 mt -60.1 -36.33 77.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.881 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -68.13 -20.65 64.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.494 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -96.02 -44.15 7.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.19 0.519 . . . . 10.0 110.361 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -69.18 -27.86 65.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.839 -0.619 . . . . 10.0 112.026 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -65.28 -30.92 71.83 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.146 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 651' ' ' VAL . . . . . 0.549 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 30.1 t -62.7 -46.7 95.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.57 -30.44 68.23 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.152 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 653' ' ' ASN . . . . . 0.46 ' HA ' ' NH1' ' A' ' 656' ' ' ARG . 13.9 t30 -66.67 -48.0 70.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.539 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.81 -47.24 85.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.869 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 655' ' ' GLN . . . . . 0.549 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 41.4 mt-30 -64.51 -38.69 91.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.257 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 656' ' ' ARG . . . . . 0.46 ' NH1' ' HA ' ' A' ' 653' ' ' ASN . 18.9 ttp-105 -63.7 -48.46 77.0 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.506 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -61.83 -43.92 97.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.537 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -62.93 -50.89 69.06 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.869 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 7.5 tp -69.49 -34.97 64.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 111.984 0.364 . . . . 10.0 111.984 -178.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -68.1 -36.35 79.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.567 0.222 . . . . 10.0 110.584 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 51.3 m -62.0 -48.09 81.89 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -63.6 -45.24 91.27 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.675 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 34.6 ttt-85 -60.4 -35.47 75.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.821 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -71.04 -38.02 72.55 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.686 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -61.93 -49.4 76.3 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 666' ' ' LEU . . . . . 0.472 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 49.4 mt -66.78 -18.25 65.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.795 -0.638 . . . . 10.0 110.713 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 39.5 tp -81.28 -41.57 21.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.008 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -78.65 -40.08 35.19 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.563 0.579 . . . . 10.0 112.563 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 27.4 m -59.68 140.0 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 121.403 0.621 . . . . 10.0 111.58 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 4.1 m -92.8 -10.08 38.14 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.823 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -130.28 160.97 32.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.946 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.01 14.41 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.877 0.37 . . . . 10.0 111.017 -178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 5.7 m -54.21 -58.73 6.26 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.851 0.358 . . . . 10.0 111.827 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 674' ' ' GLU . . . . . 0.418 ' OE2' ' HA ' ' A' ' 674' ' ' GLU . 5.0 mm-40 -63.52 -34.83 78.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 10.0 112.018 -179.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -45.92 87.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.794 0.331 . . . . 10.0 110.272 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 676' ' ' ILE . . . . . 0.478 ' O ' ' HB2' ' A' ' 680' ' ' ARG . 36.0 mm -67.43 -37.68 79.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.142 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -63.71 -47.75 79.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.216 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 44.8 m -55.42 -48.29 74.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.745 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 42.5 pt -75.71 -25.49 17.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.732 -0.387 . . . . 10.0 111.291 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 680' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 676' ' ' ILE . 27.4 ttm-85 -61.66 -45.51 93.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.989 0.423 . . . . 10.0 110.396 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 681' ' ' GLU . . . . . 0.401 ' HG2' HD22 ' A' ' 740' ' ' LEU . 30.0 mt-10 -68.14 -26.89 66.0 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.644 -0.707 . . . . 10.0 111.0 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -80.45 -48.42 12.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.026 -0.533 . . . . 10.0 111.35 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 79.1 t -59.84 -47.93 89.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.44 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -60.86 -39.72 90.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.17 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -61.71 -48.93 78.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.413 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.84 -39.72 82.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.158 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 10.5 m -64.72 -39.47 93.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.374 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -70.47 -48.02 62.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.621 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 689' ' ' ASP . . . . . 0.4 ' HA ' ' O ' ' A' ' 692' ' ' ILE . 4.5 m-20 -58.36 -29.08 65.7 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.873 -179.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -65.13 -26.97 68.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.806 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -115.81 -17.23 11.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.824 0.345 . . . . 10.0 111.457 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 692' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 689' ' ' ASP . 67.0 mt -128.21 105.53 19.84 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.432 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.16 138.64 52.5 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.46 2.107 . . . . 10.0 111.422 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -51.18 108.69 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 123.056 2.504 . . . . 10.0 113.465 -179.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 59.17 80.78 0.18 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.678 -0.692 . . . . 10.0 111.482 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 3.5 p -137.23 -164.35 1.57 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.434 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 89.9 mt -85.69 146.79 26.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.709 -0.223 . . . . 10.0 110.917 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . 0.446 ' HA ' ' CE3' ' A' ' 701' ' ' TRP . 19.5 tt0 -58.07 -39.11 77.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.434 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.17 -16.93 64.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.957 0.408 . . . . 10.0 111.422 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 24.2 ttt -87.0 -14.47 41.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.229 0.538 . . . . 10.0 110.115 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 701' ' ' TRP . . . . . 0.446 ' CE3' ' HA ' ' A' ' 698' ' ' GLU . 43.8 m0 -84.5 120.22 26.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.617 -0.719 . . . . 10.0 110.28 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -85.9 81.72 8.43 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 703' ' ' ILE . . . . . 0.463 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.9 mm -60.98 -48.82 91.45 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.872 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 704' ' ' PRO . . . . . 0.463 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.9 Cg_exo -54.94 -49.12 17.73 Favored 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 122.091 1.861 . . . . 10.0 112.192 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -63.9 -43.18 97.91 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.89 -0.671 . . . . 10.0 112.223 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.506 ' O ' ' HG ' ' A' ' 710' ' ' LEU . 54.0 tp -63.94 -42.13 97.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.547 0.213 . . . . 10.0 110.847 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 707' ' ' GLN . . . . . 0.479 ' O ' ' HD3' ' A' ' 711' ' ' LYS . 9.3 mt-30 -62.03 -50.73 70.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.759 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.98 -36.17 78.74 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -62.31 -48.23 80.75 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.278 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 710' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 706' ' ' LEU . 88.0 mt -64.33 -34.69 78.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.787 0.327 . . . . 10.0 111.219 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . 0.479 ' HD3' ' O ' ' A' ' 707' ' ' GLN . 8.6 mtpp -74.89 -14.91 60.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.261 -0.427 . . . . 10.0 112.125 -179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -110.15 -45.17 3.63 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.743 0.306 . . . . 10.0 111.618 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -73.06 -41.99 63.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.322 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -109.66 -8.51 14.95 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.988 -0.285 . . . . 10.0 111.7 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 715' ' ' ASP . . . . . 0.464 ' HB2' ' HA ' ' A' ' 828' ' ' LYS . 0.2 OUTLIER 61.64 29.74 18.3 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.098 179.741 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 36.7 tp -117.01 127.73 54.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.861 0.362 . . . . 10.0 110.721 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -90.1 106.38 18.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.39 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 41.7 mt -118.26 119.58 33.09 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.918 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.13 71.38 6.71 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.948 2.432 . . . . 10.0 112.254 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 58.0 mt -64.34 -42.37 95.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.843 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -63.38 -27.88 69.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.963 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -73.69 -47.24 41.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.309 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -66.7 -40.44 88.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.18 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 35.5 tp -58.94 -24.24 62.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.506 -0.77 . . . . 10.0 112.88 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.17 -28.95 13.87 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.814 0.302 . . . . 10.0 111.814 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -86.8 -36.82 18.32 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.178 0.436 . . . . 10.0 112.178 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -120.83 90.07 46.15 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-O 120.739 0.304 . . . . 10.0 110.916 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.31 -14.57 34.48 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.506 2.138 . . . . 10.0 111.663 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.17 -6.59 53.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.388 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 50.0 mt -68.79 -37.56 79.36 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.801 0.334 . . . . 10.0 110.458 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 54.57 -101.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.461 -0.791 . . . . 10.0 111.806 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.84 -55.35 0.77 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.322 . . . . 10.0 111.296 -178.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -56.4 -54.91 40.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.542 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 1.8 m -63.11 -28.61 70.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.996 0.426 . . . . 10.0 110.982 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 5.5 tp -65.24 -43.23 92.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -60.57 -46.92 88.41 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.441 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -58.44 -46.0 87.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.535 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 26.4 mmm-85 -56.92 -41.46 78.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.071 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 96.3 mt -66.9 -47.32 82.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.723 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 740' ' ' LEU . . . . . 0.401 HD22 ' HG2' ' A' ' 681' ' ' GLU . 60.1 tp -62.8 -51.4 67.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.815 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -60.49 -44.19 96.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.739 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -59.82 -35.62 75.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.626 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 20.3 m -69.16 -40.57 78.07 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.454 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 76.3 mt -64.46 -38.59 82.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.312 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.18 -53.79 54.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.756 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 48.5 t -61.45 -37.29 77.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.422 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -60.63 -46.01 91.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.624 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -61.52 -39.84 92.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.847 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -62.1 -37.13 83.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.615 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -70.41 -39.56 74.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.096 0.474 . . . . 10.0 110.1 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 51.2 tt0 -59.89 -37.98 80.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.41 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -61.19 -24.61 66.44 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.888 0.329 . . . . 10.0 111.888 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 34.1 t -88.44 -46.08 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.84 0.352 . . . . 10.0 111.374 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.0 -39.17 50.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.91 0.386 . . . . 10.0 111.327 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.64 138.24 5.14 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.169 -0.772 . . . . 10.0 111.169 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 756' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -58.51 -60.63 3.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.86 0.362 . . . . 10.0 111.811 -178.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -66.71 -34.24 77.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.908 0.385 . . . . 10.0 110.74 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 8.4 tpt -63.68 -42.52 98.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.484 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 59.3 mmm -62.75 -41.72 99.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.331 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.3 mmp_? -58.2 -39.03 77.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.084 0.469 . . . . 10.0 110.3 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.89 -37.11 72.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.175 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -66.7 -48.81 68.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.024 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -58.42 -46.3 86.73 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.155 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 764' ' ' LYS . . . . . 0.472 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 79.2 tttt -59.48 -45.17 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.989 -0.551 . . . . 10.0 110.108 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.53 -43.28 99.25 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.758 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.1 -42.96 97.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.615 0.245 . . . . 10.0 110.416 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 31.3 mtp -61.43 -50.79 71.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.363 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 97.2 mt -61.04 -45.15 95.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.897 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -59.53 -52.18 66.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.025 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 13.5 m -58.6 -45.94 88.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.758 0.313 . . . . 10.0 111.024 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.11 -46.05 90.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.466 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -62.75 -45.67 91.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.094 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 15.7 m -63.44 -44.41 94.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.718 -0.674 . . . . 10.0 111.094 -179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 22.8 mt -65.73 -40.07 91.79 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.841 0.353 . . . . 10.0 110.838 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -59.9 -39.25 84.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.927 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 25.1 mttp -61.39 -48.67 80.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.289 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 12.6 tm-20 -65.87 -44.23 85.99 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -57.32 -33.5 67.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.471 -0.786 . . . . 10.0 111.426 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.6 mt -61.91 -53.67 52.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.745 0.307 . . . . 10.0 110.593 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -66.91 -40.31 87.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.801 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.04 -43.95 91.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.762 -0.654 . . . . 10.0 111.495 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 63.2 mmm -61.38 -49.25 77.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.427 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 783' ' ' ASP . . . . . 0.53 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 10.4 t70 -66.19 -39.11 89.43 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.924 -0.31 . . . . 10.0 111.099 -179.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -61.05 -34.52 75.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.87 0.367 . . . . 10.0 110.92 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.3 tp -79.52 -33.98 41.58 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 178.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -62.68 -40.77 98.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.921 -1.036 . . . . 10.0 110.999 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 787' ' ' GLN . . . . . 0.53 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 10.7 pt20 . . . . . 0 C--N 1.325 -0.482 0 CA-C-O 121.148 0.499 . . . . 10.0 110.474 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo . . . . . 0 C--O 1.233 0.266 0 CA-C-O 120.937 0.307 . . . . 10.0 112.074 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.76 154.56 33.91 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 74.87 -52.58 0.67 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.945 0.498 . . . . 10.0 109.786 -178.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -62.03 -51.37 68.27 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.157 -0.474 . . . . 10.0 109.955 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -62.31 -31.41 72.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.378 0.608 . . . . 10.0 109.972 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -67.4 -32.69 73.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.72 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 38.2 mtm105 -57.3 -47.52 81.28 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.251 0.548 . . . . 10.0 109.734 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.48 -43.69 76.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.389 -0.823 . . . . 10.0 110.756 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 17.2 m -60.29 -44.19 95.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.737 -0.665 . . . . 10.0 112.01 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -69.27 -43.17 74.45 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.159 -0.216 . . . . 10.0 110.89 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 19.4 m -61.73 -39.06 90.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.946 0.403 . . . . 10.0 110.261 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 37.4 ttm -64.01 -40.38 96.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.168 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -68.02 -40.35 82.95 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.387 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.19 91.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.369 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -63.03 -36.12 82.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.368 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 12.8 ttt -62.9 -45.47 92.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.446 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.9 -42.43 97.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.541 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -63.84 -37.39 87.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.432 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 37.4 m -72.3 -30.7 65.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.617 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 24.6 tp -56.97 -57.61 11.76 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.99 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 40.9 pttt -65.26 -32.48 74.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.959 0.409 . . . . 10.0 110.513 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -61.82 -58.4 8.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.934 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -62.9 -36.62 83.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.852 -178.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 39.9 t -61.58 -54.62 32.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 120.643 0.259 . . . . 10.0 110.655 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 41.1 mm -63.42 -38.99 83.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.698 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 40.7 t -60.23 -50.69 72.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.738 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 28.5 m -59.43 -45.76 90.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.703 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 92.8 mt -62.32 -24.86 67.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 10.0 112.047 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 6.6 m -94.59 -37.86 11.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.687 0.279 . . . . 10.0 111.403 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 828' ' ' LYS . . . . . 0.464 ' HA ' ' HB2' ' A' ' 715' ' ' ASP . 29.4 mtpp -69.29 -25.42 64.24 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.536 0.569 . . . . 10.0 112.536 -178.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.08 115.34 9.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.43 0.634 . . . . 10.0 110.404 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -100.97 140.15 35.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.898 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 C--N 1.324 -0.523 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.081 -179.804 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.6 t80 . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 120.892 0.377 . . . . 10.0 110.728 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 142.43 163.26 9.6 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.804 -0.713 . . . . 10.0 112.157 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.94 160.57 9.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.795 0.331 . . . . 10.0 110.692 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.558 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 3.9 mmp_? -77.05 146.52 37.26 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 60.63 -89.88 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.93 -1.032 . . . . 10.0 113.685 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -46.22 -62.9 1.14 Allowed 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.905 1.076 . . . . 10.0 113.905 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -66.17 -31.67 72.66 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -178.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.406 ' O ' ' HG3' ' A' ' 21' ' ' MET . 0.2 OUTLIER -66.46 -48.77 68.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.726 0.298 . . . . 10.0 110.899 -179.835 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.92 -36.18 78.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.364 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -47.01 87.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.86 0.362 . . . . 10.0 110.375 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 20' ' ' ARG . 2.6 ttp85 -67.21 -33.85 76.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.095 0.474 . . . . 10.0 110.354 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.676 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 62.1 mtt -69.86 -37.4 76.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.334 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.7 tpp180 -62.07 -33.73 74.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.111 -0.495 . . . . 10.0 109.996 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -63.21 -41.14 99.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.766 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.6 t -68.2 -36.65 76.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.659 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -60.24 -37.59 74.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.078 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -62.55 -38.92 91.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.581 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.9 mt -68.12 -42.54 85.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.938 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 79.1 mt -60.78 -39.55 82.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.288 0.565 . . . . 10.0 109.843 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -67.86 -21.97 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.819 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -86.45 -23.1 26.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.58 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.9 mmt -84.77 -23.01 29.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.616 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.596 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 16.3 tt0 -55.84 -52.11 75.0 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 112.423 0.527 . . . . 10.0 112.423 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.473 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 75.8 Cg_exo -52.23 -37.41 70.24 Favored 'Trans proline' 0 C--N 1.361 1.195 0 C-N-CA 121.957 1.771 . . . . 10.0 112.399 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -72.32 -39.06 68.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.393 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 22.7 mmt -65.42 -39.29 91.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.593 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 28.7 mt-10 -63.92 -25.22 68.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.257 0.551 . . . . 10.0 110.06 178.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -82.33 -30.68 30.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.078 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.3 mp -73.25 148.42 43.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.474 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.6 p -75.45 167.42 21.93 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.387 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.9 -37.51 87.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.53 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -68.92 -32.52 72.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.511 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -66.37 -33.72 76.35 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.508 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.32 -46.12 88.15 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.7 ttpt -61.92 -34.13 75.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.08 -0.964 . . . . 10.0 109.481 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.06 -34.37 86.47 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.684 -0.689 . . . . 10.0 111.421 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -66.54 -36.2 82.09 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.024 -0.362 . . . . 10.0 110.024 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.7 m -61.7 -45.68 92.93 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.158 0.504 . . . . 10.0 109.647 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.11 -33.41 75.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.775 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -60.7 -47.7 85.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.292 -0.867 . . . . 10.0 110.284 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -61.42 -41.12 96.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.976 0.417 . . . . 10.0 109.979 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -59.06 -40.27 84.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.529 -0.759 . . . . 10.0 110.402 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -77.59 -36.47 51.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.368 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.409 HH12 ' CD ' ' A' ' 66' ' ' GLU . 63.2 mtp180 -64.68 -31.19 72.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.519 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.1 mt -60.4 -31.99 70.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.844 0.354 . . . . 10.0 110.8 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.5 -28.43 66.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.502 . . . . 10.0 110.479 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -76.23 -14.53 60.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.658 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 110.32 22.36 6.51 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.805 -0.712 . . . . 10.0 112.287 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -73.22 144.43 46.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.785 0.326 . . . . 10.0 110.153 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.0 t -86.86 136.72 22.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.164 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.9 tp -62.34 -39.64 93.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.108 0.48 . . . . 10.0 110.1 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -69.87 -16.48 63.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.21 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -90.9 -15.3 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.403 0.62 . . . . 10.0 110.259 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.0 mt -86.42 -11.98 50.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.104 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.484 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 85.0 mt -50.38 -51.89 59.72 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 113.459 0.911 . . . . 10.0 113.459 -178.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.484 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 52.2 Cg_exo -53.12 -35.89 74.62 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 122.164 1.91 . . . . 10.0 113.488 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.409 ' CD ' HH12 ' A' ' 53' ' ' ARG . 44.5 mt-10 -89.74 -45.45 9.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.724 0.297 . . . . 10.0 111.507 -179.027 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.1 -47.88 84.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.232 -0.44 . . . . 10.0 112.142 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -64.12 -30.67 71.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.721 0.296 . . . . 10.0 110.67 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.13 -43.95 81.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 10.0 109.965 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 47.5 t -61.33 -43.58 96.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.827 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.01 -46.19 97.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.318 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.423 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 11.6 ttm180 -60.64 -41.54 95.14 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.18 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.478 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 18.9 tp10 -63.95 -50.87 66.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.575 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.49 -33.33 71.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.035 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 46.3 m -59.32 -42.82 92.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.282 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.478 ' HE2' ' HA ' ' A' ' 73' ' ' GLU . 40.1 mtmt -73.19 -16.98 61.41 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.299 0.481 . . . . 10.0 112.299 -178.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 -100.13 -37.13 9.08 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.993 -0.283 . . . . 10.0 111.636 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 85.5 t -82.96 -51.45 14.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 120.785 0.326 . . . . 10.0 111.796 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -99.71 -38.31 8.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.928 0.394 . . . . 10.0 111.206 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.39 4.43 49.95 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.94 -0.648 . . . . 10.0 111.517 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 63.9 mtt -111.26 138.13 48.11 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -90.48 135.32 33.77 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.857 0.36 . . . . 10.0 110.673 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.68 112.15 4.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.854 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -59.14 152.83 19.47 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.25 0.547 . . . . 10.0 111.778 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -61.82 -36.55 81.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.286 -0.87 . . . . 10.0 111.644 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.6 m -64.67 -31.62 54.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.06 0.457 . . . . 10.0 110.894 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -73.21 -27.9 61.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.281 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 97.7 mt -66.28 -33.88 76.73 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.718 -0.475 . . . . 10.0 109.718 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.91 -50.07 67.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.471 178.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -62.56 -32.5 83.48 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.317 -0.856 . . . . 10.0 112.066 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -60.21 -36.4 90.62 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 121.06 -0.591 . . . . 10.0 112.196 179.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.676 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 25.0 ttm -74.9 -36.15 62.23 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.4 t -64.41 -41.74 93.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.152 0.501 . . . . 10.0 109.958 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 91.4 mt -73.95 -4.43 35.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.672 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -91.43 -21.36 21.0 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.242 0.544 . . . . 10.0 109.948 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -105.47 -174.26 2.49 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.827 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -83.56 67.59 9.46 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.135 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 74.2 m -149.2 166.86 27.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.138 0.494 . . . . 10.0 111.731 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 35.8 mm -113.26 135.5 52.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.173 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -110.3 124.8 52.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.923 0.392 . . . . 10.0 111.824 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.31 129.26 36.56 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.45 ' SD ' ' HA ' ' A' ' 108' ' ' LYS . 2.9 ttt -136.12 135.98 39.73 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.895 0.378 . . . . 10.0 111.082 -179.134 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.42 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 13.6 mmm180 -67.96 152.37 45.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.088 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.68 96.33 1.58 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.762 -0.653 . . . . 10.0 111.509 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 138.88 -15.5 3.31 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.382 -0.913 . . . . 10.0 113.537 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -84.23 27.22 0.7 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.978 0.362 . . . . 10.0 111.978 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.71 56.06 16.79 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.561 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.45 ' HA ' ' SD ' ' A' ' 102' ' ' MET . 50.6 tttm -55.38 -50.83 68.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.853 0.358 . . . . 10.0 111.745 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -24.65 63.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.947 0.403 . . . . 10.0 111.829 -179.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 21.2 tp -72.52 -31.64 65.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.867 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 19.0 m -71.41 -28.56 64.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.851 0.358 . . . . 10.0 111.7 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.81 66.13 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.771 1.026 . . . . 10.0 113.771 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 17.0 p -75.46 -22.39 57.32 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.319 0.489 . . . . 10.0 112.319 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 48.4 mt -68.26 -57.68 8.59 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 112.338 0.496 . . . . 10.0 112.338 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -64.63 -28.39 60.85 Favored 'Trans proline' 0 C--N 1.356 0.965 0 C-N-CA 122.055 1.837 . . . . 10.0 112.032 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.34 -49.26 67.54 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.458 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -62.43 -45.88 91.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.896 0.379 . . . . 10.0 110.685 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 25.8 tp -59.45 -50.27 74.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.788 -0.642 . . . . 10.0 111.842 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -75.71 -19.13 59.3 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.897 0.332 . . . . 10.0 111.897 -178.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.7 -26.73 65.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.889 0.376 . . . . 10.0 110.942 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 47.6 mt -61.2 -23.02 65.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.561 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.2 p -69.74 -24.22 63.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.869 0.366 . . . . 10.0 110.831 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.35 9.7 81.49 Favored Glycine 0 C--N 1.333 0.389 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.656 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -86.59 -11.78 50.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.702 0.287 . . . . 10.0 111.525 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.08 110.84 2.6 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.5 -0.857 . . . . 10.0 113.834 178.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 62.1 t -84.59 114.56 25.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -93.11 104.07 16.3 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.943 0.402 . . . . 10.0 111.034 -178.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 39.2 t -93.48 123.9 45.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.204 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 96.3 t -105.2 121.92 57.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.993 -179.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 2.7 p -108.83 165.36 11.62 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.459 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 15.5 m -75.9 -29.83 20.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.85 0.357 . . . . 10.0 111.529 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -145.04 168.54 20.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.405 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.08 -23.09 63.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.166 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -58.73 -52.5 65.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.569 -0.741 . . . . 10.0 110.646 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 30.5 mt -69.47 -35.68 75.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.716 0.293 . . . . 10.0 110.461 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.43 -50.89 71.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.05 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.29 -36.41 61.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.018 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.438 HH21 ' CG ' ' A' ' 139' ' ' ASP . 5.9 ttp85 -56.33 -58.88 6.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.523 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . 0.438 ' CG ' HH21 ' A' ' 138' ' ' ARG . 1.5 m-20 -69.36 -31.97 70.73 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.08 -0.509 . . . . 10.0 112.019 -178.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.488 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -60.87 -37.89 83.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.762 0.315 . . . . 10.0 111.214 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.2 mm-40 -91.59 -28.86 17.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.486 -0.325 . . . . 10.0 111.487 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -74.59 -43.86 53.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.827 0.346 . . . . 10.0 111.383 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 40.3 m-20 -88.41 -0.89 57.68 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.072 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.488 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 53.3 ttm-85 -61.69 -49.93 84.26 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.591 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' PRO . . . . . 0.464 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 17.2 Cg_exo -68.86 5.02 1.51 Allowed 'Trans proline' 0 C--N 1.361 1.218 0 C-N-CA 122.353 2.035 . . . . 10.0 112.504 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.6 tp -105.93 -52.45 2.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.726 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -73.86 -46.48 44.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.499 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.423 ' HA ' ' O ' ' A' ' 152' ' ' LEU . 82.3 mt-10 -68.91 -19.65 64.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.883 0.373 . . . . 10.0 111.047 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -73.39 -24.24 60.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.302 0.573 . . . . 10.0 109.556 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 71.4 mt -96.56 -11.18 25.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.938 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 114.99 -6.63 21.83 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.509 -0.853 . . . . 10.0 113.592 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . 0.423 ' O ' ' HA ' ' A' ' 148' ' ' GLU . 92.4 mt -80.89 144.95 31.58 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.167 0.484 . . . . 10.0 110.733 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.1 p -95.39 133.15 39.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.508 -0.315 . . . . 10.0 111.108 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 35.2 t -108.97 130.73 61.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.441 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -124.98 145.53 15.74 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 111.665 -0.574 . . . . 10.0 111.665 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 4.2 tp -119.08 129.16 75.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.962 0.41 . . . . 10.0 110.511 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -114.26 112.67 23.48 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.162 -0.472 . . . . 10.0 109.999 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 49.3 mt -109.46 148.98 39.19 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.384 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' PRO . . . . . 0.437 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 19.0 Cg_endo -58.3 121.24 9.65 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.753 2.302 . . . . 10.0 112.539 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.2 6.74 62.79 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.928 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' MET . . . . . 0.439 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 44.2 ttm -67.31 139.07 94.56 Favored Pre-proline 0 C--N 1.325 -0.473 0 C-N-CA 122.049 0.14 . . . . 10.0 110.96 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -52.69 147.32 31.65 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.885 2.39 . . . . 10.0 112.367 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . 0.436 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -54.47 -48.75 94.04 Favored Pre-proline 0 CA--C 1.54 0.563 0 N-CA-C 112.785 0.661 . . . . 10.0 112.785 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.436 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.8 Cg_exo -57.65 -42.33 61.36 Favored 'Trans proline' 0 C--N 1.358 1.062 0 C-N-CA 121.946 1.764 . . . . 10.0 112.346 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -64.96 -41.7 95.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.836 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.445 ' HZ1' ' CG ' ' A' ' 185' ' ' ASP . 60.8 mttm -58.91 -43.5 91.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.137 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -58.13 -40.61 81.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.932 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -68.48 -40.65 80.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.682 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -65.86 -43.01 89.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.351 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' TYR . . . . . 0.433 ' HD2' ' O ' ' A' ' 166' ' ' LYS . 42.1 m-85 -74.34 -22.79 59.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.998 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.19 -14.37 59.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.654 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -71.58 173.14 8.43 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.305 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -74.72 -39.43 61.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.286 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.0 mp -127.61 121.35 56.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.883 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 6.4 m -112.36 111.98 23.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.847 0.356 . . . . 10.0 111.359 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -91.34 133.34 35.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.101 -0.5 . . . . 10.0 109.692 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -167.72 179.55 41.03 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.347 -0.93 . . . . 10.0 112.838 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.09 152.16 21.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.541 0.21 . . . . 10.0 110.549 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -60.47 -41.38 94.07 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.953 0.353 . . . . 10.0 111.953 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -56.46 -50.95 70.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.709 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . 0.437 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 3.8 tp10 -70.71 -38.49 73.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.91 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -56.81 -39.44 74.17 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.861 0.363 . . . . 10.0 111.152 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -70.72 -44.33 57.18 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.821 -0.704 . . . . 10.0 112.242 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -67.17 -35.28 79.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.915 0.388 . . . . 10.0 110.738 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 185' ' ' ASP . . . . . 0.445 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 6.8 m-20 -59.16 -44.62 92.14 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.689 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -62.85 -38.22 89.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.466 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 54.2 mt -62.65 -47.19 84.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.514 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 188' ' ' ARG . 42.4 mtm-85 -67.27 -40.7 86.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 10.0 110.491 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.11 -49.12 78.88 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.395 -0.821 . . . . 10.0 111.608 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.66 -3.6 47.98 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.784 -0.644 . . . . 10.0 112.656 -178.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 23.0 ttp -104.21 4.0 33.44 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.879 0.371 . . . . 10.0 110.966 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -69.72 174.01 5.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.82 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -109.34 -21.59 12.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.053 0.454 . . . . 10.0 110.601 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.05 142.33 45.2 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.871 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 195' ' ' PRO . . . . . 0.407 ' HD3' ' O ' ' A' ' 667' ' ' LEU . 13.2 Cg_endo -57.72 -30.18 88.19 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.811 2.341 . . . . 10.0 112.721 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -69.91 -17.5 63.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.963 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -83.14 -13.03 56.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.302 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -56.09 157.74 4.43 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.382 0.426 . . . . 10.0 111.426 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 8.2 m -128.57 -25.26 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.228 -0.442 . . . . 10.0 112.007 -179.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -92.77 -178.2 4.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.065 0.459 . . . . 10.0 111.361 -179.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -134.03 -178.2 4.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.765 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 17.4 ttmm -57.32 131.8 51.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.274 0.559 . . . . 10.0 111.593 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 12.5 mt -82.65 74.57 9.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.158 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -84.33 -63.45 1.34 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.94 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -128.3 137.28 51.88 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.065 0.459 . . . . 10.0 111.731 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.45 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . . . -129.71 127.59 40.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.364 -0.835 . . . . 10.0 109.984 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 61.8 tp -119.79 108.9 14.96 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.08 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.3 p -98.75 131.26 46.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 CA-C-O 121.048 0.452 . . . . 10.0 110.776 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -59.05 -66.21 0.54 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.614 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 210' ' ' GLU . . . . . 0.506 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 34.3 tt0 -112.3 111.05 21.64 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.833 0.349 . . . . 10.0 110.577 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . 0.421 ' O ' ' HB2' ' A' ' 215' ' ' LEU . 34.3 m -82.34 -18.59 10.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.844 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 212' ' ' ASP . . . . . 0.408 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.0 OUTLIER -51.82 -57.49 9.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.173 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 4.9 p -88.61 -59.17 2.3 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.965 -0.561 . . . . 10.0 112.051 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 69.2 mt -52.73 -38.31 27.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 113.913 1.079 . . . . 10.0 113.913 -177.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 215' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 211' ' ' VAL . 8.0 mt -96.47 -53.79 3.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.933 0.716 . . . . 10.0 112.933 -178.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 216' ' ' ILE . . . . . 0.408 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 46.7 mm -75.91 -57.15 6.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 113.064 0.764 . . . . 10.0 113.064 -177.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -64.22 -42.7 96.48 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.035 0.383 . . . . 10.0 112.035 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -90.09 16.65 8.04 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 -178.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.88 -38.69 91.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.883 0.373 . . . . 10.0 111.071 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -106.13 31.68 4.95 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.308 -0.406 . . . . 10.0 111.488 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 33.9 m -105.12 102.99 39.56 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 222' ' ' PRO . . . . . 0.405 ' HA ' ' HA ' ' A' ' 376' ' ' THR . 72.5 Cg_endo -94.95 129.38 0.48 Allowed 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.095 2.53 . . . . 10.0 113.473 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 223' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' A' ' 374' ' ' SER . 86.9 mt -82.91 110.87 18.27 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 77.0 mt -108.33 125.95 65.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 65.8 mt . . . . . 0 C--N 1.326 -0.434 0 N-CA-C 108.578 -0.897 . . . . 10.0 108.578 177.602 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.186 0 N-CA-C 110.638 -0.134 . . . . 10.0 110.638 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 374' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 41.6 m -155.13 135.59 13.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.495 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 18.9 tt -149.73 136.8 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.165 0.507 . . . . 10.0 110.62 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 376' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 222' ' ' PRO . 0.2 OUTLIER -90.64 143.73 26.45 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.855 -0.612 . . . . 10.0 109.715 179.204 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -55.5 -48.42 74.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.835 0.35 . . . . 10.0 110.522 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -57.59 -40.24 78.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.643 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 62.7 m-20 -73.99 -14.94 61.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.981 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -88.63 -42.53 11.96 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.319 -0.622 . . . . 10.0 109.319 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -70.05 -18.41 63.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.769 -0.651 . . . . 10.0 110.7 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -74.3 -11.39 60.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.407 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 43.1 mt -93.49 0.44 56.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.564 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . 0.45 ' CD2' ' HB3' ' A' ' 206' ' ' ALA . 26.1 m-85 -94.52 142.33 27.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.591 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -75.1 -61.51 1.87 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.196 0.522 . . . . 10.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -102.34 107.68 18.78 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 44.8 tp -120.72 120.02 34.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.971 -0.558 . . . . 10.0 109.911 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -143.04 166.49 24.49 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.524 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.89 173.92 46.06 Favored Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.083 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 13.6 mtm -110.93 146.88 35.8 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.707 0.289 . . . . 10.0 110.232 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 6.7 t -126.63 160.13 31.59 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -84.7 163.11 38.25 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.489 -0.863 . . . . 10.0 111.985 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 393' ' ' THR . . . . . 0.42 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 3.2 m -71.08 73.1 0.62 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.196 0.522 . . . . 10.0 110.482 179.214 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -135.44 -30.54 1.01 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.778 -0.646 . . . . 10.0 111.8 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 19.9 t70 61.51 -114.55 0.56 Allowed 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 14.0 m 65.52 -86.39 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.898 0.703 . . . . 10.0 112.898 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -84.03 30.51 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 10.0 111.456 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -58.13 -45.6 87.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.456 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -65.61 -23.15 66.76 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.628 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -75.86 -29.3 58.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.633 0.254 . . . . 10.0 110.443 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -60.02 -42.52 94.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.994 0.426 . . . . 10.0 110.524 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.4 m -81.84 -5.76 58.49 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.963 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 17.8 m -106.14 -40.85 5.52 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.855 -0.338 . . . . 10.0 111.795 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 53.9 mt -85.99 -46.31 16.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.554 -0.293 . . . . 10.0 111.593 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -108.51 -6.11 16.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.625 0.25 . . . . 10.0 111.316 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 58.96 44.76 15.98 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.017 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 36.1 mt -112.02 138.13 49.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.776 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 408' ' ' ASP . . . . . 0.558 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 28.7 t0 -82.47 142.62 31.75 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.729 -0.471 . . . . 10.0 109.729 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 1.8 m -100.79 106.31 17.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.931 0.396 . . . . 10.0 111.487 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 83.9 t -107.05 132.81 53.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.205 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 60.2 t -96.76 126.55 49.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.52 -0.309 . . . . 10.0 110.398 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 44.8 t -95.73 131.56 29.06 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.548 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -65.17 154.42 73.56 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.645 2.23 . . . . 10.0 112.757 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.5 p -79.91 168.68 18.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.034 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -78.9 -33.41 45.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.436 0.636 . . . . 10.0 109.407 179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -124.22 151.07 65.39 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.401 -0.818 . . . . 10.0 109.557 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.68 110.4 1.44 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.502 2.135 . . . . 10.0 111.999 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 58.8 ttp -72.92 102.52 3.47 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.112 0.482 . . . . 10.0 110.545 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.8 pt -96.14 60.72 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.238 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 -86.25 128.53 34.92 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -93.81 97.97 10.77 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.832 0.348 . . . . 10.0 111.136 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -90.14 122.19 32.88 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.068 -0.715 . . . . 10.0 109.068 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 22.4 mt -104.65 150.78 38.95 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.734 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.98 141.77 98.65 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.945 2.43 . . . . 10.0 112.56 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -60.26 131.91 52.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.976 -0.557 . . . . 10.0 110.907 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.27 106.4 17.59 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.951 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 72.8 t -103.93 123.19 57.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.834 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 428' ' ' TYR . . . . . 0.406 ' HB3' ' HB2' ' A' ' 433' ' ' GLU . 2.5 m-85 -105.91 -175.18 2.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.625 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.54 -77.42 0.25 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.438 -0.505 . . . . 10.0 110.27 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 76.0 p -83.77 156.39 22.56 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.2 -0.296 . . . . 10.0 110.2 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -62.93 -27.07 69.13 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.024 -0.361 . . . . 10.0 110.024 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.12 -45.15 87.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.796 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 433' ' ' GLU . . . . . 0.406 ' HB2' ' HB3' ' A' ' 428' ' ' TYR . 18.8 mt-10 -65.73 -42.22 91.31 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.492 178.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -57.82 -51.59 68.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.803 -1.09 . . . . 10.0 111.344 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 45.7 mm -67.87 -38.46 80.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.682 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.82 -39.59 92.31 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.813 0.34 . . . . 10.0 110.459 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -61.57 -38.11 86.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.24 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 84.4 mt -63.37 -44.46 99.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.648 178.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.99 -43.77 96.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.262 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -60.48 -43.04 97.37 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.44 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . 0.614 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 30.2 t70 -66.47 -42.93 86.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.108 179.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 75.3 mt -61.14 -39.36 82.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.451 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -59.07 -39.98 83.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.999 0.428 . . . . 10.0 110.44 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.25 -39.69 82.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.221 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.614 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 10.7 mmt180 -66.91 -46.73 73.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.246 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -36.41 82.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.883 0.373 . . . . 10.0 110.597 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.39 -32.9 74.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.33 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -89.89 -5.51 56.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.179 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 77.98 29.17 54.99 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.821 -0.704 . . . . 10.0 111.719 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 450' ' ' GLN . . . . . 0.528 ' OE1' ' HD2' ' A' ' 445' ' ' ARG . 62.4 tt0 -99.38 126.96 35.84 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-O 120.401 0.143 . . . . 10.0 111.015 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.15 142.62 56.42 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 122.592 2.195 . . . . 10.0 111.307 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 52.3 t -119.86 131.45 72.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.569 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 43.3 tp -120.18 104.25 9.93 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.396 -0.594 . . . . 10.0 109.396 178.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 32.2 t -90.23 124.07 42.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.789 -0.642 . . . . 10.0 110.256 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -104.37 81.58 0.34 Allowed Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.799 -0.715 . . . . 10.0 111.977 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.13 104.82 13.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.886 0.374 . . . . 10.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 33.9 pt -72.41 -21.52 20.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.194 0.521 . . . . 10.0 110.166 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 458' ' ' SER . . . . . 0.452 ' HB2' ' HB2' ' A' ' 461' ' ' LYS . 1.1 m -99.27 118.98 37.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.483 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 57.2 mt -59.09 -41.35 83.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.945 0.402 . . . . 10.0 111.865 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 27.6 mp0 -63.93 -24.63 67.8 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.186 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . 0.452 ' HB2' ' HB2' ' A' ' 458' ' ' SER . 0.1 OUTLIER -77.69 -31.42 52.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.426 -0.352 . . . . 10.0 110.607 -179.488 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 49.1 m -60.49 -38.91 85.82 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.126 0.488 . . . . 10.0 109.939 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.46 -42.98 82.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.342 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 55.1 tp -64.13 -52.1 60.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.663 -0.698 . . . . 10.0 111.498 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.0 -30.34 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 120.672 0.272 . . . . 10.0 111.013 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 9.1 t -66.75 -40.97 88.48 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.36 -47.02 83.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.121 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -60.97 -40.49 93.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.141 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 17.0 mt -65.92 -35.81 81.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.951 0.405 . . . . 10.0 110.586 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.0 m -75.04 -33.83 61.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.091 0.472 . . . . 10.0 109.803 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -64.4 -41.17 96.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.111 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -75.86 -31.51 59.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.306 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 94.82 41.38 4.12 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.014 -0.613 . . . . 10.0 112.497 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 35.1 mt -110.53 137.81 41.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 CA-C-O 120.664 0.269 . . . . 10.0 110.999 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -61.57 134.98 57.46 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.477 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -163.68 156.47 18.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.78 0.324 . . . . 10.0 111.177 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -140.33 133.36 29.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.1 t -105.0 133.69 48.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.857 0.36 . . . . 10.0 111.426 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . 0.421 ' HB3' ' OE2' ' A' ' 487' ' ' GLU . 80.0 mt -84.93 138.83 32.26 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -144.34 135.94 25.79 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.293 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -59.2 -24.32 63.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 10.0 112.018 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -78.7 -9.27 59.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.605 0.24 . . . . 10.0 110.963 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' PHE . . . . . 0.48 ' O ' ' HG3' ' A' ' 487' ' ' GLU . 59.2 m-85 -131.79 49.95 2.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.992 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' HIS . . . . . 0.438 ' HA ' ' OE1' ' A' ' 487' ' ' GLU . 3.3 m80 -57.46 -33.64 68.16 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.912 0.387 . . . . 10.0 111.26 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.92 -33.57 76.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.103 0.478 . . . . 10.0 110.468 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -77.83 -36.68 49.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.647 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 483' ' ' PHE . 49.4 mt-10 -59.29 -39.01 81.64 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.661 -0.7 . . . . 10.0 110.523 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -59.61 -27.13 66.05 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.297 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -88.51 -38.24 15.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.861 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.87 -48.09 72.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.393 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 81.3 t -60.63 -30.95 47.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.828 0.347 . . . . 10.0 111.062 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -61.83 -28.37 69.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.312 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -120.36 21.58 11.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.824 0.345 . . . . 10.0 110.846 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -67.71 -20.03 65.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.996 0.427 . . . . 10.0 110.911 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -98.01 11.97 64.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.876 -0.678 . . . . 10.0 112.068 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -73.39 140.13 79.03 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 110.088 -0.338 . . . . 10.0 110.088 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -52.3 123.16 12.04 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.701 2.267 . . . . 10.0 113.047 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 73.68 15.99 3.94 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 123.948 0.78 . . . . 10.0 112.921 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -91.56 119.88 31.88 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.567 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 40.2 t -100.15 107.99 22.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.067 0.461 . . . . 10.0 110.374 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 8.0 m -107.39 129.84 54.87 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.528 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 61.1 mt -109.54 114.18 46.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.219 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -97.37 114.93 26.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.817 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 16.0 m -86.48 112.45 21.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.203 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 65.8 t30 58.75 77.18 0.31 Allowed 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.667 0.604 . . . . 10.0 111.204 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.35 141.11 55.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.942 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -91.66 -171.09 2.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.404 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -75.73 153.8 44.5 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.695 -0.764 . . . . 10.0 112.475 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.506 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 59.2 mtt180 66.6 -80.83 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.293 0.637 . . . . 10.0 112.104 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.57 144.76 13.65 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.114 -0.565 . . . . 10.0 111.928 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.03 154.13 41.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.63 0.252 . . . . 10.0 111.206 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -75.71 120.58 21.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.883 0.373 . . . . 10.0 110.961 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 93.4 mt -99.58 108.76 23.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.788 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 6.8 t -78.79 131.07 35.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.92 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 48.9 mt -65.85 127.38 31.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.321 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 95.97 -9.44 68.05 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.084 -0.579 . . . . 10.0 111.672 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 113.72 -176.67 17.39 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.864 -0.894 . . . . 10.0 110.864 -179.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 5.3 p -121.75 93.37 3.98 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.147 0.498 . . . . 10.0 110.642 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 17.9 p-90 -60.35 -27.04 67.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.443 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -62.5 -36.37 82.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.226 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.36 -35.15 35.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.061 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 522' ' ' GLU . . . . . 0.407 ' O ' ' HG ' ' A' ' 526' ' ' LEU . 47.8 mt-10 -62.62 -44.96 94.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.822 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 28.1 m -71.65 -25.95 25.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-O 120.994 0.426 . . . . 10.0 110.809 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -73.7 -25.51 60.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.151 0.5 . . . . 10.0 110.171 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -87.18 -0.83 57.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.491 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 522' ' ' GLU . 88.4 mt -84.24 148.57 26.64 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.886 0.374 . . . . 10.0 111.21 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -69.3 -39.92 77.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.9 -0.591 . . . . 10.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -152.85 88.66 3.85 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.21 104.11 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.057 2.504 . . . . 10.0 112.359 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.17 148.71 29.43 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.722 -0.672 . . . . 10.0 109.875 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -52.41 -50.85 61.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.951 0.405 . . . . 10.0 111.669 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 51.0 mp0 -64.69 -31.87 73.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.629 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -68.99 -44.09 73.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.029 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 79.1 mt -61.59 -42.72 95.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.183 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -61.21 -42.06 97.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.378 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -63.57 -47.33 81.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.552 . . . . 10.0 110.167 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 61.2 mt -63.95 -37.51 79.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.254 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -61.78 -43.29 99.15 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -68.63 -43.43 76.37 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.449 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.67 -47.18 86.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.582 -0.736 . . . . 10.0 109.868 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 61.3 t90 -63.83 -39.5 94.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.335 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -54.04 -48.46 70.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.579 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 39.0 t -61.85 -43.88 98.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.607 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -65.72 -44.11 87.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.95 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -58.94 -50.86 72.47 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.373 -0.83 . . . . 10.0 111.167 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.49 -24.02 63.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.347 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -67.48 -36.82 81.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.273 0.559 . . . . 10.0 109.716 178.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.16 -32.06 55.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.549 -0.75 . . . . 10.0 110.008 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 84.3 mt -64.33 -39.95 94.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.188 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -69.97 -36.26 75.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.918 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -64.94 -49.16 71.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.465 -0.789 . . . . 10.0 110.793 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 141.42 23.43 0.24 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.399 -0.905 . . . . 10.0 113.609 179.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 74.47 -166.78 54.81 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.502 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 30.5 tp -75.44 125.84 29.81 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.17 -0.307 . . . . 10.0 110.17 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -98.53 110.61 23.18 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.391 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 27.4 mm -90.24 133.89 30.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.818 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 14.0 mt -124.82 121.34 60.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.264 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -107.42 134.29 12.12 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.834 -0.698 . . . . 10.0 111.496 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 17.3 p -92.57 -57.32 2.71 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.112 0.482 . . . . 10.0 111.362 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -114.31 133.05 55.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.438 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -77.36 134.62 38.42 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -78.26 139.4 38.89 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.201 -0.296 . . . . 10.0 110.201 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -57.14 -48.09 79.52 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 564' ' ' SER . . . . . 0.441 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.3 OUTLIER -77.53 114.94 16.88 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.186 178.121 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -65.8 -24.08 66.84 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.535 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -61.42 -48.86 79.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.961 0.41 . . . . 10.0 110.463 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 69.0 mt -75.83 -34.83 28.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.118 0.485 . . . . 10.0 110.205 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -63.31 -41.1 98.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.35 -0.841 . . . . 10.0 110.621 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -75.59 -35.27 60.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.831 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -62.68 -27.42 69.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.909 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 20.4 tp -71.35 -28.59 64.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.1 0.476 . . . . 10.0 110.218 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -81.25 -30.43 34.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.248 0.547 . . . . 10.0 109.905 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.34 7.41 17.88 Favored Glycine 0 CA--C 1.52 0.382 0 CA-C-N 115.627 -0.715 . . . . 10.0 113.446 -179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -74.16 -30.59 62.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.988 0.394 . . . . 10.0 109.989 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 2.4 t -93.65 162.96 13.73 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.191 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 66.46 51.98 38.64 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.869 -0.681 . . . . 10.0 112.161 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -88.71 146.24 25.17 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.266 -0.272 . . . . 10.0 110.266 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 60.61 20.51 10.4 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 123.544 0.528 . . . . 10.0 110.438 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 75.5 40.4 32.79 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.995 -0.548 . . . . 10.0 112.641 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.33 -163.72 1.01 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.73 0.265 . . . . 10.0 110.963 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -92.33 177.32 6.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.266 0.555 . . . . 10.0 111.981 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 153.42 173.51 22.71 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.583 -0.735 . . . . 10.0 111.664 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 2.6 p -146.96 148.45 31.76 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.005 -0.369 . . . . 10.0 110.005 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.6 137.42 31.89 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.621 0.248 . . . . 10.0 111.137 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -158.91 147.88 18.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.735 178.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -115.19 147.62 40.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.266 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -130.02 111.62 12.68 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 4.9 mp -122.18 179.39 4.56 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.115 0.483 . . . . 10.0 111.594 -178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 51.9 p -132.3 179.91 5.83 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.059 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 71.4 mmm -83.46 -8.32 59.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.857 0.361 . . . . 10.0 111.151 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.12 9.74 40.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.196 0.522 . . . . 10.0 110.062 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.67 149.2 38.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.659 -0.7 . . . . 10.0 110.533 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -59.94 -28.17 67.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.164 -0.471 . . . . 10.0 111.603 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 7.2 tp -63.8 -26.41 68.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.415 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 22.4 mmt -77.44 -2.74 36.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.875 0.369 . . . . 10.0 111.286 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -101.92 -1.51 31.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.231 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 16.6 pt -94.36 4.6 8.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.965 0.412 . . . . 10.0 110.807 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -86.17 19.76 2.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.953 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.44 -59.29 0.55 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.733 0.813 . . . . 10.0 111.997 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 1.7 m -122.1 139.28 53.91 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.304 -0.258 . . . . 10.0 110.304 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -64.93 -26.16 68.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.09 0.471 . . . . 10.0 110.336 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.2 -32.56 70.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.461 179.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.8 t -67.35 -45.56 85.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.67 -0.492 . . . . 10.0 109.67 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.01 -22.97 63.06 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.404 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -59.92 -25.95 62.42 Favored Glycine 0 C--N 1.332 0.331 0 CA-C-N 115.912 -0.585 . . . . 10.0 112.715 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -65.41 -18.55 65.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.666 0.269 . . . . 10.0 111.047 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -94.99 -14.57 24.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.907 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -69.01 -30.42 68.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.893 0.378 . . . . 10.0 110.747 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm -98.28 30.2 3.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.912 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 38.8 tp -84.99 -8.47 58.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.618 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 91.42 -57.01 3.13 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.711 -0.756 . . . . 10.0 111.808 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 69.88 -69.26 0.17 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.352 0.661 . . . . 10.0 111.795 179.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp 66.57 93.58 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.277 0 O-C-N 123.563 0.539 . . . . 10.0 110.858 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 614' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.29 101.94 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.96 2.44 . . . . 10.0 112.472 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 123.18 -18.81 7.81 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.036 -0.602 . . . . 10.0 111.86 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -98.55 136.96 37.9 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.123 -0.325 . . . . 10.0 110.123 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -80.45 104.9 11.3 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.331 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -61.8 -35.9 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.046 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 40.22 65.91 0.68 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.72 0.808 . . . . 10.0 112.942 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -117.77 108.97 42.02 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.44 -23.2 44.22 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 123.062 2.508 . . . . 10.0 114.447 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 65.6 p-90 -68.13 -18.93 64.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.749 -0.38 . . . . 10.0 111.433 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 87.5 t -64.5 -49.29 81.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.05 -33.68 75.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.616 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -69.14 -44.72 71.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.51 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -63.17 -43.57 97.87 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.591 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 89.8 mt -63.51 -44.78 98.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.559 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -61.32 -37.58 83.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.988 0.423 . . . . 10.0 110.677 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -66.13 -45.56 80.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.042 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -62.89 -45.71 91.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.638 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 631' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' A' ' 635' ' ' GLU . 44.1 mt-30 -60.64 -48.63 80.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.778 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -60.92 -34.2 74.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.189 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -64.71 -42.57 95.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.998 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 634' ' ' VAL . . . . . 0.497 ' O ' ' HB3' ' A' ' 637' ' ' ARG . 70.1 t -62.81 -42.39 96.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.025 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.587 ' HA ' ' ND2' ' A' ' 638' ' ' ASN . 4.5 mm-40 -68.26 -28.98 67.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.743 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 51.1 m -67.37 -28.47 67.98 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.461 0.648 . . . . 10.0 109.339 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 637' ' ' ARG . . . . . 0.497 ' HB3' ' O ' ' A' ' 634' ' ' VAL . 16.8 ttp180 -67.31 -38.18 84.55 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.137 -0.938 . . . . 10.0 109.64 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . 0.587 ' ND2' ' HA ' ' A' ' 635' ' ' GLU . 12.2 m-20 -60.26 -45.42 93.34 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.579 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -57.53 -46.02 84.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.125 -0.943 . . . . 10.0 111.533 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.51 -43.81 98.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.618 0.247 . . . . 10.0 110.801 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 73.9 mt -64.57 -46.81 91.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.372 -0.377 . . . . 10.0 110.275 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 642' ' ' ARG . . . . . 0.433 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 12.2 mtm-85 -61.1 -42.41 98.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.061 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -58.05 -44.13 87.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.602 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.42 -44.88 95.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.621 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 71.7 mt -66.54 -40.76 89.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.005 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 646' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 82.6 mt -61.68 -27.92 69.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.115 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -69.0 -20.69 64.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.96 0.41 . . . . 10.0 110.682 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -101.52 -39.7 7.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.658 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -67.19 -34.21 77.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.653 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 650' ' ' ASP . . . . . 0.433 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 4.4 t0 -65.94 -26.93 67.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.91 0.386 . . . . 10.0 111.153 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 24.3 t -63.07 -44.47 99.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.158 0.504 . . . . 10.0 110.1 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -71.7 -29.13 64.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.701 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -66.91 -46.68 74.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.379 -0.828 . . . . 10.0 110.43 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -57.23 -48.71 78.14 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.516 0.51 . . . . 10.0 110.533 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 655' ' ' GLN . . . . . 0.411 HE22 ' HB2' ' A' ' 807' ' ' SER . 74.2 mt-30 -62.23 -42.53 99.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.792 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 9.8 ttp-105 -63.31 -42.58 99.03 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 120.974 0.416 . . . . 10.0 109.984 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 46.1 ttp180 -59.87 -47.09 87.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.769 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -66.37 -46.66 75.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.046 -179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 10.1 tp -69.07 -33.47 58.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 121.126 -0.23 . . . . 10.0 111.61 -179.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -68.11 -31.42 71.0 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.182 -0.303 . . . . 10.0 110.182 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.3 m -67.55 -45.87 74.4 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.769 -0.456 . . . . 10.0 109.769 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -65.58 -44.84 85.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.442 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -61.27 -37.14 82.09 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.35 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -73.98 -35.94 64.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.203 -0.453 . . . . 10.0 111.19 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -63.5 -49.25 74.31 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.688 -0.486 . . . . 10.0 109.688 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 666' ' ' LEU . . . . . 0.458 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 88.1 mt -59.76 -28.98 67.86 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.169 0.509 . . . . 10.0 110.282 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.407 ' O ' ' HD3' ' A' ' 195' ' ' PRO . 0.9 OUTLIER -74.73 -46.56 36.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.507 -0.77 . . . . 10.0 110.594 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.68 -49.34 59.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.757 -0.656 . . . . 10.0 112.051 -178.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 9.8 m -73.28 150.94 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.065 0.459 . . . . 10.0 111.055 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 11.1 m -101.92 -36.8 8.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.238 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -79.96 90.18 5.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.866 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 9.6 p -92.87 -9.97 9.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.543 0.687 . . . . 10.0 109.477 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.63 -42.35 67.67 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 114.829 -1.078 . . . . 10.0 111.838 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -56.22 -51.44 68.07 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.341 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 2.4 m -60.94 -45.81 93.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.084 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 48.1 mm -55.13 -47.32 77.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.474 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -70.65 -39.72 73.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.586 -0.279 . . . . 10.0 111.436 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 50.0 m -60.99 -46.58 90.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.47 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 38.0 pt -76.24 -21.22 15.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.234 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 23.5 ttm-85 -60.01 -46.91 87.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.799 0.333 . . . . 10.0 110.77 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -62.28 -45.16 94.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.64 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -62.05 -52.01 65.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.592 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 88.7 t -57.81 -45.36 87.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.236 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -63.79 -46.04 86.99 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.929 -0.308 . . . . 10.0 110.592 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -61.38 -47.68 84.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.667 -0.242 . . . . 10.0 110.704 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.25 -39.24 78.65 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.195 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 26.8 m -69.42 -39.09 78.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.428 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -67.97 -46.96 80.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.545 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 689' ' ' ASP . . . . . 0.483 ' HA ' ' O ' ' A' ' 692' ' ' ILE . 85.4 m-20 -59.81 -20.84 59.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.959 -178.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -69.46 -41.87 75.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.505 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -105.47 -14.62 15.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.947 0.403 . . . . 10.0 111.489 -179.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 692' ' ' ILE . . . . . 0.483 ' O ' ' HA ' ' A' ' 689' ' ' ASP . 35.3 mt -132.67 97.66 17.12 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.678 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.12 130.76 37.83 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.333 2.022 . . . . 10.0 111.389 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 694' ' ' PRO . . . . . 0.489 ' HA ' ' NH2' ' A' ' 736' ' ' ARG . 12.1 Cg_endo -56.1 118.44 5.23 Favored 'Trans proline' 0 C--O 1.238 0.499 0 C-N-CA 122.614 2.209 . . . . 10.0 112.508 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 62.12 72.09 0.51 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.438 -0.801 . . . . 10.0 111.257 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 52.0 p -141.84 -167.38 2.43 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.994 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 78.8 mt -83.58 142.79 30.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.473 -0.331 . . . . 10.0 110.578 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . 0.493 ' HA ' ' CD2' ' A' ' 701' ' ' TRP . 24.5 tt0 -61.11 -26.32 67.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.212 0.53 . . . . 10.0 111.153 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -71.08 -16.39 62.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.905 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 14.6 mmt -97.35 6.3 48.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.657 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 701' ' ' TRP . . . . . 0.493 ' CD2' ' HA ' ' A' ' 698' ' ' GLU . 49.7 m0 -98.49 114.5 26.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.088 -178.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -86.15 77.74 9.52 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 703' ' ' ILE . . . . . 0.481 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 36.9 mm -53.52 -48.75 91.86 Favored Pre-proline 0 CA--C 1.537 0.459 0 CA-C-N 115.193 -0.912 . . . . 10.0 112.13 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 704' ' ' PRO . . . . . 0.481 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 47.6 Cg_exo -56.44 -37.4 97.26 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 121.805 1.67 . . . . 10.0 112.303 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -69.45 -40.26 79.35 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 121.246 -0.502 . . . . 10.0 112.344 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 37.8 tp -67.15 -44.59 79.43 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -63.65 -37.2 86.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.966 -0.561 . . . . 10.0 109.926 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.93 -48.49 75.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.516 -0.765 . . . . 10.0 110.611 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -74.77 -34.84 62.53 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.869 -0.605 . . . . 10.0 111.664 -178.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 51.3 mt -68.14 -50.77 52.51 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.729 0.27 . . . . 10.0 111.729 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -66.38 -31.84 72.86 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.028 0.381 . . . . 10.0 112.028 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -87.7 -71.19 0.58 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.748 0.647 . . . . 10.0 112.748 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.28 -58.53 6.83 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.214 0.82 . . . . 10.0 113.214 -176.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -79.06 -11.8 60.0 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.478 0.918 . . . . 10.0 113.478 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 2.2 t70 63.13 24.59 14.5 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.537 0.684 . . . . 10.0 110.051 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . 0.431 ' HG ' ' HG ' ' A' ' 718' ' ' LEU . 18.9 tp -104.71 98.74 8.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.34 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -82.99 97.16 8.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.124 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.431 ' HG ' ' HG ' ' A' ' 716' ' ' LEU . 80.3 mt -129.12 119.75 19.87 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.074 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -82.09 79.06 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.627 2.218 . . . . 10.0 111.399 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 57.9 mt -60.96 -39.29 81.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.51 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -66.04 -13.97 60.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.103 0.478 . . . . 10.0 111.162 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 722' ' ' GLU . . . . . 0.501 ' O ' ' HD2' ' A' ' 726' ' ' LYS . 4.4 tp10 -92.96 -10.4 36.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.701 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 45.2 m0 -96.97 -48.62 5.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.745 0.307 . . . . 10.0 111.643 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 63.2 mt -56.78 -22.63 37.4 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.269 0.84 . . . . 10.0 113.269 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.47 -19.75 21.69 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.794 0.294 . . . . 10.0 111.794 -179.259 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 726' ' ' LYS . . . . . 0.501 ' HD2' ' O ' ' A' ' 722' ' ' GLU . 36.3 mttp -99.93 -38.43 8.61 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.702 0.26 . . . . 10.0 111.702 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -128.74 86.41 57.62 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-O 121.162 0.506 . . . . 10.0 110.796 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -65.93 -13.27 39.08 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.925 2.417 . . . . 10.0 111.749 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 40.2 mp0 -66.02 -15.2 62.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.344 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 35.6 mt -71.74 -40.24 69.51 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 110.078 -0.341 . . . . 10.0 110.078 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 53.35 -88.27 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.053 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -144.31 -49.94 0.28 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.901 -0.32 . . . . 10.0 111.817 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -59.25 -58.89 6.66 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.781 0.325 . . . . 10.0 110.688 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.0 -26.35 68.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.554 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 27.7 tp -65.57 -47.45 75.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.58 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 736' ' ' ARG . . . . . 0.489 ' NH2' ' HA ' ' A' ' 694' ' ' PRO . 73.8 mtt-85 -64.87 -44.9 88.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.266 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -57.08 -40.34 76.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.359 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 15.3 mmm-85 -61.25 -40.19 93.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.937 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 79.6 mt -64.99 -43.71 96.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.399 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 52.1 tp -71.02 -37.45 72.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.415 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -66.87 -40.89 87.99 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.984 0.421 . . . . 10.0 110.599 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -66.67 -36.08 81.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.361 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.44 -41.57 88.96 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 82.1 mt -65.8 -35.87 76.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 178.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.19 -55.28 26.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.98 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.401 ' HA ' ' HD3' ' A' ' 749' ' ' ARG . 88.1 t -58.24 -35.87 55.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.328 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -59.24 -51.01 71.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.304 179.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -64.5 -38.2 90.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.617 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 749' ' ' ARG . . . . . 0.401 ' HD3' ' HA ' ' A' ' 746' ' ' VAL . 77.2 mtp180 -61.07 -36.75 80.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.403 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -80.34 -36.93 33.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.589 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -60.32 -42.84 96.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.597 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -65.22 -12.63 53.36 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 84.3 t -79.58 -43.34 23.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.725 0.298 . . . . 10.0 111.326 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 15.1 m -99.54 -20.21 5.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 112.066 0.395 . . . . 10.0 112.066 -179.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 110.04 144.35 10.23 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.707 -0.759 . . . . 10.0 112.002 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 756' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -60.16 -43.75 95.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.732 0.301 . . . . 10.0 110.899 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -58.99 -43.72 91.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.843 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.9 tpt -65.2 -44.25 88.96 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.383 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 50.9 mmm -63.02 -46.95 85.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.621 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -56.48 -39.73 73.72 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.916 0.389 . . . . 10.0 110.8 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -70.94 -40.8 71.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.142 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -63.69 -44.31 94.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.869 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -57.35 -45.47 84.31 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.028 0.442 . . . . 10.0 110.503 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 764' ' ' LYS . . . . . 0.458 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 72.4 tttt -62.17 -45.47 93.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.005 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -61.72 -44.18 98.26 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.833 -0.621 . . . . 10.0 112.309 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 65.3 t -63.47 -44.59 98.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.392 0.139 . . . . 10.0 110.906 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.69 -49.05 77.79 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.838 0.351 . . . . 10.0 110.583 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 73.3 mt -64.85 -39.93 94.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.15 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -58.89 -57.57 12.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.199 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 17.1 m -60.4 -41.05 93.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.369 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.45 -47.15 85.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.924 0.393 . . . . 10.0 109.991 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 772' ' ' ASP . . . . . 0.5 ' CG ' ' HZ2' ' A' ' 776' ' ' LYS . 9.9 t70 -64.82 -41.67 95.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.773 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 23.2 m -62.04 -45.03 95.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.129 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 35.8 mt -69.53 -32.34 71.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.737 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -63.1 -40.01 96.39 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.5 ' HZ2' ' CG ' ' A' ' 772' ' ' ASP . 14.4 mptt -63.2 -42.79 99.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.861 -0.608 . . . . 10.0 110.268 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 14.2 tm-20 -65.58 -49.5 68.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.712 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 778' ' ' HIS . . . . . 0.526 ' O ' ' HG2' ' A' ' 782' ' ' MET . 43.3 t60 -58.48 -34.23 70.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.339 -0.846 . . . . 10.0 111.276 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.5 mt -62.08 -42.12 98.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.882 0.372 . . . . 10.0 110.275 179.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -73.05 -41.45 64.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.447 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.18 -32.01 71.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.695 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 782' ' ' MET . . . . . 0.526 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 84.8 mmm -62.68 -35.2 78.89 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.08 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -63.25 -50.55 69.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.854 0.359 . . . . 10.0 110.086 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -62.13 -27.07 68.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.24 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 9.5 mt -75.21 -45.86 37.64 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.28 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -60.69 -51.96 67.15 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.628 -179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.235 0.333 0 CA-C-O 120.778 0.323 . . . . 10.0 110.375 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo . . . . . 0 CA--C 1.533 0.448 0 N-CA-C 112.869 0.296 . . . . 10.0 112.869 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 800' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 801' ' ' GLN . 34.3 mtmm -79.59 162.58 25.24 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 801' ' ' GLN . . . . . 0.43 ' HB2' ' O ' ' A' ' 800' ' ' LYS . 8.4 mm100 72.62 -53.53 0.7 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.536 0.522 . . . . 10.0 110.803 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -59.92 -47.87 84.03 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -54.91 -35.51 64.23 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.738 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -69.3 -47.01 65.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.373 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -61.16 -41.35 96.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.538 -0.301 . . . . 10.0 111.026 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.82 -51.05 68.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.266 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 807' ' ' SER . . . . . 0.411 ' HB2' HE22 ' A' ' 655' ' ' GLN . 6.2 p -67.6 -38.71 84.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.395 -0.366 . . . . 10.0 111.742 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -63.34 -34.23 77.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.538 0.209 . . . . 10.0 110.814 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 57.9 m -62.53 -38.41 89.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.138 0.494 . . . . 10.0 110.19 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 46.8 ttm -71.95 -34.14 68.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.112 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -62.63 -41.28 98.92 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.539 -0.541 . . . . 10.0 109.539 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -66.21 -44.33 84.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.166 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -64.16 -32.09 73.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.5 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 28.7 ttp -63.18 -41.88 99.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.467 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 49.1 mt -68.06 -35.55 78.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.915 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 816' ' ' GLU . . . . . 0.536 ' CD ' ' HZ2' ' A' ' 819' ' ' LYS . 47.2 mm-40 -65.13 -45.3 85.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.059 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 7.3 m -71.75 -27.95 63.32 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.002 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 29.4 tp -54.76 -58.81 6.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.348 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 819' ' ' LYS . . . . . 0.536 ' HZ2' ' CD ' ' A' ' 816' ' ' GLU . 12.9 pttp -67.99 -26.35 65.87 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.348 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -61.17 -48.25 82.44 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.862 0.363 . . . . 10.0 110.364 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.83 -46.69 62.3 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.332 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 54.1 t -51.08 -52.52 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.807 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 27.8 mm -64.65 -43.79 96.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.591 -0.277 . . . . 10.0 111.427 -179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 30.9 m -62.88 -45.9 90.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.735 0.302 . . . . 10.0 110.859 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 95.1 m -61.61 -41.87 98.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.606 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 57.0 mt -71.96 -37.19 69.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.433 -0.348 . . . . 10.0 111.816 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 15.6 m -75.41 -32.83 60.87 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.81 0.338 . . . . 10.0 110.908 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -86.47 15.47 5.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.401 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.2 p -62.46 128.79 24.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -93.82 96.11 9.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.957 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 23.3 m . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.489 179.664 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.8 t80 . . . . . 0 C--O 1.234 0.268 0 N-CA-C 110.157 -0.312 . . . . 10.0 110.157 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 98.67 -151.2 19.5 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.869 -0.682 . . . . 10.0 111.617 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.96 175.33 10.14 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.585 0.231 . . . . 10.0 110.406 179.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.441 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 15.7 mmt85 -116.24 172.49 7.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.731 0.301 . . . . 10.0 111.286 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.6 t30 62.95 -90.1 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.391 -0.822 . . . . 10.0 111.36 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -59.39 -50.4 74.09 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.124 0.487 . . . . 10.0 111.4 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -68.15 -35.31 77.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.537 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.5 m -62.13 -46.63 88.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.814 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.2 mt -59.72 -40.73 88.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.879 0.371 . . . . 10.0 110.797 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.7 OUTLIER -65.28 -49.61 68.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.006 -179.801 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -63.4 -38.22 90.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.947 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.546 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -66.6 -42.11 87.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.711 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -58.39 -37.11 74.61 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.555 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -62.64 -37.35 86.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.355 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.3 t -75.48 -37.57 37.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.739 179.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -58.49 -36.59 59.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.927 178.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -59.42 -41.21 89.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.801 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.5 mt -65.2 -43.41 95.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.876 -0.602 . . . . 10.0 109.954 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.1 mt -61.94 -41.77 92.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.204 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -63.39 -36.1 82.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.733 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.37 -24.26 50.67 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.33 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 35.6 mtt -86.2 -16.51 37.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.45 -0.341 . . . . 10.0 111.382 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.472 ' OE1' ' HD2' ' A' ' 82' ' ' ARG . 3.9 tt0 -57.88 -53.56 64.52 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-O 119.485 -0.293 . . . . 10.0 111.537 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.443 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 31.2 Cg_exo -60.52 -25.89 81.62 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.647 1.565 . . . . 10.0 111.86 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -71.84 -45.35 61.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.243 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.2 mmt -66.06 -26.01 67.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.663 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -67.95 -15.2 63.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.004 -0.543 . . . . 10.0 110.994 179.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -93.07 -5.0 51.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.322 0.582 . . . . 10.0 110.038 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.7 mp -98.1 145.15 26.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.29 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.5 p -77.66 170.55 16.38 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.171 -0.468 . . . . 10.0 109.862 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.83 -43.5 90.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.149 0.5 . . . . 10.0 110.364 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -65.55 -30.53 71.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.652 -0.704 . . . . 10.0 111.043 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -70.05 -33.91 72.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.622 0.249 . . . . 10.0 110.409 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 73.3 mt -65.45 -42.24 92.58 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -64.81 -31.3 72.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.261 -0.881 . . . . 10.0 109.417 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.6 -34.47 89.11 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.412 -0.813 . . . . 10.0 112.144 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.433 ' HZ3' ' CD ' ' A' ' 49' ' ' GLU . 29.1 mmmt -65.3 -36.16 83.21 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.979 -0.378 . . . . 10.0 109.979 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.9 m -61.74 -43.67 98.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.269 0.557 . . . . 10.0 109.66 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.9 -30.29 68.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.774 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.433 ' CD ' ' HZ3' ' A' ' 46' ' ' LYS . 4.0 tt0 -68.2 -45.89 72.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.592 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -58.53 -42.84 88.68 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.178 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -60.51 -46.63 89.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.914 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.21 -32.72 73.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.352 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 43.4 mtp180 -68.24 -49.35 61.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.857 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 82.6 mt -61.05 -31.96 71.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.006 0.432 . . . . 10.0 110.535 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -62.22 -44.99 95.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.902 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -83.08 -48.99 9.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.07 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 163.53 111.48 0.26 Allowed Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.51 -0.636 . . . . 10.0 111.51 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -166.66 154.68 9.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 43.9 t -99.83 131.67 46.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.409 HD12 ' O ' ' A' ' 118' ' ' LEU . 14.8 tp -60.09 -42.72 95.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.193 0.521 . . . . 10.0 110.269 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.6 mp0 -65.4 -19.68 66.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.014 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -87.21 -18.58 29.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.356 0.598 . . . . 10.0 110.176 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.7 mt -83.06 -13.68 55.3 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.951 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.498 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 89.3 mt -48.69 -53.41 36.69 Favored Pre-proline 0 CA--C 1.542 0.652 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -178.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.498 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.1 Cg_exo -53.38 -47.34 27.93 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.021 1.814 . . . . 10.0 113.098 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -74.9 -46.45 35.9 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.813 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.97 75.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.977 -178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -62.18 -34.73 76.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.85 -179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.8 -44.38 85.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.192 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.44 -45.69 98.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.237 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 59.1 t -61.8 -44.94 99.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.127 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.7 ttm180 -60.26 -42.87 96.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.116 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -61.36 -48.67 80.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.379 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.97 73.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.911 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.7 m -62.08 -35.11 77.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.952 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -78.36 -18.2 55.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.527 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -98.42 -45.9 5.97 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 111.782 0.29 . . . . 10.0 111.782 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 76.5 t -76.05 -54.92 12.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.687 0.28 . . . . 10.0 111.639 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -90.11 -43.05 10.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.714 0.292 . . . . 10.0 111.205 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.2 16.62 24.75 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.806 -0.711 . . . . 10.0 111.591 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.6 mtm -131.04 124.18 30.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.754 0.311 . . . . 10.0 110.191 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.472 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 9.5 ttp180 -71.07 133.35 46.21 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.875 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.95 117.5 7.09 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.412 ' HB2' ' HG3' ' A' ' 87' ' ' GLN . 33.1 m-85 -56.66 149.56 17.52 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.451 0.469 . . . . 10.0 111.278 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -61.71 -34.08 75.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.037 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.6 m -68.1 -29.96 46.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 10.0 110.79 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.428 HE22 HD22 ' A' ' 110' ' ' LEU . 96.3 mt-30 -70.64 -31.09 67.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.07 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 74.6 mt -64.29 -34.19 77.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.793 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.5 mt -66.85 -49.75 64.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.684 178.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -63.58 -46.25 92.72 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.629 -0.714 . . . . 10.0 112.501 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.29 -31.93 78.92 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.996 -0.621 . . . . 10.0 112.213 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' MET . . . . . 0.546 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 14.9 ttm -72.6 -35.44 67.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.993 0.425 . . . . 10.0 110.44 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.7 t -70.31 -36.33 66.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.127 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 93.8 mt -72.92 3.08 5.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.713 -0.676 . . . . 10.0 112.091 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -80.04 -30.08 39.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.336 0.589 . . . . 10.0 109.485 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -104.75 -167.22 1.32 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.409 -0.814 . . . . 10.0 111.051 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 -86.38 57.58 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.065 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 408' ' ' ASP . 31.4 m -127.9 147.79 50.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.957 -0.565 . . . . 10.0 112.05 -178.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 43.5 mm -100.16 123.85 53.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 108.745 -0.835 . . . . 10.0 108.745 177.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.69 134.45 51.96 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.05 0.452 . . . . 10.0 112.056 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 102' ' ' MET . 0.0 OUTLIER -97.21 158.72 15.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.61 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.447 ' H ' ' CD ' ' A' ' 101' ' ' GLU . 49.2 ttm -171.69 134.97 0.84 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.836 -0.801 . . . . 10.0 108.836 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -62.06 151.6 34.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.239 0.542 . . . . 10.0 111.476 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.0 m -71.51 92.74 1.14 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.929 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 152.7 -28.85 0.84 Allowed Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.783 -0.722 . . . . 10.0 112.205 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.438 ' HB2' ' SD ' ' A' ' 102' ' ' MET . 5.5 mm-40 -66.96 -17.26 64.83 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.769 0.319 . . . . 10.0 111.135 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.28 67.21 0.64 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.744 -0.741 . . . . 10.0 112.429 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -61.07 -58.84 6.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.84 0.352 . . . . 10.0 111.049 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.1 -36.29 81.26 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.969 -179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.428 HD22 HE22 ' A' ' 87' ' ' GLN . 31.6 tp -67.81 -27.2 66.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.271 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 95.7 m -80.19 -30.4 38.72 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.013 0.435 . . . . 10.0 111.252 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.405 ' HB3' HD22 ' A' ' 207' ' ' LEU . . . -67.29 -12.3 59.76 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.072 0.767 . . . . 10.0 113.072 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 31.8 p -75.63 -24.41 56.45 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.02 0.378 . . . . 10.0 112.02 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.95 -56.23 18.29 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.098 0.407 . . . . 10.0 112.098 -179.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.06 -26.16 58.25 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.891 1.727 . . . . 10.0 111.881 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.28 -52.71 44.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.526 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.407 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 68.8 t80 -60.41 -43.9 96.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.082 0.467 . . . . 10.0 110.688 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.409 ' O ' HD12 ' A' ' 60' ' ' LEU . 34.7 tp -60.55 -51.07 71.0 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.638 -0.71 . . . . 10.0 112.009 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -73.31 -24.11 60.36 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.839 0.311 . . . . 10.0 111.839 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -67.12 -24.07 65.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.711 0.291 . . . . 10.0 110.975 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 71.6 mt -59.9 -26.46 65.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.609 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.0 p -66.48 -29.39 69.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.895 0.378 . . . . 10.0 111.171 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.96 14.14 67.78 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.782 -0.723 . . . . 10.0 112.602 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -93.06 -12.5 30.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.838 0.351 . . . . 10.0 111.165 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 88.85 119.49 1.67 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.783 -0.723 . . . . 10.0 113.012 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.1 t -80.41 115.54 23.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -86.16 92.0 8.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.004 0.43 . . . . 10.0 110.339 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 28.3 t -84.65 122.97 38.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.153 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.464 ' O ' ' HA ' ' A' ' 208' ' ' VAL . 87.1 t -109.7 122.47 64.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.363 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.22 148.16 39.45 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.831 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 4.1 m -54.17 -37.84 36.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 O-C-N 123.486 0.492 . . . . 10.0 112.029 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -141.44 168.53 19.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.561 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -75.17 -26.74 59.3 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.145 -0.48 . . . . 10.0 111.532 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -56.66 -52.88 63.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.892 0.377 . . . . 10.0 110.544 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 98.3 mt -70.76 -34.64 72.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.582 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.61 -52.6 64.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.687 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -67.81 -35.54 78.8 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.999 0.428 . . . . 10.0 110.339 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 138' ' ' ARG . 4.5 ttp180 -58.0 -59.03 5.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.061 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . 0.404 ' CG ' HH21 ' A' ' 138' ' ' ARG . 2.2 m-20 -70.86 -27.98 64.23 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.597 0.592 . . . . 10.0 112.597 -178.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -59.81 -44.28 94.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.861 0.362 . . . . 10.0 110.906 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -88.89 -25.44 22.13 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.429 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -71.86 -46.92 56.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.916 0.388 . . . . 10.0 111.241 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -89.36 0.34 56.89 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.438 -0.347 . . . . 10.0 111.046 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 58.3 ttm-85 -60.69 -49.67 88.66 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' PRO . . . . . 0.472 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 28.0 Cg_exo -62.96 -10.57 20.88 Favored 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 122.178 1.919 . . . . 10.0 112.888 -179.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.0 tp -92.66 -50.17 5.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.052 0.453 . . . . 10.0 110.288 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -71.79 -45.87 60.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.007 -0.542 . . . . 10.0 112.004 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.94 -24.75 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.982 0.42 . . . . 10.0 110.792 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -70.37 -33.15 71.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.764 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 60.1 mt -84.29 -14.91 48.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.811 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 109.94 16.97 10.01 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.798 -0.715 . . . . 10.0 112.951 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 37.2 mt -102.58 134.08 46.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.795 0.331 . . . . 10.0 110.435 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.03 126.69 34.34 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.567 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 46.9 t -106.06 128.63 60.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.908 0.385 . . . . 10.0 110.828 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -124.13 146.99 16.49 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.075 -0.583 . . . . 10.0 111.773 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.6 tp -118.56 125.8 74.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.062 0.458 . . . . 10.0 110.44 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -101.68 113.38 26.49 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.054 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 36.0 mt -100.37 141.71 23.23 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.742 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' PRO . . . . . 0.45 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 24.0 Cg_endo -61.07 107.21 0.44 Allowed 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.962 2.441 . . . . 10.0 112.854 -179.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.69 16.3 46.17 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.021 -0.609 . . . . 10.0 113.372 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 12.4 ptm -77.64 159.58 76.54 Favored Pre-proline 0 CA--C 1.535 0.393 0 CA-C-N 117.26 0.53 . . . . 10.0 109.9 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -52.06 143.52 40.74 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.062 2.508 . . . . 10.0 113.291 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . 0.439 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -57.89 -49.11 95.53 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.794 -0.639 . . . . 10.0 112.422 -179.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.439 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 41.9 Cg_exo -58.69 -36.31 97.36 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.599 1.533 . . . . 10.0 112.046 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.02 -39.25 90.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.513 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.437 ' HZ1' ' CG ' ' A' ' 185' ' ' ASP . 57.5 mttm -60.95 -43.58 98.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.155 179.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -59.8 -39.37 84.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.667 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -68.16 -39.32 82.63 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.988 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -73.08 -38.87 66.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.011 -0.541 . . . . 10.0 111.501 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -75.54 -26.29 57.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.686 0.279 . . . . 10.0 111.564 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.34 1.48 28.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.048 0.452 . . . . 10.0 110.756 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -81.61 176.32 9.75 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.802 -0.636 . . . . 10.0 109.722 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -78.24 -33.42 49.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.881 0.372 . . . . 10.0 110.522 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 88.0 mt -136.79 122.16 26.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.121 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.1 m -115.51 122.73 46.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.833 0.349 . . . . 10.0 111.194 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -97.95 136.2 38.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.898 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.81 170.32 43.08 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.441 -0.885 . . . . 10.0 112.817 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.5 m -88.48 151.12 22.75 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 122.43 0.292 . . . . 10.0 110.679 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -57.62 -42.31 83.09 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 -179.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -58.21 -54.26 48.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.615 -0.266 . . . . 10.0 111.421 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' GLU . . . . . 0.45 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.4 tp10 -65.27 -37.67 87.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.091 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.81 -39.24 80.56 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.897 0.379 . . . . 10.0 110.701 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -76.13 -42.64 23.57 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.85 -0.69 . . . . 10.0 111.596 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -37.97 86.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.89 0.376 . . . . 10.0 110.429 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 185' ' ' ASP . . . . . 0.437 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 8.3 m-20 -59.5 -44.06 93.21 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.429 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.64 -38.78 91.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.47 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 47.5 mt -64.58 -46.62 81.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.819 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 28.3 mtm180 -69.68 -35.86 75.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.124 0.488 . . . . 10.0 110.545 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.03 -50.65 71.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.483 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.3 -0.9 30.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.732 -0.667 . . . . 10.0 112.438 -178.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 25.7 ttp -105.39 10.77 33.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.193 0.521 . . . . 10.0 110.403 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 192' ' ' ALA . . . . . 0.4 ' HB1' ' HB2' ' A' ' 197' ' ' GLU . . . -78.05 166.07 23.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.254 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -103.83 -26.24 12.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.078 0.466 . . . . 10.0 110.227 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -118.05 138.52 25.56 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.49 -23.94 76.59 Favored 'Trans proline' 0 CA--C 1.53 0.284 0 C-N-CA 122.614 2.209 . . . . 10.0 112.534 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 37.8 mp0 -78.44 -13.01 60.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.464 -0.334 . . . . 10.0 111.079 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 197' ' ' GLU . . . . . 0.4 ' HB2' ' HB1' ' A' ' 192' ' ' ALA . 67.6 mt-10 -82.39 -4.99 58.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.549 -0.296 . . . . 10.0 110.902 -179.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 198' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 198' ' ' ARG . 45.6 mtt85 -62.68 157.78 20.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.284 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 12.2 m -133.29 -14.63 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.057 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -91.79 163.79 13.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.179 0.514 . . . . 10.0 111.558 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -122.76 174.86 6.86 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.679 -0.86 . . . . 10.0 108.679 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -55.23 124.67 17.74 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.122 0.487 . . . . 10.0 111.182 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 10.4 mt -79.82 72.32 6.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.307 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 9.7 t-160 -88.49 -53.57 4.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.733 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -128.78 138.68 52.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.916 0.388 . . . . 10.0 111.789 -178.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 206' ' ' ALA . . . . . 0.559 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . . . -129.97 135.84 48.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.552 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 207' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 112' ' ' ALA . 35.7 tp -131.69 109.92 10.52 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.354 -179.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 208' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 2.9 p -104.97 140.55 22.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.67 0.272 . . . . 10.0 110.98 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.34 -40.59 70.6 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 210' ' ' GLU . . . . . 0.413 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 7.5 tt0 -135.27 113.72 11.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.036 0.446 . . . . 10.0 111.029 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 34.2 m -84.54 -14.88 11.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.111 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 212' ' ' ASP . . . . . 0.408 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 0.9 OUTLIER -55.53 -71.13 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.729 -179.18 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.1 m -76.13 -38.09 57.23 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.473 0.546 . . . . 10.0 112.473 -178.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 214' ' ' ILE . . . . . 0.497 ' O ' ' HB2' ' A' ' 218' ' ' GLU . 45.5 mt -71.55 -43.54 71.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 113.993 1.108 . . . . 10.0 113.993 -177.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 17.0 mt -93.74 -50.68 5.26 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.929 0.714 . . . . 10.0 112.929 -177.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 216' ' ' ILE . . . . . 0.408 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 48.6 mm -73.14 -56.68 8.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -70.97 -39.49 72.48 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 218' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 214' ' ' ILE . 6.0 mm-40 -91.61 19.27 6.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.89 -51.4 69.44 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 220' ' ' ARG . . . . . 0.423 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -96.85 32.36 2.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.96 0.409 . . . . 10.0 111.392 -178.571 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 17.4 m -101.86 105.02 39.24 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-O 120.92 0.39 . . . . 10.0 110.197 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 222' ' ' PRO . . . . . 0.423 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 73.1 Cg_endo -91.33 132.25 1.44 Allowed 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.939 2.426 . . . . 10.0 112.778 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 223' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 374' ' ' SER . 69.2 mt -78.22 105.65 9.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.156 -0.474 . . . . 10.0 109.768 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 59.0 mt -86.49 122.88 39.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.775 -0.648 . . . . 10.0 112.18 -178.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 59.8 mt . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.273 178.223 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.394 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 374' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 58.1 m -156.01 146.13 21.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.009 0.433 . . . . 10.0 111.478 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 16.5 tt -145.96 141.0 21.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.752 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.63 145.43 25.68 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.318 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -56.8 -41.14 77.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.774 0.321 . . . . 10.0 110.314 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 378' ' ' GLN . . . . . 0.505 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.4 tm0? -55.96 -41.9 75.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.902 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -78.06 -30.66 49.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.054 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -68.1 -49.05 63.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.989 0.423 . . . . 10.0 110.304 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -72.78 -17.31 61.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.758 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.63 -25.27 63.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.348 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 73.9 mt -78.92 -12.87 60.05 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.806 -0.633 . . . . 10.0 111.753 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 384' ' ' TYR . . . . . 0.559 ' CD2' ' HB3' ' A' ' 206' ' ' ALA . 30.1 m-85 -80.81 138.75 36.25 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.799 0.333 . . . . 10.0 110.875 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -72.95 -73.48 0.2 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.186 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -91.41 90.55 7.73 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 66.2 tp -99.46 106.34 18.37 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.58 -0.737 . . . . 10.0 109.705 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -122.74 161.44 23.92 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.801 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -179.3 172.64 44.66 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.136 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 65.2 mtm -112.71 152.46 29.04 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.951 0.405 . . . . 10.0 110.576 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 9.6 t -122.04 -176.69 3.4 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.076 -0.713 . . . . 10.0 109.076 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -106.43 165.18 13.53 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.623 -0.799 . . . . 10.0 111.584 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 4.7 m -71.08 74.52 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.399 0.618 . . . . 10.0 109.99 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 394' ' ' ALA . . . . . 0.417 ' HA ' ' HB3' ' A' ' 569' ' ' ASN . . . -131.39 -48.72 0.99 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.992 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 395' ' ' ASP . . . . . 0.503 ' CG ' ' H ' ' A' ' 396' ' ' THR . 21.0 t70 66.38 -140.54 0.16 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 -178.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 396' ' ' THR . . . . . 0.503 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 4.8 m 70.0 -77.72 0.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 122.777 0.431 . . . . 10.0 111.652 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -81.72 15.15 2.28 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.2 0.524 . . . . 10.0 111.191 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 398' ' ' ALA . . . . . 0.435 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -66.99 -23.43 65.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.714 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -75.74 -10.92 59.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.906 0.384 . . . . 10.0 111.091 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 400' ' ' GLU . . . . . 0.443 ' HG2' ' CD1' ' A' ' 639' ' ' PHE . 43.0 mt-10 -89.27 -14.27 36.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.506 -0.316 . . . . 10.0 111.085 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 401' ' ' PHE . . . . . 0.435 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 18.7 m-85 -60.9 -51.7 68.17 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.961 0.41 . . . . 10.0 110.553 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 402' ' ' SER . . . . . 0.403 ' O ' ' HA ' ' A' ' 406' ' ' LYS . 0.7 OUTLIER -75.62 -21.0 58.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.418 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 29.1 m -81.84 -47.17 13.16 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.5 mt -88.68 -60.2 2.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 112.709 0.633 . . . . 10.0 112.709 -177.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 405' ' ' TYR . . . . . 0.505 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 68.8 m-85 -90.98 -4.78 56.18 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.635 0.606 . . . . 10.0 112.635 -177.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 406' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 402' ' ' SER . 67.4 mmtt 59.82 53.6 4.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.072 0.463 . . . . 10.0 110.205 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 34.9 mt -111.47 144.17 41.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.257 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 408' ' ' ASP . . . . . 0.561 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . 36.8 t0 -78.87 167.95 20.42 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.884 -0.784 . . . . 10.0 108.884 178.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 19.6 m -138.72 121.82 16.84 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 121.963 -0.46 . . . . 10.0 112.123 -178.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 85.7 t -132.39 131.31 60.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.934 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.2 t -94.11 119.62 42.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.222 -0.288 . . . . 10.0 110.222 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 41.1 t -93.56 132.66 29.61 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 116.405 -0.362 . . . . 10.0 110.587 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -67.96 159.25 53.78 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.763 2.309 . . . . 10.0 112.548 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 15.2 p -82.84 166.5 18.92 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.914 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -63.11 -37.23 86.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.421 0.629 . . . . 10.0 109.685 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 -136.86 147.88 60.93 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.913 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.52 135.6 50.27 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 122.297 1.998 . . . . 10.0 111.942 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 56.8 mtm -71.86 138.65 48.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.869 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.3 mt -104.17 10.74 8.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.61 0.719 . . . . 10.0 109.431 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 15.7 ttp-105 -66.62 124.99 24.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.095 -0.957 . . . . 10.0 110.928 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . 0.529 ' O ' ' HA ' ' A' ' 583' ' ' SER . 89.4 mttt -105.89 136.25 45.87 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -104.82 148.98 26.05 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.864 0.364 . . . . 10.0 111.014 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 72.5 mt -125.25 148.04 59.44 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.941 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -61.47 164.31 15.75 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.914 2.409 . . . . 10.0 113.986 -178.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -84.24 116.96 23.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.018 -0.992 . . . . 10.0 109.608 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 59.0 mt -96.22 102.72 14.55 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.3 0.571 . . . . 10.0 110.256 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 42.9 t -93.19 129.44 43.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.199 -0.909 . . . . 10.0 110.772 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 428' ' ' TYR . . . . . 0.483 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 79.3 m-85 -112.39 -178.6 3.45 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.078 179.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 429' ' ' MET . . . . . 0.56 ' HB2' ' OE2' ' A' ' 433' ' ' GLU . 20.1 mmt -74.21 -76.7 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.879 0.371 . . . . 10.0 111.112 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 59.4 p -89.72 160.45 16.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.162 -0.472 . . . . 10.0 111.052 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 431' ' ' GLU . . . . . 0.433 ' OE1' ' HD3' ' A' ' 434' ' ' LYS . 9.5 tp10 -60.85 -27.26 67.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.717 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -59.47 -48.47 81.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.895 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 433' ' ' GLU . . . . . 0.56 ' OE2' ' HB2' ' A' ' 429' ' ' MET . 14.3 mt-10 -62.68 -39.17 93.12 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.079 0.466 . . . . 10.0 110.29 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 434' ' ' LYS . . . . . 0.433 ' HD3' ' OE1' ' A' ' 431' ' ' GLU . 63.9 tttt -60.67 -51.45 69.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.311 -0.859 . . . . 10.0 110.798 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 49.4 mm -66.4 -42.79 91.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.982 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -60.3 -37.39 80.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.78 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.99 -37.4 85.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.444 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 76.8 mt -62.95 -42.95 98.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.922 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 41.6 mm -56.89 -42.36 78.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.674 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -64.54 -47.28 79.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.165 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -59.89 -39.09 84.16 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.079 0.466 . . . . 10.0 110.411 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 78.7 mt -71.38 -45.74 67.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.547 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -50.03 -49.68 50.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.836 -0.62 . . . . 10.0 111.468 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -58.93 -44.04 91.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.672 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.436 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 38.3 mtt-85 -75.17 -22.0 58.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.316 -178.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 29.7 m -68.34 -36.62 79.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.128 0.49 . . . . 10.0 110.163 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.9 -25.55 30.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.999 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 34.8 mttp -79.14 -31.36 44.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.209 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 101.57 35.64 4.03 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.429 -0.891 . . . . 10.0 112.698 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 450' ' ' GLN . . . . . 0.436 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 59.7 tt0 -112.8 125.6 29.63 Favored Pre-proline 0 C--N 1.323 -0.561 0 O-C-N 122.673 -0.31 . . . . 10.0 110.825 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -65.36 136.88 48.93 Favored 'Trans proline' 0 C--O 1.237 0.447 0 C-N-CA 122.497 2.131 . . . . 10.0 111.153 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 60.9 t -123.04 122.96 66.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.505 -178.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 45.7 tp -109.7 112.22 24.15 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 41.5 t -96.06 121.31 46.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.13 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -103.93 105.01 2.55 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.713 -0.756 . . . . 10.0 112.175 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 17.2 p -103.02 139.51 38.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.754 0.312 . . . . 10.0 110.529 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 7.5 pt -100.88 3.89 10.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.378 0.609 . . . . 10.0 110.051 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 3.5 p -133.82 128.8 35.48 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.978 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 28.8 mt -62.12 -36.7 75.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.025 0.44 . . . . 10.0 110.587 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.95 -41.59 83.17 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.582 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -36.74 77.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.844 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 3.8 m -58.98 -46.07 89.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.951 0.405 . . . . 10.0 110.402 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -71.86 -32.32 67.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.66 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 61.4 tp -68.43 -54.88 14.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.616 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.9 p -63.48 -30.16 49.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.904 0.383 . . . . 10.0 110.336 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 10.5 t -64.5 -43.91 92.6 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -65.45 -42.43 92.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.33 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -63.28 -43.51 97.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.619 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 47.0 mt -62.88 -42.03 99.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.246 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 35.3 m -64.41 -34.89 79.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.045 0.45 . . . . 10.0 110.017 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -63.29 -39.8 95.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.049 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.09 -4.88 56.75 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.295 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 75.88 26.78 63.92 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.025 -0.607 . . . . 10.0 112.378 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 71.3 mt -94.35 116.13 34.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.916 0.388 . . . . 10.0 110.803 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -64.2 131.67 48.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.202 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -155.93 157.89 37.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.992 -178.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -121.41 134.54 55.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.933 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 11.0 t -110.6 132.63 58.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.681 0.277 . . . . 10.0 110.809 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.09 164.66 22.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.529 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -157.1 117.9 3.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.144 -0.48 . . . . 10.0 109.834 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -59.57 -21.31 60.13 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.911 -0.586 . . . . 10.0 112.27 -179.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -76.38 -19.78 57.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.684 0.278 . . . . 10.0 111.113 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -127.18 64.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.473 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -59.59 -30.4 68.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.232 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.55 -28.89 69.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.583 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -84.56 -33.9 23.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.02 0.438 . . . . 10.0 109.898 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -58.37 -36.91 74.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.723 -0.672 . . . . 10.0 110.966 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -53.62 -35.6 61.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 10.0 111.974 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -83.01 -35.16 26.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.917 0.389 . . . . 10.0 110.675 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 75.8 mt -66.86 -54.0 29.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.297 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 49.4 t -61.54 -30.67 48.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.16 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -60.69 -29.96 69.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.607 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 71.4 mm-40 -114.27 21.38 14.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.773 0.321 . . . . 10.0 110.942 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.68 -17.63 62.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.028 0.442 . . . . 10.0 111.069 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -101.27 15.27 57.82 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.046 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -79.33 142.09 58.18 Favored Pre-proline 0 C--N 1.324 -0.542 0 N-CA-C 110.075 -0.342 . . . . 10.0 110.075 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.93 123.3 12.14 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.539 2.16 . . . . 10.0 112.789 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 71.5 16.68 5.88 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.615 -0.721 . . . . 10.0 112.751 178.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.74 110.23 21.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.984 0.421 . . . . 10.0 110.605 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 20.4 t -92.74 114.44 29.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.983 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 2.0 m -115.95 134.3 55.12 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.02 -179.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 62.7 mt -110.61 120.75 62.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 120.85 0.357 . . . . 10.0 110.069 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -111.29 124.25 51.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.605 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 14.5 m -103.56 119.65 39.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.54 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 14.1 m120 54.98 48.14 20.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.619 -0.718 . . . . 10.0 111.956 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 49.2 ttm -74.72 121.2 21.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.099 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -69.66 -174.16 0.69 Allowed 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.608 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -73.89 -178.13 37.2 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.065 -0.588 . . . . 10.0 112.587 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.413 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 52.6 mtt180 63.98 -95.52 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.83 0.452 . . . . 10.0 110.504 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 81.21 167.04 37.4 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.929 -0.653 . . . . 10.0 113.096 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.59 167.81 21.2 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.618 0.247 . . . . 10.0 111.087 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -85.53 106.76 17.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.747 0.308 . . . . 10.0 110.339 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 65.9 mt -80.62 108.95 14.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.257 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 19.6 t -88.12 127.78 40.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.638 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 50.3 mt -71.6 132.3 44.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.162 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 90.72 11.52 61.9 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.743 -0.741 . . . . 10.0 111.751 -179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 94.68 179.45 37.7 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.891 -0.671 . . . . 10.0 111.774 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 2.6 p -117.45 96.0 5.21 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.805 0.336 . . . . 10.0 110.976 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 18.0 p-90 -59.84 -25.81 65.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.795 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -66.72 -34.26 77.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.656 -0.702 . . . . 10.0 110.48 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.34 -31.15 38.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.262 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.14 -46.08 75.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.686 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.0 m -69.02 -27.2 34.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.846 0.355 . . . . 10.0 110.754 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -78.84 -9.11 59.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.982 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -93.56 -7.54 43.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.144 0.497 . . . . 10.0 110.483 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 60.3 mt -99.01 134.65 41.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.936 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -65.63 -49.7 67.74 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.191 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -126.63 88.55 54.14 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.703 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -83.29 112.99 2.01 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.972 2.448 . . . . 10.0 111.591 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 530' ' ' THR . . . . . 0.516 ' H ' ' NE2' ' A' ' 533' ' ' GLN . 16.7 p -87.82 176.52 7.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.581 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -58.96 -44.93 91.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.947 0.403 . . . . 10.0 111.054 -179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.482 ' OE1' ' HB ' ' A' ' 530' ' ' THR . 1.2 mp0 -63.61 -36.23 83.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.651 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . 0.516 ' NE2' ' H ' ' A' ' 530' ' ' THR . 31.9 mt-30 -65.97 -49.87 66.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.953 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 74.2 mt -60.33 -45.32 96.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.605 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . 0.424 ' CD ' ' HZ3' ' A' ' 538' ' ' LYS . 14.2 tp10 -64.54 -44.13 91.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.795 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -60.43 -50.02 75.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.691 -0.231 . . . . 10.0 110.811 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 85.0 mt -62.64 -45.07 99.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.607 -0.27 . . . . 10.0 110.67 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . 0.424 ' HZ3' ' CD ' ' A' ' 535' ' ' GLU . 5.5 ttmt -60.75 -45.16 95.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.887 0.375 . . . . 10.0 110.782 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.18 95.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.259 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 540' ' ' ASP . . . . . 0.583 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 0.1 OUTLIER -67.64 -40.43 84.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.389 -0.368 . . . . 10.0 110.057 179.617 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 44.3 t90 -59.8 -42.15 92.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.142 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -53.37 -44.0 68.23 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.79 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 59.6 t -65.47 -47.61 86.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.739 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 544' ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 13.4 mtm180 -63.72 -33.27 75.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.346 0.593 . . . . 10.0 110.272 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -65.52 -50.59 64.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.186 -0.915 . . . . 10.0 111.063 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.79 -26.81 64.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.298 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.2 -39.45 92.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.189 0.519 . . . . 10.0 109.88 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 86.2 t -65.85 -37.34 79.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.994 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 98.5 mt -66.09 -32.74 74.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.202 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -69.97 -38.98 76.22 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.275 179.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -69.0 -44.24 73.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.125 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 145.26 18.56 0.17 Allowed Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.075 -1.06 . . . . 10.0 113.684 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 77.54 -169.75 54.85 Favored Glycine 0 C--N 1.328 0.13 0 C-N-CA 120.668 -0.777 . . . . 10.0 112.352 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 63.8 tp -72.2 125.53 27.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.0 0.428 . . . . 10.0 110.409 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -94.31 123.62 37.83 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.786 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 40.8 mm -105.43 128.19 59.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.343 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 557' ' ' ILE . . . . . 0.405 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.2 mt -120.77 123.2 69.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 120.989 0.423 . . . . 10.0 110.49 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.53 122.08 7.05 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 111.321 -0.712 . . . . 10.0 111.321 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 18.3 p -82.51 -56.27 3.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.143 0.497 . . . . 10.0 111.113 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 14.4 mp0 -110.73 141.46 44.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.617 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 15.1 mmt180 -87.13 123.49 32.24 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.149 -0.685 . . . . 10.0 109.149 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -67.19 143.72 56.4 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.704 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -57.15 -66.12 0.51 Allowed 'General case' 0 N--CA 1.462 0.154 0 O-C-N 123.431 0.457 . . . . 10.0 109.99 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.58 121.62 20.01 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 565' ' ' ARG . . . . . 0.415 ' HB2' ' HB3' ' A' ' 631' ' ' GLN . 16.9 tpt180 -60.5 -21.2 62.16 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 123.457 0.473 . . . . 10.0 111.659 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -55.43 -61.4 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.962 0.41 . . . . 10.0 110.749 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 30.0 mt -71.31 -24.51 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.032 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -63.08 -49.34 74.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.485 0.659 . . . . 10.0 109.523 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 569' ' ' ASN . . . . . 0.417 ' HB3' ' HA ' ' A' ' 394' ' ' ALA . 50.2 t30 -67.58 -38.55 84.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.954 -1.021 . . . . 10.0 110.676 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -67.12 -30.95 71.1 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.799 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 44.4 tp -66.82 -32.78 74.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.988 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -85.64 -33.77 21.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.485 -0.78 . . . . 10.0 110.995 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.63 54.81 2.49 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 121.235 -0.507 . . . . 10.0 113.902 -179.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -92.15 -51.46 5.17 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.46 -167.87 2.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.173 179.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 73.92 39.11 47.58 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.475 -0.869 . . . . 10.0 112.238 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 577' ' ' ARG . . . . . 0.549 ' H ' ' HB3' ' A' ' 580' ' ' ASP . 51.3 mtt180 -97.58 122.45 40.65 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 58.73 41.17 22.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.015 0.436 . . . . 10.0 111.793 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 82.16 32.33 29.14 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 121.039 -0.601 . . . . 10.0 113.096 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 580' ' ' ASP . . . . . 0.549 ' HB3' ' H ' ' A' ' 577' ' ' ARG . 6.1 t70 -81.11 163.65 22.98 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -89.47 -139.49 0.13 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.905 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 120.65 167.41 13.36 Favored Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 120.666 -0.778 . . . . 10.0 112.326 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 583' ' ' SER . . . . . 0.529 ' HA ' ' O ' ' A' ' 421' ' ' LYS . 1.3 p -149.19 122.27 8.86 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.442 0.163 . . . . 10.0 110.619 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.49 125.81 39.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.721 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 585' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 4.3 tpm_? -132.99 124.83 28.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.539 -0.3 . . . . 10.0 110.192 179.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -116.43 140.01 49.82 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.9 0.381 . . . . 10.0 111.114 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -132.18 122.97 26.12 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.104 -0.702 . . . . 10.0 109.104 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 5.3 mt -130.39 179.25 6.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.829 0.347 . . . . 10.0 111.286 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 38.8 p -142.55 178.6 7.5 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.803 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 74.7 mmm -85.31 -4.32 59.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.09 0.471 . . . . 10.0 110.271 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -105.33 0.58 27.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.507 -0.769 . . . . 10.0 109.9 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.57 154.86 41.08 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.76 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -69.59 -24.71 63.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.256 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 10.1 tp -59.42 -34.23 72.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.295 -0.411 . . . . 10.0 111.342 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 14.8 mmt -64.38 -16.72 62.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.764 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -82.73 -10.66 58.79 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 17.2 pt -82.15 -8.85 11.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.225 -0.59 . . . . 10.0 110.201 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -84.39 -13.9 50.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.26 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.85 -68.36 0.16 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.419 -0.81 . . . . 10.0 111.954 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 28.1 m -71.52 115.78 11.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.35 -0.386 . . . . 10.0 111.233 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -68.45 -19.71 64.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.138 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -38.4 79.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.188 179.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.7 t -63.08 -51.84 66.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.011 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 604' ' ' SER . . . . . 0.426 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 1.2 m -63.08 -34.5 77.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.446 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -63.21 -39.14 97.56 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.138 -0.553 . . . . 10.0 111.756 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 14.1 tpt -70.02 -29.04 66.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.134 0.492 . . . . 10.0 110.267 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 607' ' ' MET . . . . . 0.426 ' O ' ' HE2' ' A' ' 612' ' ' MET . 63.0 mtt -70.66 -21.47 62.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.784 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 608' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 604' ' ' SER . 48.9 mtt180 -73.1 -6.46 45.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.101 0.477 . . . . 10.0 110.409 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -79.97 -4.07 50.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.501 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 31.3 tp -65.75 -39.31 90.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.109 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 109.73 -40.77 2.43 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.916 -0.659 . . . . 10.0 111.458 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 612' ' ' MET . . . . . 0.454 ' CG ' ' HA ' ' A' ' 428' ' ' TYR . 1.7 mpt? 60.63 -106.47 0.26 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.028 0.531 . . . . 10.0 111.677 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.94 109.88 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.326 0 O-C-N 123.666 0.603 . . . . 10.0 111.283 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 614' ' ' PRO . . . . . 0.483 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 37.8 Cg_endo -66.3 85.5 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.61 2.207 . . . . 10.0 112.491 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 162.44 -44.2 0.36 Allowed Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.902 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.43 54.71 3.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.118 0.485 . . . . 10.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -81.47 84.89 6.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.578 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 14.9 tt -86.56 1.87 5.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.936 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 71.75 141.47 0.05 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.435 0.694 . . . . 10.0 111.462 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -147.36 92.89 4.76 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.122 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -61.49 -28.33 83.34 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 123.407 2.738 . . . . 10.0 114.115 -178.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 37.8 p-90 -61.0 -25.3 66.79 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 111.852 0.316 . . . . 10.0 111.852 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.94 -50.12 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.725 0.298 . . . . 10.0 110.232 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 68.0 m -59.6 -38.5 81.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.859 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -63.84 -39.54 94.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.862 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -69.57 -43.61 72.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.175 179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.13 -44.02 99.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.585 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -61.28 -40.4 94.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.596 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -66.21 -45.04 82.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.199 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -61.67 -46.64 88.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.993 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 631' ' ' GLN . . . . . 0.415 ' HB3' ' HB2' ' A' ' 565' ' ' ARG . 56.5 mt-30 -58.83 -43.15 90.63 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.961 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 51.2 mtp85 -71.08 -33.85 70.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.279 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -63.29 -38.79 92.52 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.007 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 69.6 t -58.63 -47.67 88.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.241 178.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -73.21 -23.5 60.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.704 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.0 m -67.66 -29.65 69.0 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -78.12 -32.63 50.56 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.846 -1.07 . . . . 10.0 108.526 177.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -60.3 -49.92 75.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.128 -0.942 . . . . 10.0 109.802 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 639' ' ' PHE . . . . . 0.443 ' CD1' ' HG2' ' A' ' 400' ' ' GLU . 32.2 t80 -56.62 -38.22 71.79 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.56 179.087 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 640' ' ' ASP . . . . . 0.462 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 32.4 t70 -59.34 -35.49 73.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.602 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 24.9 mt -82.75 -38.97 15.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.119 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 642' ' ' ARG . . . . . 0.492 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 5.5 mtm180 -61.03 -39.16 88.72 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.666 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 643' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 18.8 pttm -66.31 -25.32 66.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.016 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 644' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 15.8 mm100 -66.95 -39.65 87.33 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.621 -0.511 . . . . 10.0 109.621 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 33.1 mt -66.94 -39.69 87.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.629 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 646' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 46.9 mt -63.42 -35.55 80.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.733 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 647' ' ' GLU . . . . . 0.408 ' CD ' ' HZ3' ' A' ' 804' ' ' LYS . 3.0 mm-40 -63.62 -24.11 67.66 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.115 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 648' ' ' TYR . . . . . 0.407 ' CZ ' ' HG3' ' A' ' 800' ' ' LYS . 48.1 m-85 -97.28 -39.95 8.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.132 0.491 . . . . 10.0 110.979 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -75.21 -27.02 59.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.713 0.634 . . . . 10.0 112.713 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 650' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 5.4 t0 -68.16 -21.56 64.89 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.216 0.531 . . . . 10.0 110.368 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 17.8 t -68.23 -49.45 66.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -68.49 -25.51 65.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.054 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -61.5 -54.24 45.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 10.0 111.043 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -61.9 -42.98 99.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.912 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -64.89 -38.66 91.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.652 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 14.0 ttp-105 -65.25 -45.88 82.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.788 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -61.35 -40.28 93.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.487 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.4 -54.18 36.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.764 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.2 tp -67.09 -35.29 74.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 116.64 -0.255 . . . . 10.0 111.603 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -64.27 -41.71 96.78 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 110.356 -0.239 . . . . 10.0 110.356 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 15.0 t -61.9 -50.3 72.73 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -57.56 -45.95 84.53 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.779 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 19.3 ttt-85 -62.19 -36.98 83.56 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.931 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -74.36 -37.12 63.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.754 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.01 -41.44 96.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 10.0 110.65 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 77.2 mt -83.15 -5.03 58.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.393 0.616 . . . . 10.0 110.499 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 52.1 tp -91.26 -47.19 7.64 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.351 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -65.69 -41.26 92.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.502 -0.772 . . . . 10.0 112.046 -179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 34.0 m -73.35 145.59 11.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.9 0.381 . . . . 10.0 111.302 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.66 -27.17 29.28 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.974 0.416 . . . . 10.0 110.055 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -81.48 -178.04 6.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.486 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 7.4 p -179.82 -24.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.392 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -37.29 63.59 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.412 -0.813 . . . . 10.0 111.329 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.96 -53.98 52.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.641 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.55 -41.92 99.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.837 -0.619 . . . . 10.0 110.564 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 29.5 mm -57.91 -51.44 70.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.663 -0.698 . . . . 10.0 111.56 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 -68.68 -32.2 71.85 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 49.8 m -65.8 -49.63 67.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.741 0.305 . . . . 10.0 110.548 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 42.8 pt -73.83 -21.49 18.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 120.826 -0.35 . . . . 10.0 111.084 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 49.2 ttm-85 -59.58 -38.67 81.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.795 0.331 . . . . 10.0 110.536 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.99 -34.85 79.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.82 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -80.39 -41.95 23.71 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.457 -178.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 64.7 t -59.63 -47.6 90.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-O 120.941 0.4 . . . . 10.0 110.76 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -64.71 -38.52 91.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.07 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.1 tttm -59.95 -51.48 69.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.504 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.85 -36.86 77.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.232 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 25.8 m -68.81 -43.73 75.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.702 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.4 mt -66.74 -47.24 83.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.412 . . . . 10.0 110.394 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -58.32 -24.46 59.72 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.915 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -74.06 -18.28 60.85 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 691' ' ' TYR . . . . . 0.429 ' OH ' ' HD3' ' A' ' 709' ' ' ARG . 97.5 m-85 -122.53 -25.82 4.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.937 0.399 . . . . 10.0 111.071 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 51.4 mt -126.06 102.46 27.74 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.866 -0.607 . . . . 10.0 109.701 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -60.99 132.49 42.3 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.499 2.132 . . . . 10.0 111.594 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -44.3 104.92 0.06 OUTLIER 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 123.654 2.903 . . . . 10.0 113.653 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 53.75 80.98 0.1 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.008 -0.996 . . . . 10.0 111.802 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 8.8 p -137.27 -163.1 1.37 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.98 -0.554 . . . . 10.0 110.604 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 5.1 mt -78.05 128.79 34.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.278 179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . 0.574 ' HA ' ' CD2' ' A' ' 701' ' ' TRP . 11.4 pm0 -55.57 -28.14 53.29 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.41 -22.52 61.85 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.074 0.464 . . . . 10.0 110.59 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 22.9 ttt -92.87 11.24 27.86 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.181 0.515 . . . . 10.0 110.797 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 701' ' ' TRP . . . . . 0.574 ' CD2' ' HA ' ' A' ' 698' ' ' GLU . 53.8 m0 -97.77 126.18 42.99 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.227 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -85.38 79.44 9.47 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 703' ' ' ILE . . . . . 0.507 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.3 mm -62.16 -50.39 80.34 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.318 -0.855 . . . . 10.0 111.461 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 704' ' ' PRO . . . . . 0.507 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 35.6 Cg_exo -58.24 -46.11 27.11 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.886 1.724 . . . . 10.0 112.189 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -61.03 -44.64 97.94 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.007 -0.616 . . . . 10.0 112.583 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 40.0 tp -66.73 -42.63 85.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.511 0.196 . . . . 10.0 111.053 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -60.6 -50.9 71.65 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.473 -0.33 . . . . 10.0 110.651 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -62.92 -37.22 86.14 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.573 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . 0.429 ' HD3' ' OH ' ' A' ' 691' ' ' TYR . 7.1 tpt180 -61.48 -48.64 80.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.502 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 89.4 mt -63.28 -35.59 80.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.292 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -70.49 -41.4 72.75 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.266 0.469 . . . . 10.0 112.266 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -85.31 -44.15 13.08 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 113.051 0.76 . . . . 10.0 113.051 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.36 -34.59 25.58 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.444 0.905 . . . . 10.0 113.444 -176.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -115.97 -1.26 12.56 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.735 1.013 . . . . 10.0 113.735 -177.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 33.0 t70 60.72 35.0 19.8 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.672 0.749 . . . . 10.0 109.952 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 13.8 tp -123.2 108.1 12.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.136 -179.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -90.92 103.69 16.37 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.109 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 80.6 mt -122.16 123.84 27.1 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.897 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 719' ' ' PRO . . . . . 0.437 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 87.8 Cg_endo -82.08 70.5 7.08 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.762 2.308 . . . . 10.0 111.233 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 91.7 mt -56.42 -39.6 62.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.295 -0.866 . . . . 10.0 111.649 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -58.49 -47.95 82.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.606 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 722' ' ' GLU . . . . . 0.437 ' HB2' ' HB2' ' A' ' 719' ' ' PRO . 27.0 mm-40 -64.92 -34.59 78.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.428 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -63.19 -49.95 72.22 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.972 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 35.6 tp -75.74 -24.79 56.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.063 0.459 . . . . 10.0 110.736 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -69.17 -50.92 43.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.846 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -81.25 -34.54 32.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.13 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -119.44 90.29 42.21 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.617 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -70.39 -15.68 34.77 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.116 1.877 . . . . 10.0 111.63 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -72.49 -7.88 52.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.303 -0.862 . . . . 10.0 110.918 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.92 -35.56 80.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.301 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 731' ' ' HIS . . . . . 0.414 ' HB3' ' H ' ' A' ' 732' ' ' GLU . 7.0 t-80 51.92 -102.18 0.12 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.426 -0.807 . . . . 10.0 111.066 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 732' ' ' GLU . . . . . 0.414 ' H ' ' HB3' ' A' ' 731' ' ' HIS . 0.0 OUTLIER -141.64 -53.07 0.44 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.017 0.437 . . . . 10.0 110.465 -179.733 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -56.26 -48.7 76.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.637 -0.71 . . . . 10.0 111.385 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 2.4 m -66.25 -28.4 68.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.239 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 48.1 tp -66.46 -41.95 88.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.462 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 55.9 mtt-85 -60.82 -39.65 89.78 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.815 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -60.75 -42.79 98.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.604 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 7.6 mmm-85 -64.45 -43.41 94.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.561 -0.745 . . . . 10.0 111.388 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 94.1 mt -62.7 -48.71 86.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.976 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 34.3 tp -64.42 -46.23 84.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.054 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.71 88.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 10.0 111.433 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -66.06 -36.06 82.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.554 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 54.1 p -63.79 -37.72 88.41 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.814 0.34 . . . . 10.0 110.2 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 744' ' ' ILE . . . . . 0.413 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 30.6 mt -72.58 -38.21 58.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.079 -0.51 . . . . 10.0 109.882 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -58.97 -49.66 77.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.131 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 60.3 t -66.57 -36.07 76.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.102 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -60.08 -48.2 82.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.414 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 748' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 27.2 mt-30 -60.61 -40.82 93.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.806 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 749' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 749' ' ' ARG . 19.8 ttp-105 -63.05 -43.39 98.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.349 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -70.09 -37.33 75.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.134 0.492 . . . . 10.0 109.988 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.9 -42.08 98.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.64 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -62.33 -19.95 63.85 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.235 0.458 . . . . 10.0 112.235 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.6 t -82.99 -43.58 18.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.131 0.491 . . . . 10.0 110.68 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 17.4 t -81.84 -37.49 15.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.244 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 119.81 134.25 4.75 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 110.706 -0.957 . . . . 10.0 110.706 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 756' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -54.03 -59.58 4.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.727 0.299 . . . . 10.0 111.789 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 26.3 mp0 -63.51 -36.13 82.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.085 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 16.1 tpt -65.15 -41.46 94.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.688 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 47.3 mmm -62.18 -40.22 95.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.727 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -59.58 -39.62 84.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.367 0.604 . . . . 10.0 110.027 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -70.59 -36.93 73.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.677 -0.692 . . . . 10.0 109.735 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -66.5 -47.56 72.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.294 -0.866 . . . . 10.0 110.245 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -58.15 -45.33 87.61 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.39 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -60.9 -45.54 94.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.385 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.34 -47.25 90.92 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 121.086 -0.578 . . . . 10.0 112.454 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.28 -44.41 95.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.703 0.287 . . . . 10.0 110.556 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -56.83 -50.4 72.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.119 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.28 -45.94 91.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.579 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.98 -44.25 96.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.591 -0.277 . . . . 10.0 110.979 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 11.1 m -62.64 -38.91 92.1 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.478 -0.328 . . . . 10.0 110.557 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 17.8 mt -59.87 -52.1 66.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.519 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -61.86 -42.02 98.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.718 -0.674 . . . . 10.0 111.303 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 44.1 m -58.95 -54.21 49.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.561 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 6.1 mp -67.7 -27.66 67.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.669 -0.242 . . . . 10.0 111.366 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 15.5 t-105 -62.53 -41.75 99.07 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.527 ' HZ1' ' HB3' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -61.12 -47.31 86.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.685 -0.688 . . . . 10.0 109.628 178.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 777' ' ' GLU . . . . . 0.403 ' CD ' ' HZ2' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -55.93 -42.62 76.4 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.205 179.537 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 778' ' ' HIS . . . . . 0.647 ' O ' ' HG2' ' A' ' 782' ' ' MET . 59.2 t60 -65.01 -46.46 81.27 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.445 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.6 mt -59.57 -46.42 88.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.873 0.368 . . . . 10.0 111.01 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.54 90.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.766 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.99 -34.38 76.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.623 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 782' ' ' MET . . . . . 0.647 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 97.3 mmm -58.0 -50.95 71.63 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.176 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 783' ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 8.1 t70 -73.24 -36.3 66.39 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-O 120.651 0.262 . . . . 10.0 110.417 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -56.98 -36.87 70.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.605 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 57.3 tp -88.62 -30.93 18.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.499 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -56.76 -45.96 81.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.683 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 787' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 10.0 pt20 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.158 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo . . . . . 0 CA--C 1.529 0.253 0 N-CA-C 113.321 0.47 . . . . 10.0 113.321 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 800' ' ' LYS . . . . . 0.473 ' NZ ' ' HB2' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -67.97 -43.5 78.83 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 -179.755 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -64.21 -39.36 93.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.526 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.36 -46.53 79.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.929 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 803' ' ' TYR . . . . . 0.404 ' CD2' ' HD1' ' A' ' 648' ' ' TYR . 72.6 t80 -59.29 -38.92 81.42 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.125 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 804' ' ' LYS . . . . . 0.408 ' HZ3' ' CD ' ' A' ' 647' ' ' GLU . 85.2 mttt -59.24 -46.12 89.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.931 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 34.8 mtm105 -58.9 -46.93 86.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.236 0.541 . . . . 10.0 110.077 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -59.42 -43.86 92.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.563 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 14.3 m -67.36 -38.78 85.34 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.446 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -67.21 -41.04 86.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.732 0.301 . . . . 10.0 110.4 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 10.9 m -65.77 -39.35 90.92 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 22.9 ttm -63.73 -34.9 78.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.278 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -69.54 -45.72 68.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.543 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.8 -50.55 71.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.972 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -60.1 -32.38 70.93 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.074 0.464 . . . . 10.0 110.861 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 40.8 ttp -65.64 -49.22 69.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.029 179.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.26 -40.57 94.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 816' ' ' GLU . . . . . 0.419 ' HA ' ' HE2' ' A' ' 819' ' ' LYS . 34.6 mm-40 -61.11 -41.88 97.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.083 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 4.8 m -75.78 -28.34 58.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.569 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 31.0 tp -61.08 -60.38 3.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.857 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 819' ' ' LYS . . . . . 0.419 ' HE2' ' HA ' ' A' ' 816' ' ' GLU . 44.7 pttt -59.16 -32.97 70.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.692 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -62.82 -57.41 10.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.679 -0.692 . . . . 10.0 111.31 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -65.39 -34.11 77.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.911 -178.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 822' ' ' VAL . . . . . 0.404 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 39.6 t -58.62 -53.27 49.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.712 0.291 . . . . 10.0 110.511 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 33.9 mm -64.66 -39.76 86.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.535 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 36.2 m -62.37 -50.64 70.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.05 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 29.0 m -58.26 -41.77 85.0 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 111.961 0.356 . . . . 10.0 111.961 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 826' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 98.9 mt -65.55 -23.98 67.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.936 0.398 . . . . 10.0 111.343 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 4.5 m -95.34 -21.19 18.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.365 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -74.49 -9.92 59.05 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.565 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.4 p -56.97 125.79 13.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 121.198 0.523 . . . . 10.0 110.439 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -104.7 115.71 30.79 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.193 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 3.4 m . . . . . 0 C--N 1.321 -0.637 0 CA-C-N 115.322 -0.854 . . . . 10.0 109.089 179.267 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 109.813 -0.44 . . . . 10.0 109.813 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -137.77 144.48 41.62 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.848 0.356 . . . . 10.0 110.191 179.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 114.52 137.27 6.42 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 121.102 -0.57 . . . . 10.0 111.853 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.88 128.2 20.51 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.028 0.442 . . . . 10.0 111.223 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.479 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 1.2 mmp_? -63.19 142.76 58.26 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.668 -0.696 . . . . 10.0 111.492 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.428 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 0.9 OUTLIER 71.89 -81.99 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.302 -0.863 . . . . 10.0 112.232 179.129 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -49.65 -66.16 0.44 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.92 0.711 . . . . 10.0 112.92 -178.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 19' ' ' ARG . 7.8 ttm105 -71.02 -27.63 63.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.679 0.276 . . . . 10.0 111.454 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.9 m -61.88 -38.08 86.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.371 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 14' ' ' ASN . 90.1 mt -59.55 -49.83 76.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.678 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 16' ' ' ARG . 26.8 ptt-85 -75.62 -29.34 59.17 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.813 -0.355 . . . . 10.0 111.383 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -63.93 -40.68 97.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.094 0.473 . . . . 10.0 109.736 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.437 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -68.49 -35.46 77.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.124 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.7 tpp180 -61.26 -35.62 77.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.617 -0.72 . . . . 10.0 110.783 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.89 -40.82 85.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.654 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.0 t -74.78 -39.81 46.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.448 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.8 t -57.57 -37.92 61.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.658 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -62.64 -44.73 95.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.498 . . . . 10.0 110.206 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.1 mt -60.77 -45.11 98.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.345 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 61.9 mt -59.56 -43.16 90.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.513 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -66.68 -33.18 75.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.488 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.488 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -76.81 -34.11 57.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.155 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 16.4 ttt -83.18 -9.66 59.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.361 -0.382 . . . . 10.0 111.295 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.422 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 19.3 tt0 -58.72 -51.74 79.67 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-O 119.39 -0.338 . . . . 10.0 111.885 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.488 ' HD2' ' O ' ' A' ' 30' ' ' ALA . 60.3 Cg_exo -53.87 -33.37 71.3 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.082 1.854 . . . . 10.0 111.772 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -71.37 -39.54 71.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.275 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 20.0 mmt -65.73 -33.59 76.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.621 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -66.5 -14.02 61.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.057 0.456 . . . . 10.0 110.813 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -94.81 -8.09 38.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.362 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.9 mp -88.45 142.0 28.07 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.675 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 p -75.15 167.07 22.62 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.725 0.297 . . . . 10.0 110.529 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.83 -42.98 90.52 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.384 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.402 ' CD ' ' HZ3' ' A' ' 44' ' ' LYS . 52.5 mm-40 -69.8 -19.7 63.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.507 -0.315 . . . . 10.0 111.423 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -75.43 -36.76 60.72 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 110.293 -0.262 . . . . 10.0 110.293 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.7 mt -61.79 -41.41 97.7 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.402 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 35.2 ttmt -64.74 -35.11 80.01 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.58 -1.191 . . . . 10.0 109.416 178.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.63 -28.83 70.36 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.341 -0.845 . . . . 10.0 112.295 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -71.83 -37.19 70.36 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 33.1 m -60.87 -45.25 95.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 10.0 109.959 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.62 -33.09 73.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.011 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -63.34 -43.62 97.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.573 -0.74 . . . . 10.0 110.304 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.7 m-30 -61.38 -37.26 82.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.284 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 9.4 tpp180 -60.54 -45.4 93.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.729 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.57 -44.3 74.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.896 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 -61.09 -37.11 81.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.279 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.0 mt -59.93 -38.04 81.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.389 -0.368 . . . . 10.0 111.077 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -86.56 -14.34 43.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.066 0.46 . . . . 10.0 110.706 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -77.69 -52.57 8.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.71 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 157.45 45.93 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.398 -0.819 . . . . 10.0 111.594 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -117.63 139.01 51.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.706 0.289 . . . . 10.0 110.338 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 42.6 t -85.51 138.66 18.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.813 -0.439 . . . . 10.0 109.813 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.446 HD12 ' O ' ' A' ' 118' ' ' LEU . 22.6 tp -57.74 -45.0 86.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.985 0.421 . . . . 10.0 110.836 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 25.7 mp0 -64.7 -16.97 63.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.835 -0.62 . . . . 10.0 111.433 179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -91.95 -14.7 29.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.07 0.462 . . . . 10.0 110.298 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.2 mt -87.61 -8.91 55.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.144 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.463 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 69.8 mt -50.16 -50.92 66.97 Favored Pre-proline 0 CA--C 1.543 0.699 0 N-CA-C 113.387 0.884 . . . . 10.0 113.387 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.463 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.7 Cg_exo -52.05 -48.39 21.85 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 122.251 1.967 . . . . 10.0 113.199 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -77.04 -43.99 32.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.621 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.15 -51.6 69.31 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.184 0.438 . . . . 10.0 112.184 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -63.74 -32.38 73.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.661 0.267 . . . . 10.0 111.178 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.23 -43.37 91.64 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.855 -0.424 . . . . 10.0 109.855 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.9 t -62.36 -43.05 97.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.127 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 46.2 t -62.01 -44.32 98.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.565 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.413 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 9.8 ttm180 -62.02 -40.87 97.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.393 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -67.57 -52.9 33.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.267 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.72 -41.72 77.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.712 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.1 m -62.59 -31.38 72.19 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -179.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -72.46 -20.43 61.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.662 0.268 . . . . 10.0 111.195 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -100.55 -27.53 13.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.826 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 90.1 t -89.82 -51.45 12.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.688 0.28 . . . . 10.0 111.725 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -104.84 -26.88 12.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.041 0.448 . . . . 10.0 111.124 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 85.66 11.67 73.82 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.862 -0.685 . . . . 10.0 111.499 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 68.3 mtt -112.2 122.02 46.57 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.803 0.335 . . . . 10.0 110.603 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 -84.03 134.32 34.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.111 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -70.38 115.66 9.82 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -60.97 156.21 18.19 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.369 0.418 . . . . 10.0 111.254 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -60.12 -37.14 79.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.144 -179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.3 m -65.13 -32.28 57.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.902 0.382 . . . . 10.0 110.57 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -73.77 -33.54 64.3 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.079 -0.509 . . . . 10.0 109.74 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.56 -39.03 92.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.57 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.8 mt -62.2 -53.05 60.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.198 179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.76 -45.95 95.18 Favored Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 115.745 -0.661 . . . . 10.0 112.444 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.22 -32.49 82.78 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.284 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.437 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 25.9 ttm -71.88 -38.95 69.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.826 0.346 . . . . 10.0 110.343 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 90.7 t -67.6 -30.96 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.398 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.0 mt -69.2 -3.67 14.57 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.675 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -83.26 -20.85 33.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.527 0.68 . . . . 10.0 109.369 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -93.39 -162.92 0.98 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.538 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.7 ttt180 -107.38 58.64 0.62 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.56 -0.904 . . . . 10.0 108.56 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 3.1 m -130.58 164.52 24.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.295 -0.866 . . . . 10.0 111.224 -178.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.4 mm -109.88 127.36 66.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.692 -0.685 . . . . 10.0 109.24 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.83 127.94 53.84 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.995 0.369 . . . . 10.0 111.995 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -82.07 124.49 29.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.64 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 19.0 ttm -120.03 124.32 45.59 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.76 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.574 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 8.8 mmm180 -70.24 152.33 44.34 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.675 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.05 106.12 1.53 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.788 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 124.74 -18.96 7.08 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.618 -0.801 . . . . 10.0 113.884 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.642 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 10.2 mm-40 -58.82 -41.47 86.92 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 117.112 0.456 . . . . 10.0 112.095 -178.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.48 85.87 1.28 Allowed Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.523 -0.846 . . . . 10.0 112.324 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -65.43 -47.76 75.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.7 0.286 . . . . 10.0 111.551 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 55.7 m -63.55 -29.27 70.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.914 0.387 . . . . 10.0 111.559 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.2 tp -87.4 6.92 31.39 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.956 0.408 . . . . 10.0 111.154 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 40.8 m -120.83 -43.09 2.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.877 0.37 . . . . 10.0 110.597 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.67 -15.63 63.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.405 0.521 . . . . 10.0 112.405 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.6 -21.83 61.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.821 0.343 . . . . 10.0 111.921 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 11.6 mt -74.43 -57.57 2.09 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.58 -28.22 69.82 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 122.005 1.803 . . . . 10.0 112.156 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -64.96 -50.28 67.02 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.505 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -61.87 -44.37 96.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.952 0.405 . . . . 10.0 110.797 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.446 ' O ' HD12 ' A' ' 60' ' ' LEU . 49.6 tp -59.47 -54.31 48.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.83 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -71.0 -22.8 62.12 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.024 -0.27 . . . . 10.0 111.629 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.485 ' HB3' ' HB3' ' A' ' 173' ' ' ASP . . . -67.43 -27.71 67.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.817 0.342 . . . . 10.0 111.121 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 73.7 mt -60.17 -25.16 65.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.605 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.3 p -71.66 -20.46 61.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.018 0.437 . . . . 10.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.47 6.39 76.0 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.161 -0.542 . . . . 10.0 112.986 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 46.2 mmtt -79.2 -24.22 43.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.921 0.36 . . . . 10.0 110.778 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 106.05 117.01 4.24 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.629 -0.796 . . . . 10.0 113.559 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 74.1 t -87.82 115.05 27.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.1 m170 -94.03 101.39 13.43 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.084 0.468 . . . . 10.0 111.17 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 40.7 t -89.94 122.75 41.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.924 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.2 t -101.84 119.98 50.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.669 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.05 158.0 18.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.674 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.4 m -72.3 -31.12 37.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.977 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -145.79 172.04 13.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.584 0.231 . . . . 10.0 110.922 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -73.96 -26.81 60.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.198 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -58.67 -58.68 7.52 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.665 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.28 -35.6 80.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.912 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.58 -50.07 74.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.107 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.64 -25.3 49.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.879 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -66.22 -60.29 2.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.754 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.58 -29.63 69.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.057 -0.519 . . . . 10.0 111.475 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.52 -49.77 76.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.82 0.343 . . . . 10.0 111.237 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -79.36 -27.86 41.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.151 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . 0.409 ' O ' ' HD2' ' A' ' 145' ' ' PRO . 8.2 t30 -71.55 -45.42 62.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.298 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -86.68 -3.26 59.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.209 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.481 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 59.6 ttm-85 -59.81 -50.08 88.42 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 24.5 Cg_exo -64.56 -5.22 9.7 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 122.201 1.934 . . . . 10.0 112.701 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 23.9 tp -96.7 -54.65 3.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.955 0.407 . . . . 10.0 110.224 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -67.81 -44.34 77.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.265 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.457 ' HA ' ' O ' ' A' ' 152' ' ' LEU . 3.7 mt-10 -70.69 -16.7 62.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.918 0.389 . . . . 10.0 111.135 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.445 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 73.3 t80 -73.03 -27.43 61.76 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.422 0.629 . . . . 10.0 109.588 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 30.5 mt -95.55 -8.03 36.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.206 -0.907 . . . . 10.0 110.94 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 112.96 -14.85 23.8 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.559 -0.829 . . . . 10.0 113.454 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 148' ' ' GLU . 85.3 mt -71.41 156.27 39.67 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.951 0.405 . . . . 10.0 111.021 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 16.2 p -107.51 136.41 47.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.336 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 45.1 t -110.27 122.4 64.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.135 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -117.31 139.34 14.91 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 121.119 -0.562 . . . . 10.0 112.002 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 5.5 tp -112.89 130.45 66.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.05 0.452 . . . . 10.0 110.688 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -115.57 107.35 15.03 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.003 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 94.0 mt -102.36 145.44 30.52 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.495 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' PRO . . . . . 0.414 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 19.7 Cg_endo -59.02 113.94 1.79 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.612 2.208 . . . . 10.0 112.049 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 105.81 0.45 39.35 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.801 -0.714 . . . . 10.0 112.433 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' MET . . . . . 0.586 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 39.4 ttm -66.22 137.87 95.79 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 110.396 -0.224 . . . . 10.0 110.396 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.97 152.38 71.43 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.491 2.128 . . . . 10.0 112.371 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -53.45 -47.39 96.45 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.862 0.69 . . . . 10.0 112.862 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -52.26 -49.42 17.46 Favored 'Trans proline' 0 C--N 1.361 1.218 0 C-N-CA 121.831 1.687 . . . . 10.0 112.645 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.59 -38.06 86.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.088 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.586 ' HE2' ' O ' ' A' ' 161' ' ' MET . 59.1 mttm -59.92 -45.09 93.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.48 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -59.62 -35.32 74.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.845 -0.616 . . . . 10.0 111.124 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -70.15 -39.0 75.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.052 0.453 . . . . 10.0 110.422 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -73.6 -38.43 65.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.74 -0.663 . . . . 10.0 111.551 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -74.9 -25.2 58.76 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.524 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -84.34 -1.84 56.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.114 0.483 . . . . 10.0 110.712 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -79.9 168.35 19.35 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.45 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . 0.485 ' HB3' ' HB3' ' A' ' 120' ' ' ALA . 18.3 m-20 -71.04 -40.59 71.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.16 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.2 mp -127.01 127.23 69.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.168 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 5.2 m -117.33 125.37 50.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.884 0.373 . . . . 10.0 111.244 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -103.28 129.57 50.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -165.95 172.15 41.27 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.103 -1.046 . . . . 10.0 113.171 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.95 151.84 19.69 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.466 -0.198 . . . . 10.0 110.466 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -61.57 -36.42 80.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.755 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -58.26 -54.91 41.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.255 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . 0.414 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.7 tp10 -67.72 -35.71 79.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.959 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -55.03 -40.99 70.8 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.385 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -74.68 -40.97 36.32 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.008 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -63.92 -39.28 93.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.75 0.31 . . . . 10.0 110.573 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . 0.437 ' CG ' ' HZ3' ' A' ' 166' ' ' LYS . 19.6 m-20 -60.86 -41.98 96.97 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.98 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -62.73 -39.62 94.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.197 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 75.3 mt -66.86 -45.95 76.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.883 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 68.5 mtm-85 -63.82 -38.54 91.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.888 0.375 . . . . 10.0 110.969 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -64.45 -46.39 83.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.616 -0.72 . . . . 10.0 111.087 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -73.24 -20.98 60.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.622 -0.717 . . . . 10.0 112.064 -178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 22.9 ttp -99.87 26.57 6.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.112 0.482 . . . . 10.0 110.9 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -87.89 161.53 17.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.537 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -102.56 -29.06 11.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.083 0.468 . . . . 10.0 110.484 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.09 140.56 31.24 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.02 -26.28 81.98 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.693 2.262 . . . . 10.0 112.638 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -75.62 -11.09 59.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.542 -0.299 . . . . 10.0 111.305 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.78 -13.81 58.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.629 -0.26 . . . . 10.0 110.672 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' ARG . . . . . 0.444 HH11 ' HD2' ' A' ' 198' ' ' ARG . 35.1 mtt180 -53.45 155.23 3.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.951 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 14.7 m -130.93 -20.81 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.374 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -89.31 -179.09 5.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.753 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -133.44 -79.87 0.48 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.534 -0.303 . . . . 10.0 110.974 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 19.5 ttmm -151.93 142.27 22.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.8 0.334 . . . . 10.0 110.562 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 9.9 mt -93.04 60.41 3.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.343 0.592 . . . . 10.0 109.752 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -81.01 -56.71 3.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.623 -0.717 . . . . 10.0 112.285 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -132.69 137.36 46.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.033 0.445 . . . . 10.0 111.623 -178.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.472 ' HB3' ' CD1' ' A' ' 384' ' ' TYR . . . -134.01 129.43 36.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.427 -0.806 . . . . 10.0 109.741 178.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 55.0 tp -124.07 108.49 12.4 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.176 -0.465 . . . . 10.0 109.808 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -96.82 132.1 42.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.184 0.516 . . . . 10.0 111.254 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -60.98 -53.84 52.29 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.368 -0.833 . . . . 10.0 112.352 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' GLU . . . . . 0.531 ' HB2' HH21 ' A' ' 509' ' ' ARG . 34.4 tt0 -123.97 108.3 12.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.005 0.431 . . . . 10.0 111.027 -179.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.47 -21.11 8.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.6 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.77 -34.56 59.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.703 -0.68 . . . . 10.0 111.379 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 8.9 p -107.2 -57.16 2.11 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.923 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.66 -37.91 68.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 113.485 0.92 . . . . 10.0 113.485 -177.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 10.9 mt -94.19 -28.79 15.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.773 0.657 . . . . 10.0 112.773 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 40.3 mm -92.1 -63.05 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 112.406 0.521 . . . . 10.0 112.406 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -69.65 -47.47 63.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.857 0.317 . . . . 10.0 111.857 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 218' ' ' GLU . . . . . 0.428 ' HA ' ' OG1' ' A' ' 221' ' ' THR . 6.1 mm-40 -80.3 12.31 3.02 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.682 0.623 . . . . 10.0 112.682 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.92 -42.83 97.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.773 0.32 . . . . 10.0 111.515 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 7.1 mtp-105 -102.39 28.24 6.11 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 221' ' ' THR . . . . . 0.428 ' OG1' ' HA ' ' A' ' 218' ' ' GLU . 4.5 m -96.44 110.29 52.0 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 120.712 0.291 . . . . 10.0 110.232 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -90.54 125.53 1.15 Allowed 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.901 2.401 . . . . 10.0 112.795 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 223' ' ' LEU . . . . . 0.598 ' O ' ' HA ' ' A' ' 374' ' ' SER . 80.8 mt -78.79 90.65 4.67 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.343 -0.614 . . . . 10.0 109.343 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 90.1 mt -88.95 117.49 32.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.801 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 58.7 mt -96.44 113.03 29.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 6.3 m -99.33 76.3 2.04 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.212 0.53 . . . . 10.0 110.395 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -114.89 89.16 0.49 Allowed Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.66 -0.781 . . . . 10.0 112.14 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -78.21 169.86 19.55 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.659 2.239 . . . . 10.0 112.216 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -94.74 -2.11 51.67 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.622 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 367' ' ' ASN . 94.2 mt-10 58.12 -115.15 0.81 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.581 -0.736 . . . . 10.0 111.168 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 13.6 t70 54.58 -130.7 2.06 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 123.552 0.533 . . . . 10.0 110.483 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 7.0 m -147.84 99.96 3.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.952 0.406 . . . . 10.0 110.3 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.09 65.65 7.31 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.179 0.514 . . . . 10.0 110.76 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . 0.443 ' HB3' ' NH1' ' A' ' 238' ' ' ARG . 39.3 mm-40 -67.09 -5.91 15.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.666 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -59.51 -32.05 69.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.175 -0.466 . . . . 10.0 111.239 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.07 -32.99 74.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.624 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 237' ' ' LYS . . . . . 0.41 ' HB2' ' CD1' ' A' ' 365' ' ' ILE . 14.3 ttmt -67.98 -21.13 65.08 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.007 0.432 . . . . 10.0 111.186 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 238' ' ' ARG . . . . . 0.443 ' HD2' ' N ' ' A' ' 238' ' ' ARG . 1.4 mpt_? -79.58 -18.86 50.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.051 0.453 . . . . 10.0 110.091 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 21.3 t -82.2 -47.99 18.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.035 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 240' ' ' ASN . . . . . 0.452 ' ND2' ' HA ' ' A' ' 360' ' ' LYS . 14.3 t30 -69.06 -13.4 62.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.688 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -66.39 -17.42 64.77 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.198 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 12.4 tt -87.93 -16.39 9.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.836 0.35 . . . . 10.0 111.531 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 243' ' ' ILE . . . . . 0.548 ' N ' ' HD2' ' A' ' 244' ' ' PRO . 25.3 mm -67.09 -45.57 52.06 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 113.201 0.815 . . . . 10.0 113.201 -178.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 244' ' ' PRO . . . . . 0.548 ' HD2' ' N ' ' A' ' 243' ' ' ILE . 16.1 Cg_endo -58.77 -6.96 3.8 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 122.426 2.084 . . . . 10.0 113.561 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 19.3 t60 -87.41 -6.06 58.59 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 246' ' ' LEU . . . . . 0.422 HD12 ' CB ' ' A' ' 252' ' ' GLU . 2.8 mt -113.72 168.7 9.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.02 -178.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 51.8 mt -125.72 129.4 72.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.168 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 248' ' ' ARG . . . . . 0.661 ' HA ' ' O ' ' A' ' 253' ' ' ASP . 2.4 ptm180 -67.0 87.21 0.14 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.539 0.685 . . . . 10.0 111.06 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? 179.45 -41.62 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 250' ' ' GLU . . . . . 0.465 ' O ' ' HB2' ' A' ' 251' ' ' LYS . 4.2 mt-10 -160.14 157.25 28.08 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 114.692 -1.14 . . . . 10.0 108.738 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 250' ' ' GLU . 62.4 mttm 71.37 82.23 0.15 Allowed 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.871 0.732 . . . . 10.0 110.671 -179.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 252' ' ' GLU . . . . . 0.723 ' OE2' ' HA ' ' A' ' 282' ' ' ILE . 4.9 mm-40 67.75 -85.94 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.165 0.802 . . . . 10.0 113.165 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 253' ' ' ASP . . . . . 0.661 ' O ' ' HA ' ' A' ' 248' ' ' ARG . 43.8 t0 -53.35 104.87 0.11 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.97 0.414 . . . . 10.0 111.93 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 73.7 m -165.28 123.88 1.67 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.754 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . 0.424 ' CD ' HH21 ' A' ' 248' ' ' ARG . 1.0 OUTLIER -73.94 89.2 1.88 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.189 0.519 . . . . 10.0 110.434 179.273 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 5.8 m 74.75 -64.1 0.4 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.244 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 9.8 t80 64.24 -86.68 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.299 0.64 . . . . 10.0 111.508 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 56.94 34.15 24.4 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.876 0.369 . . . . 10.0 111.138 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 93.59 -45.94 2.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.808 -0.71 . . . . 10.0 112.435 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -129.25 -76.73 0.55 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.949 0.404 . . . . 10.0 110.941 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 91.74 -71.71 1.74 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.047 -0.597 . . . . 10.0 111.964 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -165.66 175.24 9.02 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.2 165.14 25.68 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.933 -0.395 . . . . 10.0 109.933 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 2.6 m -77.12 68.9 3.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.027 0.442 . . . . 10.0 111.794 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -146.96 71.34 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.033 -0.53 . . . . 10.0 109.954 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 1.2 t70 56.57 68.49 0.85 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.975 0.893 . . . . 10.0 108.816 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . 0.474 ' H ' ' CD ' ' A' ' 267' ' ' GLU . 0.6 OUTLIER -83.46 23.38 0.94 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.354 -1.294 . . . . 10.0 112.955 -177.318 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 268' ' ' LYS . . . . . . . . . . . . . 3.8 ptpp? -65.11 104.82 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.45 0.643 . . . . 10.0 110.838 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 269' ' ' SER . . . . . 0.492 ' HB3' ' OE1' ' A' ' 271' ' ' GLN . 19.7 m -79.62 85.8 5.31 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.464 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 43.2 mtm180 -77.66 10.95 2.32 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 271' ' ' GLN . . . . . 0.492 ' OE1' ' HB3' ' A' ' 269' ' ' SER . 4.2 pm0 -90.79 8.68 33.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.392 0.615 . . . . 10.0 109.785 178.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 13.9 t 63.45 -101.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.129 0 CA-C-N 114.963 -1.017 . . . . 10.0 110.812 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 65.57 -78.18 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.224 0.61 . . . . 10.0 112.13 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 63.6 mt 71.25 141.44 0.05 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.726 0.641 . . . . 10.0 109.983 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 3.7 m -152.14 -75.14 0.14 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.416 0.895 . . . . 10.0 113.416 -178.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.91 68.1 0.71 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 -176.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.39 14.95 13.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.346 -0.843 . . . . 10.0 110.877 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . -94.63 -33.79 6.59 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.878 -0.889 . . . . 10.0 110.878 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 64.54 26.87 13.39 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.382 0.611 . . . . 10.0 110.341 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 10.9 p -124.78 -15.55 4.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.424 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 64.5 mt -87.89 -43.77 11.56 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 282' ' ' ILE . . . . . 0.723 ' HA ' ' OE2' ' A' ' 252' ' ' GLU . 19.8 tt -60.4 -21.36 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.489 -0.778 . . . . 10.0 111.024 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -68.36 -9.53 48.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.606 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -87.9 -28.95 21.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.584 -0.28 . . . . 10.0 110.906 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.37 -44.89 20.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.96 0.409 . . . . 10.0 109.971 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 26.9 mt -65.1 152.62 43.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.585 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 287' ' ' VAL . . . . . 0.519 ' HA ' ' HA ' ' A' ' 293' ' ' ASP . 26.5 t 71.32 151.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 O-C-N 123.642 0.589 . . . . 10.0 111.543 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 288' ' ' LYS . . . . . 0.514 ' N ' ' HB2' ' A' ' 293' ' ' ASP . 0.0 OUTLIER 74.39 163.03 0.26 Allowed 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.893 0.877 . . . . 10.0 112.099 179.063 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 289' ' ' GLU . . . . . 0.461 ' HA ' ' OE2' ' A' ' 289' ' ' GLU . 2.8 mm-40 73.76 -74.82 0.08 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.094 -0.957 . . . . 10.0 111.54 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 290' ' ' GLY . . . . . 0.517 ' O ' ' HB ' ' A' ' 291' ' ' ILE . . . 156.17 131.57 1.41 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.372 -0.918 . . . . 10.0 112.473 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 291' ' ' ILE . . . . . 0.517 ' HB ' ' O ' ' A' ' 290' ' ' GLY . 1.5 mp 78.23 125.95 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 N-CA-C 108.435 -0.95 . . . . 10.0 108.435 -178.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 292' ' ' MET . . . . . 0.457 ' SD ' HD11 ' A' ' 298' ' ' LEU . 48.1 ttp 69.78 21.03 6.61 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.904 -1.147 . . . . 10.0 107.904 -177.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 293' ' ' ASP . . . . . 0.519 ' HA ' ' HA ' ' A' ' 287' ' ' VAL . 0.7 OUTLIER -125.43 4.3 7.66 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.212 -1.358 . . . . 10.0 110.847 -179.209 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -80.21 -29.63 38.59 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.244 0.545 . . . . 10.0 109.842 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 139.75 15.9 0.53 Allowed Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.306 -0.861 . . . . 10.0 111.892 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -83.01 155.66 23.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.837 0.351 . . . . 10.0 110.734 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.78 153.54 19.38 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 179.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . 0.457 HD11 ' SD ' ' A' ' 292' ' ' MET . 10.5 tp -89.1 -4.56 58.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.963 0.411 . . . . 10.0 111.122 -179.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 12.7 p90 -110.5 40.3 2.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.551 0.691 . . . . 10.0 110.106 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 43.5 m -124.23 148.4 57.7 Favored Pre-proline 0 C--N 1.32 -0.713 0 CA-C-N 115.357 -0.838 . . . . 10.0 109.776 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -60.66 -16.09 41.14 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.82 2.347 . . . . 10.0 112.73 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -92.93 8.33 40.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.146 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -151.49 35.84 0.57 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.344 0.592 . . . . 10.0 110.35 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 8.5 tp -81.95 -25.7 9.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.042 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 305' ' ' MET . . . . . 0.419 ' HG3' ' HG2' ' A' ' 777' ' ' GLU . 8.1 tmm? -66.13 -47.45 74.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.492 -0.322 . . . . 10.0 111.189 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 50.7 mt -68.57 -34.45 75.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.673 0.273 . . . . 10.0 110.553 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 10.5 tpt -57.25 -40.39 77.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.043 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 308' ' ' HIS . . . . . 0.466 ' HE2' ' CG ' ' A' ' 351' ' ' ASP . 5.6 t60 -82.16 -2.05 50.95 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.229 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 43.2 m170 -102.31 -42.24 6.08 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 121.084 -0.246 . . . . 10.0 110.98 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 23.1 m -69.03 -36.51 74.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.84 0.352 . . . . 10.0 111.108 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 3.0 p -67.83 -24.76 65.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.597 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 312' ' ' ALA . . . . . . . . . . . . . . . -65.41 -39.97 92.82 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.176 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -69.08 -33.14 73.06 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.536 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 35.0 tp -69.94 -45.77 66.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.049 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 315' ' ' ARG . . . . . . . . . . . . . 39.8 ptt180 -80.0 18.23 0.86 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.245 0.545 . . . . 10.0 110.866 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -124.78 3.34 8.16 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.459 0.647 . . . . 10.0 109.553 178.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -101.79 -77.69 0.54 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.957 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -88.33 -10.13 50.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.903 0.382 . . . . 10.0 111.275 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.16 -47.32 14.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.571 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -114.06 105.64 13.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.903 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 321' ' ' THR . . . . . 0.57 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 0.2 OUTLIER -84.81 136.79 33.53 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.425 0.631 . . . . 10.0 111.304 -179.314 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 322' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 5.2 tpt180 -66.83 140.7 57.83 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.807 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 323' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 0.5 OUTLIER 78.95 -15.39 0.77 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.157 0.983 . . . . 10.0 113.492 177.372 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 324' ' ' VAL . . . . . 0.57 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 2.6 p -115.86 -44.79 3.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 120.529 -0.468 . . . . 10.0 111.53 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -92.3 -25.45 18.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.335 0.588 . . . . 10.0 110.039 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 37.7 p90 -161.75 154.82 20.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.905 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 17.7 tt -136.71 132.61 48.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.904 0.383 . . . . 10.0 110.238 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 17.5 t -116.25 115.77 50.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.246 -0.65 . . . . 10.0 109.246 179.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 329' ' ' LYS . . . . . 0.416 ' O ' ' HD3' ' A' ' 329' ' ' LYS . 0.0 OUTLIER -124.21 117.47 24.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.822 -179.253 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 59.19 34.06 23.01 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.338 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 88.7 -8.93 78.03 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.661 -0.78 . . . . 10.0 112.845 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -89.08 116.09 27.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.942 0.401 . . . . 10.0 110.27 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 48.1 t -89.05 120.28 37.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.755 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 65.4 mt -124.09 130.48 73.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.953 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 53.4 mt -79.85 131.02 35.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.976 -0.379 . . . . 10.0 109.976 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 41.3 t -105.13 119.06 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.072 0.463 . . . . 10.0 110.241 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -86.5 123.92 32.24 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.312 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -90.27 -6.62 54.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.513 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -81.58 -48.54 11.64 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.032 0.382 . . . . 10.0 112.032 -178.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.99 2.58 8.69 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 69.02 54.41 14.18 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.567 -0.825 . . . . 10.0 111.859 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -114.0 150.91 33.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.64 0.257 . . . . 10.0 110.534 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.65 121.01 41.27 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.946 0.403 . . . . 10.0 111.12 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 49.2 mtt -107.45 99.24 8.77 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.861 -0.422 . . . . 10.0 109.861 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.92 -8.3 40.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.678 -178.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -117.08 30.35 6.34 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.655 -0.784 . . . . 10.0 111.852 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -143.56 149.61 37.65 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.133 -0.321 . . . . 10.0 110.133 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -152.94 132.27 12.83 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.206 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -62.75 120.1 10.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.443 . . . . 10.0 111.334 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.6 m -71.63 -161.46 0.07 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.845 -0.616 . . . . 10.0 111.926 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 351' ' ' ASP . . . . . 0.466 ' CG ' ' HE2' ' A' ' 308' ' ' HIS . 33.7 t70 64.12 23.36 13.17 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.755 0.788 . . . . 10.0 110.403 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 74.38 5.65 73.09 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.554 -0.748 . . . . 10.0 113.537 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 18.5 tp -64.24 -50.18 69.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 117.179 0.489 . . . . 10.0 110.602 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 354' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -61.95 -33.31 74.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.085 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 355' ' ' GLN . . . . . 0.567 ' HA ' ' NE2' ' A' ' 355' ' ' GLN . 0.8 OUTLIER -67.39 -34.9 78.23 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.155 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -66.56 -38.62 87.48 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.165 0.507 . . . . 10.0 110.004 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 85.4 t -68.32 -44.51 83.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.041 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -66.97 -19.31 65.7 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 115.683 -0.69 . . . . 10.0 110.876 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -95.46 -15.45 22.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.224 -0.444 . . . . 10.0 111.252 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 360' ' ' LYS . . . . . 0.452 ' HA ' ' ND2' ' A' ' 240' ' ' ASN . 35.9 ttpt -78.46 -49.07 14.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.269 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -93.11 179.95 5.28 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.4 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -78.46 55.14 4.07 Favored Glycine 0 CA--C 1.517 0.198 0 C-N-CA 121.134 -0.555 . . . . 10.0 112.774 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 2.9 t -108.54 155.2 9.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 110.024 -0.362 . . . . 10.0 110.024 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.27 110.42 11.97 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 365' ' ' ILE . . . . . 0.41 ' CD1' ' HB2' ' A' ' 237' ' ' LYS . 27.8 mt -66.77 130.85 32.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.812 -179.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -84.75 -169.78 2.8 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.608 -0.724 . . . . 10.0 110.17 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 367' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 230' ' ' GLU . 5.5 t-20 -106.11 20.33 19.12 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.123 0.487 . . . . 10.0 110.305 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 60.06 -163.68 0.23 Allowed 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.224 -0.898 . . . . 10.0 111.639 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -159.65 81.91 0.74 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.816 -0.809 . . . . 10.0 108.816 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -123.33 -165.3 1.31 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.601 -179.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 1.7 p -73.4 103.67 4.14 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.14 0.793 . . . . 10.0 113.14 -178.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 5.9 tp -86.33 -30.48 22.19 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.698 -0.853 . . . . 10.0 108.698 177.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -166.07 133.74 2.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.482 -1.235 . . . . 10.0 108.136 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 374' ' ' SER . . . . . 0.598 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 24.3 m -152.4 148.16 27.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.051 0.453 . . . . 10.0 111.769 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 16.7 tt -155.41 139.53 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.504 -0.771 . . . . 10.0 109.977 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.1 143.98 26.76 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -57.21 -41.37 79.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.672 0.272 . . . . 10.0 110.983 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 378' ' ' GLN . . . . . 0.415 ' HA ' ' CE1' ' A' ' 405' ' ' TYR . 1.5 tm0? -59.89 -39.92 86.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.174 0.511 . . . . 10.0 110.359 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -81.71 -0.85 44.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.311 -179.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -102.59 -48.04 4.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.173 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -71.04 -21.58 62.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.123 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -72.43 -12.17 60.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.882 0.372 . . . . 10.0 110.999 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 42.7 mt -84.91 -18.38 34.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.798 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.472 ' CD1' ' HB3' ' A' ' 206' ' ' ALA . 39.0 m-85 -77.03 142.41 39.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.169 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -73.96 -64.31 1.04 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.95 0.405 . . . . 10.0 110.347 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -95.5 98.24 10.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.669 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 52.0 tp -107.41 110.03 21.9 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.072 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -130.21 163.99 25.49 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.206 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.35 168.89 41.97 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.422 -0.894 . . . . 10.0 112.398 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 35.9 mtm -105.75 140.01 39.44 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.211 -0.292 . . . . 10.0 110.211 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 3.4 t -124.27 156.5 36.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -91.22 174.76 38.93 Favored Glycine 0 N--CA 1.441 -0.988 0 C-N-CA 120.622 -0.799 . . . . 10.0 111.599 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 393' ' ' THR . . . . . 0.574 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 1.3 m -74.49 62.95 1.04 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.289 0.566 . . . . 10.0 110.499 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . 0.41 ' HB3' ' HG2' ' A' ' 566' ' ' ARG . . . -113.81 -43.18 3.31 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.474 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 395' ' ' ASP . . . . . 0.462 ' CG ' ' H ' ' A' ' 396' ' ' THR . 35.9 t70 59.66 -126.76 1.19 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 396' ' ' THR . . . . . 0.585 ' HB ' ' OE1' ' A' ' 397' ' ' GLU . 1.8 m 59.07 -93.78 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.77 0.428 . . . . 10.0 112.069 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 397' ' ' GLU . . . . . 0.585 ' OE1' ' HB ' ' A' ' 396' ' ' THR . 3.5 mp0 -75.77 2.28 12.59 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.943 0.401 . . . . 10.0 111.206 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -59.17 -26.09 64.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.65 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 399' ' ' PHE . . . . . 0.416 ' HD1' ' O ' ' A' ' 396' ' ' THR . 16.7 p90 -69.16 -23.06 63.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.969 0.414 . . . . 10.0 110.76 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.44 -13.38 60.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.5 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -59.37 -35.99 74.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.846 0.355 . . . . 10.0 110.558 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 402' ' ' SER . . . . . 0.476 ' O ' ' HA ' ' A' ' 406' ' ' LYS . 2.3 m -78.28 -18.23 55.58 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.656 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.2 m -100.36 -32.2 10.96 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.39 0.515 . . . . 10.0 112.39 -178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 55.4 mt -87.82 -49.58 14.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 111.736 0.273 . . . . 10.0 111.736 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 405' ' ' TYR . . . . . 0.415 ' CE1' ' HA ' ' A' ' 378' ' ' GLN . 96.6 m-85 -112.14 -5.73 14.21 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.994 -0.282 . . . . 10.0 111.654 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 406' ' ' LYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 402' ' ' SER . 3.9 mtpp 62.71 48.64 4.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.825 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 16.6 mt -109.76 152.21 25.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.071 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . 0.479 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 22.3 t0 -93.52 135.22 34.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.506 -0.315 . . . . 10.0 110.318 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.83 118.65 27.5 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.31 -0.405 . . . . 10.0 111.373 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.26 137.43 57.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.294 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 5.1 m -102.32 140.18 21.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.592 0.235 . . . . 10.0 110.619 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 91.2 t -108.44 131.77 21.55 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.63 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.5 152.56 80.57 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.63 2.22 . . . . 10.0 112.278 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 1.5 p -78.71 157.03 28.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.491 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -64.92 -39.27 93.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.359 0.599 . . . . 10.0 109.835 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 -124.45 157.84 63.64 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.563 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.49 122.24 10.08 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.403 2.069 . . . . 10.0 111.793 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 27.6 mtm -72.47 112.02 8.16 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.851 0.358 . . . . 10.0 111.16 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 4.0 mt -103.84 54.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.562 0.696 . . . . 10.0 109.695 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 420' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 420' ' ' ARG . 33.5 ttp180 -98.38 104.2 16.21 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.358 -0.837 . . . . 10.0 109.905 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.86 98.89 2.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.933 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 422' ' ' ASP . . . . . 0.405 ' OD2' ' HD2' ' A' ' 572' ' ' ARG . 26.4 m-20 -84.02 114.66 21.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.765 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 39.5 mt -98.41 155.73 36.53 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.468 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -66.86 176.73 4.11 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.929 2.419 . . . . 10.0 112.878 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -93.03 130.02 38.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.559 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 64.2 mt -101.19 93.64 5.56 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.01 0.433 . . . . 10.0 109.956 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 427' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 588' ' ' LEU . 61.8 t -84.31 125.1 40.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.71 -0.677 . . . . 10.0 111.003 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 428' ' ' TYR . . . . . 0.46 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 4.6 m-85 -114.45 176.73 4.92 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.85 -0.613 . . . . 10.0 109.942 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.2 mmm -78.55 -75.44 0.23 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.13 -0.228 . . . . 10.0 111.195 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 58.3 p -90.63 162.12 15.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.845 0.355 . . . . 10.0 111.353 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -61.95 -32.93 73.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.527 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 436' ' ' GLN . . . -57.32 -42.64 82.25 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.728 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -65.37 -46.94 78.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.277 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 434' ' ' LYS . . . . . 0.404 ' HE3' ' O ' ' A' ' 559' ' ' THR . 4.7 ttpt -58.95 -54.14 50.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.314 -0.857 . . . . 10.0 111.129 -179.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 40.3 mm -60.09 -45.64 95.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.388 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 432' ' ' ALA . 0.2 OUTLIER -60.96 -37.22 81.65 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.218 -179.438 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.98 -36.66 83.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.087 0.47 . . . . 10.0 109.847 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 79.9 mt -65.25 -46.48 90.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.753 178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 42.1 mm -57.51 -41.16 78.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.497 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -66.24 -45.07 81.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.174 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.77 -39.14 87.68 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.13 0.491 . . . . 10.0 110.117 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 71.2 mt -70.83 -49.68 48.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.565 -0.743 . . . . 10.0 111.068 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -54.08 -42.6 69.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.791 -0.641 . . . . 10.0 112.081 -178.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.99 -34.6 78.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.303 0.573 . . . . 10.0 110.684 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.457 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 66.5 mtt-85 -82.19 -17.48 46.06 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.825 -179.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 1.8 m -69.25 -28.35 66.25 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -84.71 -23.66 29.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.656 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -87.36 -14.06 41.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.938 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 79.14 36.78 26.73 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.762 -0.733 . . . . 10.0 112.619 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' GLN . . . . . 0.457 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 63.7 tt0 -105.44 126.42 30.91 Favored Pre-proline 0 C--N 1.324 -0.531 0 O-C-N 122.712 -0.287 . . . . 10.0 110.542 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.87 136.17 44.12 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.535 2.157 . . . . 10.0 111.421 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 91.8 t -119.16 124.76 73.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.356 -0.384 . . . . 10.0 111.392 -178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 52.5 tp -112.21 108.25 17.42 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.965 -0.562 . . . . 10.0 109.544 178.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 12.2 t -90.92 115.27 29.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.169 -0.468 . . . . 10.0 110.418 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -96.46 79.59 0.74 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.867 -0.682 . . . . 10.0 112.294 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 6.4 p -82.43 120.43 25.45 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.386 -0.227 . . . . 10.0 110.386 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 41.9 pt -89.93 -10.28 10.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.086 0.47 . . . . 10.0 110.638 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' SER . . . . . 0.489 ' OG ' ' HB2' ' A' ' 461' ' ' LYS . 25.8 p -116.57 127.01 54.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.506 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 24.2 mt -62.68 -32.95 57.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-O 120.897 0.38 . . . . 10.0 111.02 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -62.88 -33.03 74.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.977 0.418 . . . . 10.0 110.568 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . 0.489 ' HB2' ' OG ' ' A' ' 458' ' ' SER . 0.0 OUTLIER -83.37 -30.66 27.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.769 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 17.5 m -59.32 -46.94 87.22 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.875 0.369 . . . . 10.0 110.697 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.74 -33.61 66.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.858 0.361 . . . . 10.0 110.376 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 46.7 tp -63.39 -53.05 58.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.69 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 8.1 p -63.56 -33.69 63.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.695 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 75.6 m -64.43 -42.22 96.15 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 120.744 0.307 . . . . 10.0 110.442 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -67.54 -40.3 85.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.13 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . 0.459 ' CD ' ' HZ2' ' A' ' 471' ' ' LYS . 8.4 mm-40 -65.57 -41.66 92.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.851 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 51.8 mt -61.75 -36.69 81.75 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.9 0.381 . . . . 10.0 110.477 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.4 m -71.01 -33.45 70.38 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.294 0.569 . . . . 10.0 109.873 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.459 ' HZ2' ' CD ' ' A' ' 468' ' ' GLU . 31.9 ttpt -66.28 -40.36 90.03 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.483 -0.781 . . . . 10.0 110.576 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.94 -21.27 37.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.584 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 89.79 52.82 2.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.709 -0.758 . . . . 10.0 112.489 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 50.0 mt -124.82 127.28 72.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.722 0.296 . . . . 10.0 110.566 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.404 ' O ' ' HB ' ' A' ' 500' ' ' VAL . 50.6 mttm -62.16 138.76 58.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.136 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 45.4 p-80 -156.88 147.54 21.56 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.882 0.372 . . . . 10.0 111.231 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -130.54 119.59 22.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.304 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.7 t -89.59 133.87 30.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.006 0.431 . . . . 10.0 111.408 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 86.4 mt -84.81 83.83 7.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.263 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -78.28 113.45 16.27 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.812 -0.44 . . . . 10.0 109.812 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -62.68 -10.11 11.42 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.897 0.703 . . . . 10.0 112.897 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -81.36 -10.17 59.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.985 0.422 . . . . 10.0 109.992 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -135.47 85.23 2.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.537 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' HIS . . . . . 0.402 ' HD2' ' OE1' ' A' ' 487' ' ' GLU . 30.8 m170 -61.57 -32.96 73.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.259 -178.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.51 -36.03 82.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.025 0.441 . . . . 10.0 110.086 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.93 -44.06 73.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.462 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.402 ' OE1' ' HD2' ' A' ' 484' ' ' HIS . 37.5 mt-10 -59.73 -47.83 84.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.433 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -60.26 -33.96 73.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.63 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -70.52 -38.56 74.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.808 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 50.8 mt -74.84 -45.68 43.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.799 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.0 t -55.36 -34.62 34.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.138 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -57.4 -31.49 65.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.542 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -124.62 26.59 7.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.734 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -69.02 -21.25 64.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.132 0.492 . . . . 10.0 110.902 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -100.08 14.12 60.04 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.771 -0.728 . . . . 10.0 111.671 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -75.52 140.44 71.94 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.208 -0.293 . . . . 10.0 110.208 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -52.59 125.98 19.54 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.689 2.26 . . . . 10.0 113.356 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 70.78 16.52 6.69 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.449 -0.796 . . . . 10.0 112.8 178.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.23 115.29 26.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.897 0.379 . . . . 10.0 110.105 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' A' ' 475' ' ' LYS . 53.8 t -96.1 108.03 20.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.247 0.546 . . . . 10.0 110.205 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 7.4 m -106.11 130.18 54.05 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.601 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 49.0 mt -109.41 119.28 58.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.2 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -109.19 130.29 55.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.87 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 7.0 m -100.72 93.58 5.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.816 0.341 . . . . 10.0 110.75 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 55.51 78.41 0.19 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.456 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 8.6 ttt -83.87 142.88 30.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.421 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -70.8 173.01 7.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.007 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -61.69 156.82 35.18 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 116.144 -0.48 . . . . 10.0 113.172 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.531 HH21 ' HB2' ' A' ' 210' ' ' GLU . 75.5 mtt180 70.77 -82.05 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.463 0.705 . . . . 10.0 111.302 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 79.73 170.65 40.72 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.53 -0.628 . . . . 10.0 111.53 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.28 148.47 49.72 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.585 0.231 . . . . 10.0 110.584 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.53 90.68 4.51 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.822 -0.436 . . . . 10.0 109.822 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 70.8 mt -70.7 114.74 9.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.692 -0.685 . . . . 10.0 111.235 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 3.9 t -89.71 133.84 30.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.663 -0.698 . . . . 10.0 110.182 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 53.7 mt -64.9 131.57 47.05 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.515 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 98.13 -17.17 59.06 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 121.079 -0.582 . . . . 10.0 111.743 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 115.66 -164.38 12.2 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.0 p -135.05 101.79 4.99 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 117.061 0.431 . . . . 10.0 110.624 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 53.3 p-90 -56.28 -28.15 57.75 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.315 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -61.0 -43.32 99.05 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.055 0.455 . . . . 10.0 110.662 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -73.09 -23.03 60.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.873 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -79.49 -47.06 16.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.042 -0.527 . . . . 10.0 110.574 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.0 m -69.4 -23.45 26.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.927 0.394 . . . . 10.0 110.848 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -78.89 -10.85 59.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.009 0.433 . . . . 10.0 110.916 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -94.25 -3.1 51.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.665 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 58.5 mt -97.19 152.28 18.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.317 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -64.64 -61.22 2.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.554 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -131.1 97.28 20.34 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 529' ' ' PRO . . . . . 0.431 ' HA ' ' OE1' ' A' ' 533' ' ' GLN . 60.7 Cg_endo -81.17 93.18 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.613 2.209 . . . . 10.0 112.057 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 17.5 p -71.04 168.84 16.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.448 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.92 -41.42 70.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.936 0.398 . . . . 10.0 111.025 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -61.01 -43.58 98.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.053 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . 0.431 ' OE1' ' HA ' ' A' ' 529' ' ' PRO . 75.0 mt-30 -65.3 -46.64 79.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.731 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 75.1 mt -58.85 -49.24 83.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.314 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -61.98 -41.88 98.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.036 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 20.1 tptp -61.08 -49.05 78.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.801 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 74.6 mt -63.79 -39.29 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.706 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 25.1 mtmt -62.11 -39.62 93.12 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.865 0.364 . . . . 10.0 110.277 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -62.92 -44.41 96.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.225 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -67.26 -41.95 84.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.115 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 70.9 t90 -60.46 -39.63 88.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.568 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -57.5 -46.03 84.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.469 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.61 -42.06 94.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.883 179.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 31.6 mtp180 -62.41 -38.54 90.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.824 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -66.77 -47.39 72.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.469 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -33.4 75.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.859 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.7 99.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.926 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 67.7 t -65.82 -35.14 74.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.386 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 84.0 mt -62.26 -43.64 98.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.315 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.18 -18.15 61.29 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.913 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -80.19 -30.49 38.76 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.398 179.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 125.82 19.14 2.29 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.571 -0.823 . . . . 10.0 112.973 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 72.21 -163.76 54.52 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.938 -0.649 . . . . 10.0 112.505 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 51.8 tp -77.91 119.68 21.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.918 0.389 . . . . 10.0 110.336 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.4 t60 -92.51 115.54 28.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.163 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 14.8 mm -98.83 132.8 43.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.929 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 557' ' ' ILE . . . . . 0.432 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.8 mt -124.21 122.72 64.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.918 0.39 . . . . 10.0 110.517 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.89 116.71 5.24 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.897 -0.668 . . . . 10.0 111.437 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 559' ' ' THR . . . . . 0.404 ' O ' ' HE3' ' A' ' 434' ' ' LYS . 19.0 p -74.37 -43.19 57.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.125 0.488 . . . . 10.0 110.656 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . 0.422 ' OE2' ' HG2' ' A' ' 461' ' ' LYS . 19.8 mp0 -136.72 145.21 44.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.631 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 88.1 mtt-85 -95.36 166.85 11.68 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.854 -0.424 . . . . 10.0 109.854 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 562' ' ' HIS . . . . . 0.423 ' CE1' HD13 ' A' ' 567' ' ' ILE . 46.2 t-80 -107.39 149.85 27.41 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -57.02 -64.98 0.7 Allowed 'General case' 0 N--CA 1.462 0.148 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.75 117.45 10.48 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 108.937 -0.764 . . . . 10.0 108.937 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 565' ' ' ARG . . . . . 0.41 ' HB3' ' OG1' ' A' ' 396' ' ' THR . 14.2 tpt180 -61.66 -14.36 30.53 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.891 -178.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 566' ' ' ARG . . . . . 0.41 ' HG2' ' HB3' ' A' ' 394' ' ' ALA . 5.4 ttm180 -55.06 -45.41 75.32 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 121.002 0.43 . . . . 10.0 110.939 179.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 567' ' ' ILE . . . . . 0.423 HD13 ' CE1' ' A' ' 562' ' ' HIS . 61.3 mt -81.1 -31.75 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.458 . . . . 10.0 110.401 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -61.41 -51.48 68.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.135 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 569' ' ' ASN . . . . . 0.519 ' HB3' ' O ' ' A' ' 393' ' ' THR . 31.3 m-20 -65.27 -28.95 69.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.634 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -62.13 -36.75 82.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.214 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 40.3 tp -76.65 -35.72 57.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.377 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 572' ' ' ARG . . . . . 0.405 ' HD2' ' OD2' ' A' ' 422' ' ' ASP . 14.4 ttp180 -69.32 -30.8 68.94 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.16 0.505 . . . . 10.0 110.497 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -85.37 13.82 53.4 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 121.035 -0.602 . . . . 10.0 113.76 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 -75.46 -32.38 60.6 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 117.231 0.515 . . . . 10.0 110.279 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 4.7 t -91.03 166.63 12.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.471 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 67.16 54.02 23.01 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.724 -0.75 . . . . 10.0 112.571 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 15.2 mmt180 -69.02 117.23 10.41 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 578' ' ' GLN . . . . . 0.642 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 3.5 tt0 61.45 26.79 16.49 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.968 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 86.4 55.97 2.36 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.867 -0.683 . . . . 10.0 112.679 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -108.36 -169.3 1.48 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.94 -0.393 . . . . 10.0 109.94 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -95.25 150.3 20.39 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.962 0.41 . . . . 10.0 111.596 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.59 -179.18 48.37 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.135 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.6 p -155.31 128.57 8.3 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.144 -0.317 . . . . 10.0 110.144 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.11 125.45 52.16 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.785 0.326 . . . . 10.0 111.147 -179.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 585' ' ' ARG . . . . . 0.432 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 2.0 tpm_? -129.69 122.51 29.11 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -113.48 149.8 33.76 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.046 0.451 . . . . 10.0 110.777 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 59.9 m-85 -129.0 162.06 28.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.988 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 588' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 427' ' ' VAL . 44.6 tp -162.51 149.41 13.32 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.104 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 92.5 p -123.3 169.94 10.8 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.808 -0.442 . . . . 10.0 109.808 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 590' ' ' MET . . . . . 0.438 ' SD ' ' HE2' ' A' ' 595' ' ' MET . 71.4 mmm -83.61 0.22 47.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.144 0.497 . . . . 10.0 110.075 179.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -100.91 -17.37 16.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.005 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -70.71 147.48 49.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.13 0.49 . . . . 10.0 111.451 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -65.12 -15.88 62.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.558 -0.746 . . . . 10.0 112.735 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 14.5 tp -64.81 -23.15 67.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.703 0.287 . . . . 10.0 111.406 -179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.438 ' HE2' ' SD ' ' A' ' 590' ' ' MET . 7.0 mmt -75.49 -2.42 28.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.725 0.298 . . . . 10.0 111.442 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -95.17 -7.66 38.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.514 -0.312 . . . . 10.0 111.37 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 20.2 pt -79.51 -13.09 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-O 120.945 0.402 . . . . 10.0 111.298 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -84.75 50.48 1.92 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.409 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 70.6 -55.83 0.62 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.812 0.845 . . . . 10.0 111.167 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 59.4 m -155.0 137.74 15.27 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -62.88 -17.2 61.28 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 602' ' ' ARG . . . . . 0.421 ' HD2' ' O ' ' A' ' 602' ' ' ARG . 1.8 tmm_? -64.32 -35.46 80.93 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 48.5 t -71.2 -46.37 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.91 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -20.03 63.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.522 -0.763 . . . . 10.0 111.213 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -62.93 -15.08 55.15 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 116.018 -0.537 . . . . 10.0 113.088 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 46.2 tpp -67.37 -21.56 65.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.095 0.474 . . . . 10.0 110.431 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 66.6 mtt -78.32 -11.24 59.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.569 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 59.8 mtt-85 -69.17 -17.64 63.83 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.089 0.471 . . . . 10.0 110.298 179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -102.74 28.37 6.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.766 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 22.6 tp -88.17 -14.59 38.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.23 0.538 . . . . 10.0 110.099 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 111.26 -48.07 0.98 Allowed Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.803 -0.635 . . . . 10.0 112.193 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 66.98 -77.54 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.368 0.667 . . . . 10.0 111.836 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 59.86 83.98 0.2 Allowed Pre-proline 0 N--CA 1.464 0.229 0 O-C-N 123.613 0.571 . . . . 10.0 110.992 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 614' ' ' PRO . . . . . 0.46 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 31.8 Cg_exo -58.13 105.03 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.833 2.355 . . . . 10.0 112.278 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 125.0 -14.68 7.46 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 121.023 -0.608 . . . . 10.0 111.71 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -110.57 129.56 55.77 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.061 -0.348 . . . . 10.0 110.061 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -83.3 100.65 10.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.542 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 4.7 tp -66.93 -28.53 43.3 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.758 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 619' ' ' GLU . . . . . 0.427 ' HA ' ' OE1' ' A' ' 619' ' ' GLU . 13.9 mm-40 40.01 82.64 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.611 0.967 . . . . 10.0 113.611 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 40.8 m170 -119.71 100.57 48.94 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -57.48 -30.17 87.3 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 123.368 2.712 . . . . 10.0 113.752 -178.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 65.9 p-90 -63.59 -22.08 66.7 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 121.12 -0.232 . . . . 10.0 111.583 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 70.1 t -66.84 -48.7 79.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 109.704 -0.48 . . . . 10.0 109.704 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 43.8 m -60.56 -40.39 91.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.38 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -67.13 -32.34 73.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.661 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -70.8 -43.81 67.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.959 0.409 . . . . 10.0 110.126 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.67 -45.25 92.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.289 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.36 -34.9 74.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.808 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -65.21 -48.8 72.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.817 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -65.99 -36.87 84.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.832 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -58.11 -44.93 87.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.066 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -74.05 -25.46 59.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.294 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -68.62 -37.13 79.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.32 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 88.5 t -57.46 -48.06 83.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 109.786 -0.45 . . . . 10.0 109.786 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -70.18 -28.18 65.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.818 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.8 m -63.48 -35.25 79.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.181 -0.674 . . . . 10.0 109.181 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -70.25 -40.96 74.11 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.359 -0.837 . . . . 10.0 109.084 178.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -66.77 -35.6 80.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.257 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -58.13 -43.88 87.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.093 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.22 -40.63 90.84 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 641' ' ' ILE . . . . . 0.432 ' O ' ' HG ' ' A' ' 645' ' ' LEU . 61.3 mt -67.77 -46.22 82.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.3 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 64.8 mtm-85 -58.16 -42.79 86.73 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.038 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -61.65 -45.52 93.68 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.73 179.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -60.9 -39.74 90.43 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.862 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 641' ' ' ILE . 85.0 mt -71.03 -40.45 71.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.675 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 646' ' ' LEU . . . . . 0.424 ' HA ' ' HB2' ' A' ' 649' ' ' ASP . 82.4 mt -67.46 -24.43 65.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.578 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -58.33 -44.68 88.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.043 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -77.63 -31.17 52.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.333 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 649' ' ' ASP . . . . . 0.424 ' HB2' ' HA ' ' A' ' 646' ' ' LEU . 88.1 m-20 -65.9 -45.43 82.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.428 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 650' ' ' ASP . . . . . 0.43 ' HA ' ' HB3' ' A' ' 653' ' ' ASN . 15.9 t70 -63.46 -28.75 70.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.51 -0.313 . . . . 10.0 111.469 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 53.7 t -61.25 -50.46 80.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.444 -0.576 . . . . 10.0 109.444 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -70.48 -27.61 64.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.991 179.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 653' ' ' ASN . . . . . 0.43 ' HB3' ' HA ' ' A' ' 650' ' ' ASP . 20.5 t30 -63.13 -52.14 63.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.395 -0.821 . . . . 10.0 111.11 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -62.03 -44.56 96.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.808 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -60.73 -42.1 96.63 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.871 0.367 . . . . 10.0 110.083 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 6.6 ttp-105 -63.75 -45.99 87.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.02 178.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -60.09 -43.16 95.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.694 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.71 -53.84 44.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.719 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.8 tp -65.31 -32.17 57.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-O 120.655 0.264 . . . . 10.0 111.419 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -69.78 -32.41 70.89 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 110.39 -0.226 . . . . 10.0 110.39 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 49.1 m -65.62 -46.29 79.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -63.77 -43.78 95.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.371 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 28.3 ttt-85 -63.26 -36.73 84.63 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.521 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -66.1 -40.71 90.98 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.776 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -60.67 -49.74 76.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.054 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 61.7 mt -67.32 -17.19 64.66 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.066 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 44.2 tp -83.18 -44.13 15.38 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.385 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -71.63 -47.96 51.09 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 20.0 m -68.59 149.36 11.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.073 0.463 . . . . 10.0 111.566 -179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -42.54 9.92 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.917 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -94.99 140.86 29.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.386 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 8.6 p -135.2 11.8 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.918 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 8.1 m -55.18 -38.61 68.57 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.587 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -59.17 -51.74 68.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 10.0 111.219 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.99 -46.12 86.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.051 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 676' ' ' ILE . . . . . 0.401 ' O ' ' HB2' ' A' ' 680' ' ' ARG . 34.0 mm -58.47 -44.2 88.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.874 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -72.52 -40.5 66.76 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.949 -0.3 . . . . 10.0 111.613 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 60.6 m -61.92 -39.43 92.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.659 -0.246 . . . . 10.0 111.464 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 45.9 pt -83.49 -21.07 8.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 120.835 -0.346 . . . . 10.0 111.011 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 680' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 676' ' ' ILE . 30.3 ttm-85 -59.66 -51.13 71.11 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.917 0.389 . . . . 10.0 110.702 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -63.76 -36.38 83.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.057 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -66.95 -46.5 74.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.836 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 72.1 t -60.09 -45.1 96.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.361 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -62.98 -45.55 91.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.308 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 34.3 tttm -58.81 -49.2 78.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.694 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -60.4 -41.04 93.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.402 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 25.6 m -67.87 -40.08 83.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.39 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 92.1 mt -68.61 -43.4 83.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.213 -0.448 . . . . 10.0 110.377 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -60.92 -19.09 60.1 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.866 0.365 . . . . 10.0 111.721 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -79.59 -21.06 45.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.736 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -117.4 -29.28 5.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.995 0.426 . . . . 10.0 110.995 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 55.6 mt -124.79 106.16 29.4 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.386 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -72.72 138.74 29.61 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.701 2.267 . . . . 10.0 111.389 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 694' ' ' PRO . . . . . 0.447 ' HA ' ' OE1' ' A' ' 732' ' ' GLU . 37.4 Cg_endo -67.21 131.37 24.9 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.344 2.029 . . . . 10.0 112.891 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 64.11 41.33 6.37 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.708 -0.678 . . . . 10.0 112.03 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 40.4 p -107.86 -150.98 0.46 Allowed 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 96.8 mt -113.55 158.71 20.42 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.174 -0.306 . . . . 10.0 110.174 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -58.99 -36.73 75.39 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.237 0.458 . . . . 10.0 112.237 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -78.29 1.39 21.89 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.032 0.444 . . . . 10.0 111.294 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 60.9 mtt -104.38 7.05 35.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.145 0.498 . . . . 10.0 110.071 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 701' ' ' TRP . . . . . . . . . . . . . 48.7 m0 -104.5 121.49 43.58 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.437 -178.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -86.05 82.74 7.98 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 703' ' ' ILE . . . . . 0.46 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 39.2 mm -61.74 -48.99 88.22 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.34 -0.846 . . . . 10.0 112.009 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 704' ' ' PRO . . . . . 0.46 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 42.9 Cg_exo -58.15 -43.69 45.47 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.008 1.805 . . . . 10.0 112.425 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -62.82 -42.93 99.59 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.954 -0.641 . . . . 10.0 112.299 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 35.2 tp -69.16 -42.49 75.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.659 0.266 . . . . 10.0 110.472 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -60.97 -44.91 96.64 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.706 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.83 -41.86 99.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.785 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -64.16 -41.98 96.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.888 0.375 . . . . 10.0 110.567 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 89.9 mt -62.64 -38.96 92.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.237 0.541 . . . . 10.0 110.011 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 21.1 mtpp -86.49 13.13 8.87 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.588 -0.733 . . . . 10.0 111.349 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -125.8 -51.95 1.57 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.767 0.318 . . . . 10.0 111.511 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -98.03 -23.64 15.68 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.353 0.871 . . . . 10.0 113.353 -177.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -108.63 -6.46 15.99 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.363 -0.535 . . . . 10.0 112.204 -178.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 39.1 t70 57.01 32.92 22.51 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.596 0.713 . . . . 10.0 110.7 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 12.5 tp -120.69 117.65 28.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.171 0.51 . . . . 10.0 111.06 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -90.96 99.24 12.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.459 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 77.7 mt -121.97 123.06 27.46 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.832 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -85.16 73.69 4.09 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.816 2.344 . . . . 10.0 111.653 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 46.7 mt -57.81 -37.67 61.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.115 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -62.34 -29.69 70.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.799 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -81.67 -37.61 27.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.003 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 42.5 m0 -60.92 -56.72 17.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.645 -0.707 . . . . 10.0 111.233 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 18.2 tp -65.07 -24.44 67.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.041 0.448 . . . . 10.0 111.244 -179.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -66.81 -39.93 87.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.042 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 726' ' ' LYS . . . . . 0.429 ' O ' ' HD3' ' A' ' 728' ' ' PRO . 8.8 mttp -99.84 -29.51 12.56 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.446 0.536 . . . . 10.0 112.446 -178.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -114.97 87.41 15.15 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 120.719 0.295 . . . . 10.0 111.049 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . 0.497 ' HD2' ' OE1' ' A' ' 729' ' ' GLU . 10.6 Cg_exo -72.27 -22.23 22.31 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.683 2.255 . . . . 10.0 112.346 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . 0.497 ' OE1' ' HD2' ' A' ' 728' ' ' PRO . 4.0 mp0 -74.59 1.95 10.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.75 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 16.4 mt -66.12 -27.34 67.97 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 731' ' ' HIS . . . . . 0.406 ' HB3' ' H ' ' A' ' 732' ' ' GLU . 5.4 t-80 56.42 -101.41 0.13 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.801 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 732' ' ' GLU . . . . . 0.447 ' OE1' ' HA ' ' A' ' 694' ' ' PRO . 8.4 tt0 -148.99 -54.31 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.924 -0.31 . . . . 10.0 111.428 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.78 -50.51 73.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.454 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.59 -35.61 74.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.559 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 4.5 tt -65.0 -43.47 92.44 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.164 -0.471 . . . . 10.0 109.898 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -62.67 -46.75 86.72 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.115 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -63.13 -38.1 89.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.198 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 21.9 mmm-85 -57.47 -49.83 75.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.853 0.359 . . . . 10.0 110.089 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 79.8 mt -57.31 -46.34 85.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.218 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 53.6 tp -62.0 -47.2 85.86 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.11 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -59.44 -46.71 87.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.382 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.9 -35.73 77.42 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.199 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 20.4 m -66.66 -44.84 80.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.435 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 73.1 mt -64.49 -37.65 80.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.458 . . . . 10.0 110.614 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.47 -55.66 25.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.363 -0.381 . . . . 10.0 110.611 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 85.0 t -62.23 -35.47 69.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.758 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -58.67 -49.48 77.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.463 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 748' ' ' GLN . . . . . 0.58 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 44.0 mt-30 -64.52 -35.99 82.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.493 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 64.8 mtp180 -64.68 -36.77 85.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.147 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -71.08 -37.72 72.45 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.45 -45.43 91.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.877 -1.056 . . . . 10.0 112.269 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 752' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 56.2 mt-10 -58.61 -28.7 65.86 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -178.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 17.8 t -78.74 -32.6 15.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.992 0.425 . . . . 10.0 111.147 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.9 t -86.59 -46.04 16.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.082 0.468 . . . . 10.0 110.946 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 130.78 137.78 4.17 Favored Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 111.137 -0.785 . . . . 10.0 111.137 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 756' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -57.64 -59.26 5.47 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 27.1 mp0 -63.09 -36.03 82.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.762 0.315 . . . . 10.0 111.032 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 17.5 tpt -65.85 -43.86 87.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.82 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 40.3 mmm -63.03 -42.51 99.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.516 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.7 mmp_? -60.12 -39.25 85.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.249 0.547 . . . . 10.0 109.834 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -69.45 -38.11 77.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.711 178.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -64.07 -49.96 70.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.158 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -59.08 -46.12 89.1 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.213 -0.448 . . . . 10.0 110.31 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -57.44 -46.2 83.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.24 178.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -66.68 -46.04 79.19 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.832 -0.622 . . . . 10.0 112.351 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 61.6 t -59.66 -42.01 87.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.408 0.147 . . . . 10.0 110.822 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 22.7 mtp -59.94 -48.82 80.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.726 0.298 . . . . 10.0 110.427 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.99 -43.3 96.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.644 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -62.5 -48.3 80.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.312 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 8.4 m -63.0 -40.17 96.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.85 0.357 . . . . 10.0 110.292 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.6 tt -61.61 -46.92 87.78 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.433 -0.581 . . . . 10.0 109.433 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 772' ' ' ASP . . . . . 0.586 ' O ' ' HG2' ' A' ' 776' ' ' LYS . 0.3 OUTLIER -63.99 -43.6 95.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.796 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 42.1 m -55.86 -45.98 78.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.896 0.379 . . . . 10.0 110.844 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.24 -24.96 59.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.723 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -67.62 -38.84 84.48 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.996 -0.372 . . . . 10.0 109.996 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.586 ' HG2' ' O ' ' A' ' 772' ' ' ASP . 3.8 mmtt -62.38 -40.84 97.79 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 108.816 -0.809 . . . . 10.0 108.816 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 777' ' ' GLU . . . . . 0.419 ' HG2' ' HG3' ' A' ' 305' ' ' MET . 15.5 tm-20 -63.4 -53.29 54.65 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.912 -1.04 . . . . 10.0 109.374 178.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 778' ' ' HIS . . . . . 0.53 ' O ' ' HG2' ' A' ' 782' ' ' MET . 16.0 t60 -54.77 -37.27 65.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.31 -0.859 . . . . 10.0 111.86 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.16 -44.31 97.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.999 0.428 . . . . 10.0 110.361 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -75.43 -38.14 59.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.433 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.97 -42.06 93.33 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.9 -0.591 . . . . 10.0 111.281 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 782' ' ' MET . . . . . 0.53 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 97.5 mmm -60.0 -37.67 80.38 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.171 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 783' ' ' ASP . . . . . 0.402 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 9.1 t70 -71.79 -45.82 60.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.421 179.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -54.48 -42.52 70.82 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.531 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 21.9 tp -78.93 -30.97 44.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.858 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -58.5 -45.15 89.36 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.956 0.407 . . . . 10.0 110.984 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 787' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 6.9 pt20 -88.58 -31.8 18.44 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.749 -0.38 . . . . 10.0 110.627 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -70.61 -25.68 75.31 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.018 -0.611 . . . . 10.0 113.226 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 6.3 tp -61.97 -17.7 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.805 0.336 . . . . 10.0 111.667 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -64.33 -27.14 68.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.829 0.347 . . . . 10.0 110.483 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 87.0 mt -98.38 2.22 47.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.402 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -109.68 -21.06 12.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.605 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -77.6 87.44 1.03 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 121.03 -0.605 . . . . 10.0 112.199 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 8.2 p90 -79.79 -177.23 5.82 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.917 0.389 . . . . 10.0 110.874 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -75.23 156.33 35.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.583 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 67.56 34.95 4.35 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.432 0.457 . . . . 10.0 111.291 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -167.73 137.28 2.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.417 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -79.77 129.17 71.92 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.545 -0.298 . . . . 10.0 110.461 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.3 -24.09 58.39 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 123.099 2.533 . . . . 10.0 113.807 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 25.7 mtmm -82.45 -45.48 14.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.001 0.429 . . . . 10.0 109.95 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -62.95 -44.19 96.74 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.695 -0.684 . . . . 10.0 111.418 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -65.66 -36.55 83.99 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -61.36 -47.52 85.48 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.003 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -58.3 -40.46 82.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.114 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -60.39 -53.5 56.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.33 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -60.77 -37.49 82.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.692 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 28.4 m -65.97 -36.77 84.23 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.904 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -67.37 -41.46 85.03 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 6.6 m -65.47 -38.25 89.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.204 0.526 . . . . 10.0 109.827 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 32.7 ttm -63.52 -41.85 98.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.327 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -65.83 -42.49 90.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.57 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.42 -46.53 89.73 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.008 0.432 . . . . 10.0 110.32 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.75 85.03 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.463 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 22.4 ttp -63.61 -40.72 97.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.098 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.5 -40.59 95.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.523 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -65.05 -40.88 95.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.149 0.5 . . . . 10.0 110.173 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 14.4 m -68.93 -30.84 69.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.256 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 61.5 tp -63.55 -57.43 10.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.608 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt -61.13 -34.52 75.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.691 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -60.45 -61.44 2.6 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.582 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.79 -31.57 72.29 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.554 0.576 . . . . 10.0 112.554 -178.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 822' ' ' VAL . . . . . 0.43 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 14.6 t -60.22 -54.58 32.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.851 -0.34 . . . . 10.0 110.282 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 34.3 mm -66.6 -40.63 86.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.934 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 50.7 m -60.65 -50.9 71.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.005 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 93.3 m -59.6 -38.72 82.0 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.749 0.309 . . . . 10.0 111.593 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 826' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 94.6 mt -66.65 -18.27 65.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.823 0.344 . . . . 10.0 111.347 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 5.4 m -102.51 -34.1 9.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.913 0.387 . . . . 10.0 110.309 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -63.35 -23.89 67.61 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.624 -0.717 . . . . 10.0 111.722 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.82 122.33 4.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 121.586 0.708 . . . . 10.0 111.323 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -86.38 93.13 9.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.549 -0.751 . . . . 10.0 110.161 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 62.1 t -90.75 137.44 21.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.606 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 38.0 mtt180 -72.34 93.08 1.47 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.981 0.419 . . . . 10.0 110.216 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 91.4 mtp -97.26 121.81 57.7 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.966 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.76 170.06 19.71 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.678 2.252 . . . . 10.0 111.501 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -66.19 108.03 2.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.012 0.434 . . . . 10.0 111.066 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.485 -0.769 . . . . 10.0 109.84 179.474 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 110.308 -0.256 . . . . 10.0 110.308 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.68 108.58 14.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.062 0.458 . . . . 10.0 110.27 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 2.5 pt -96.83 91.66 2.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.904 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.1 95.63 4.27 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.103 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 79.9 mt -91.03 133.24 35.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.066 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.45 146.99 29.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.551 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -85.89 65.39 9.1 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.056 0.455 . . . . 10.0 110.328 179.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.74 -19.82 61.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.296 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -83.42 67.43 9.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.307 0.575 . . . . 10.0 109.853 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . 0.552 ' O ' ' HD3' ' B' ' 12' ' ' PRO . 28.4 mttt -73.33 147.68 44.19 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.223 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.29 101.1 11.82 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 120.951 0.405 . . . . 10.0 111.701 -178.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . 0.552 ' HD3' ' O ' ' B' ' 10' ' ' LYS . 8.1 Cg_endo -87.89 18.93 1.43 Allowed 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.052 2.502 . . . . 10.0 111.59 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -60.88 -31.79 71.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.795 -0.638 . . . . 10.0 111.555 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -33.95 76.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.969 0.414 . . . . 10.0 110.994 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 39.5 t -81.49 -33.83 12.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.519 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.11 -16.99 56.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.972 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 82.0 t -66.82 -35.25 74.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.928 0.394 . . . . 10.0 110.904 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.18 -40.32 78.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.123 0.487 . . . . 10.0 111.064 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.31 -6.89 59.21 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.685 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . 0.467 ' HA3' ' OG ' ' B' ' 23' ' ' SER . . . -62.07 -32.17 81.36 Favored Glycine 0 N--CA 1.453 -0.226 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.974 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 12.6 t -59.85 -34.7 56.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.912 0.387 . . . . 10.0 111.214 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 22.6 ttt -132.91 56.08 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.231 0.538 . . . . 10.0 110.378 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' SER . . . . . 0.467 ' OG ' ' HA3' ' B' ' 20' ' ' GLY . 73.8 m -83.51 90.83 7.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.502 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.95 157.3 18.97 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.006 -0.739 . . . . 10.0 109.006 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -140.69 145.88 37.1 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.152 0.501 . . . . 10.0 111.244 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -105.34 -122.27 0.22 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.689 -0.687 . . . . 10.0 109.392 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 60.3 ttp -85.72 -31.24 22.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.881 0.372 . . . . 10.0 110.421 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.038 -0.982 . . . . 10.0 110.112 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.79 0.329 . . . . 10.0 110.245 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -81.79 124.94 30.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.84 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 136.62 150.0 5.76 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.908 -0.663 . . . . 10.0 112.444 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.404 ' O ' ' HB3' ' A' ' 16' ' ' ARG . 6.0 m -63.31 148.16 49.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.906 0.384 . . . . 10.0 110.421 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.648 ' HD2' ' OD1' ' A' ' 408' ' ' ASP . 2.3 mmp_? -66.94 143.9 56.55 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.53 0.567 . . . . 10.0 112.53 -178.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.9 t30 68.33 -82.96 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 114.76 -1.109 . . . . 10.0 112.801 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -51.63 -59.64 4.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.509 0.929 . . . . 10.0 113.509 -177.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.404 ' HB3' ' O ' ' A' ' 12' ' ' SER . 8.1 tpt180 -72.13 -41.73 66.84 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.76 0.652 . . . . 10.0 112.76 -177.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.6 p -59.44 -50.55 73.51 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.9 mt -64.06 -37.88 89.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.762 0.315 . . . . 10.0 111.041 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 23.6 ttp-105 -65.62 -45.12 84.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.469 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -63.58 -41.74 98.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.124 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.416 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 52.1 mtt -65.81 -34.81 79.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.618 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -61.96 -33.4 74.23 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.012 0.434 . . . . 10.0 110.135 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -66.88 -35.61 80.42 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.33 -0.618 . . . . 10.0 109.33 179.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 56.9 t -71.87 -38.83 66.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.504 -0.771 . . . . 10.0 109.476 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.5 t -58.49 -36.18 57.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.683 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -60.66 -38.66 85.62 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.069 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.7 mt -65.72 -43.97 93.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 65.9 mt -62.65 -36.44 75.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.503 -0.772 . . . . 10.0 110.233 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -63.35 -36.27 83.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.478 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.2 -25.28 36.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.71 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 46.8 mtt -80.35 -19.05 47.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.064 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.475 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 5.8 tt0 -59.65 -55.87 41.46 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-O 119.356 -0.355 . . . . 10.0 110.973 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.475 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 27.5 Cg_exo -63.7 -19.34 67.1 Favored 'Trans proline' 0 C--N 1.359 1.09 0 C-N-CA 121.97 1.78 . . . . 10.0 111.712 179.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -74.3 -45.09 49.72 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.4 mmt -68.96 -24.02 64.21 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.357 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 96.5 mt-10 -65.06 -22.77 67.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.76 179.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.9 mttt -86.35 -6.61 58.9 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.386 0.613 . . . . 10.0 109.915 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.2 mp -98.38 141.21 31.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.383 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.8 p -74.48 170.15 16.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.241 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -60.23 -38.05 82.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.959 0.409 . . . . 10.0 110.846 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -68.12 -32.89 73.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.721 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.71 -34.34 73.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.764 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.88 -43.65 98.42 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -67.04 -32.48 73.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.093 -0.958 . . . . 10.0 109.761 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.5 -34.91 90.86 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.351 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -66.74 -36.88 83.49 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.3 m -60.78 -44.83 96.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.136 178.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.15 -33.85 76.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.284 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -65.16 -40.51 94.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.65 179.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.2 m-30 -61.01 -42.66 98.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.777 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -59.02 -43.12 91.53 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.016 0.436 . . . . 10.0 110.372 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.37 -41.37 76.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.891 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -61.44 -38.11 86.0 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.153 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 55.3 mt -63.22 -40.16 96.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.801 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -70.14 -31.96 69.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.539 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -69.65 -61.79 1.64 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.785 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 168.95 27.27 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.204 -0.998 . . . . 10.0 113.27 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -94.02 140.92 29.13 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.1 t -87.09 139.43 17.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.566 HD12 ' O ' ' A' ' 118' ' ' LEU . 20.6 tp -56.26 -40.75 74.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.967 0.413 . . . . 10.0 111.107 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -63.43 -21.55 66.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.626 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -82.31 -20.73 36.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.076 0.465 . . . . 10.0 110.358 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.6 mt -82.15 -9.32 59.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.625 -178.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 76.8 mt -49.43 -53.4 40.72 Favored Pre-proline 0 CA--C 1.542 0.645 0 N-CA-C 113.013 0.746 . . . . 10.0 113.013 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 33.5 Cg_exo -58.95 -49.83 10.4 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.963 1.776 . . . . 10.0 113.204 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -69.61 -43.8 72.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.335 -0.393 . . . . 10.0 111.955 -178.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.9 -47.56 77.36 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.002 0.371 . . . . 10.0 112.002 -178.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -61.5 -34.03 74.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.7 -0.227 . . . . 10.0 110.663 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.58 -43.98 88.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.372 179.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 95.5 t -61.59 -47.44 93.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.024 -0.534 . . . . 10.0 110.265 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 48.2 t -61.58 -42.52 94.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.442 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -59.82 -46.22 89.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.488 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -64.17 -44.25 92.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.383 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.46 -33.39 72.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.374 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.5 m -63.76 -37.11 86.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.38 179.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.6 mtmm -72.33 -12.51 61.17 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.83 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -110.89 -39.32 4.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -178.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 62.0 t -82.07 -45.09 20.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.957 0.408 . . . . 10.0 111.702 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -101.21 -27.88 12.96 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.854 0.359 . . . . 10.0 111.212 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.11 4.63 81.35 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.017 -0.611 . . . . 10.0 111.784 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 18.0 mtt -117.27 139.94 50.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.587 -0.523 . . . . 10.0 109.587 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.425 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 8.5 ttp180 -85.66 138.05 32.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.815 0.34 . . . . 10.0 110.711 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.41 114.31 5.33 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -55.56 152.52 8.98 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 123.596 0.56 . . . . 10.0 112.022 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.75 -40.17 96.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.975 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.9 m -68.29 -27.33 36.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 10.0 111.084 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -70.96 -30.29 66.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.221 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.9 mt -65.22 -36.21 83.45 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.19 -50.57 65.41 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.835 -0.621 . . . . 10.0 109.719 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.09 99.5 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.666 -0.697 . . . . 10.0 112.089 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -66.44 -32.2 81.1 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.886 -0.673 . . . . 10.0 112.079 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.416 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 13.9 ttm -71.27 -36.09 71.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.846 0.355 . . . . 10.0 110.424 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 76.5 t -65.82 -33.78 65.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.223 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.76 -2.27 22.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.702 -0.681 . . . . 10.0 112.13 -179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -80.5 -28.03 37.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.207 0.527 . . . . 10.0 109.988 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -103.73 175.43 5.48 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.167 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 43.1 ttt85 -78.49 77.83 4.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.888 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 408' ' ' ASP . 0.4 OUTLIER -152.0 159.85 43.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.099 0.476 . . . . 10.0 111.582 -179.676 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 49.9 mm -100.12 134.64 39.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.713 179.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.84 111.95 23.69 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.851 0.358 . . . . 10.0 111.287 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -86.99 117.11 25.49 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.7 mtt -111.59 177.67 4.58 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.281 0.562 . . . . 10.0 111.495 -178.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.451 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 9.2 mmm180 -108.73 142.71 38.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.312 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.63 110.0 2.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.771 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.43 ' O ' ' HG2' ' A' ' 578' ' ' GLN . . . 127.17 -23.36 5.51 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.856 -0.687 . . . . 10.0 112.535 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -75.85 -41.06 53.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.939 0.4 . . . . 10.0 110.834 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 155.27 150.38 5.56 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.971 -0.633 . . . . 10.0 111.63 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -121.55 -80.43 0.62 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.777 0.289 . . . . 10.0 110.687 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.74 -24.64 38.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.061 0.457 . . . . 10.0 110.675 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 45.9 tp -63.14 -25.29 68.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.323 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.96 -20.99 26.5 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.23 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -83.06 -8.84 59.49 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.435 0.531 . . . . 10.0 112.435 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 11.5 p -67.1 -33.36 75.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.768 0.318 . . . . 10.0 111.793 -179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 26.3 mt -65.71 -57.6 13.74 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.929 -178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.13 -32.28 74.83 Favored 'Trans proline' 0 C--N 1.357 0.977 0 C-N-CA 121.935 1.757 . . . . 10.0 111.959 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.98 -52.88 45.57 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.689 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.41 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 63.6 t80 -59.92 -44.55 94.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.865 0.364 . . . . 10.0 110.633 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.566 ' O ' HD12 ' A' ' 60' ' ' LEU . 36.6 tp -59.44 -54.74 43.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.462 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -69.94 -23.29 63.18 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.876 0.324 . . . . 10.0 111.876 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.435 ' HB3' ' HB3' ' A' ' 173' ' ' ASP . . . -67.28 -26.19 66.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.019 0.438 . . . . 10.0 110.882 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 63.5 mt -60.81 -25.55 66.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.382 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.7 p -70.17 -19.32 63.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.864 0.364 . . . . 10.0 111.089 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 72.45 12.09 76.84 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 121.048 -0.596 . . . . 10.0 112.711 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.1 mmpp? -85.28 -21.99 28.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.688 0.28 . . . . 10.0 111.034 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.39 115.23 3.78 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.554 -0.831 . . . . 10.0 112.962 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 96.4 t -83.78 112.18 20.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 19.0 m170 -86.87 96.43 10.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.799 0.333 . . . . 10.0 110.387 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.5 t -86.1 120.34 35.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.127 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 26.0 t -98.88 113.58 34.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.326 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.36 151.8 21.84 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.99 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -69.06 -49.15 65.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.353 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -126.96 157.6 39.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.421 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.08 -17.77 63.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.703 -178.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -68.51 -55.44 11.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.837 0.351 . . . . 10.0 110.559 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.68 -31.94 73.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.69 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.05 -44.62 74.9 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.866 -0.607 . . . . 10.0 111.118 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -80.7 -40.45 25.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.792 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -52.55 -61.37 2.32 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.922 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -70.11 -27.3 64.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.259 -0.428 . . . . 10.0 112.073 -178.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.61 -50.49 64.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.949 0.404 . . . . 10.0 110.494 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -71.17 -33.21 69.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.052 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -70.88 -36.69 72.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.569 -0.287 . . . . 10.0 111.658 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -92.69 -3.12 55.4 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.027 -0.269 . . . . 10.0 111.559 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.472 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 63.2 ttm-85 -59.77 -49.16 93.05 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-O 119.293 -0.384 . . . . 10.0 111.877 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' PRO . . . . . 0.541 ' O ' ' HB2' ' A' ' 149' ' ' PHE . 29.2 Cg_exo -63.15 -9.12 16.03 Favored 'Trans proline' 0 C--N 1.361 1.204 0 C-N-CA 122.228 1.952 . . . . 10.0 112.692 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.5 tp -93.09 -52.39 4.59 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.018 0.437 . . . . 10.0 110.245 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -72.24 -45.5 59.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.888 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -67.0 -23.29 65.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.764 0.316 . . . . 10.0 110.971 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.541 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 29.7 t80 -68.29 -26.11 65.48 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.751 -0.463 . . . . 10.0 109.751 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 54.2 mt -94.5 -1.0 54.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.637 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 97.62 1.8 58.83 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.819 -0.705 . . . . 10.0 113.447 178.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 28.8 mt -80.9 140.79 35.12 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.057 0.429 . . . . 10.0 110.794 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.86 123.95 34.26 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.754 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 56.7 t -104.95 119.78 54.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.574 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -115.51 146.87 18.89 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.652 -0.785 . . . . 10.0 112.201 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.5 tp -119.99 127.4 75.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.038 0.447 . . . . 10.0 110.45 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -108.46 105.83 15.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.137 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 161' ' ' MET . 86.1 mt -96.65 146.68 31.73 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.897 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' PRO . . . . . 0.482 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 27.5 Cg_endo -62.37 116.96 3.84 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.856 2.371 . . . . 10.0 112.355 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 96.21 6.19 59.01 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.749 -0.739 . . . . 10.0 112.825 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' MET . . . . . 0.442 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.5 OUTLIER -67.97 150.09 97.92 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.539 0.17 . . . . 10.0 110.612 179.679 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -63.52 152.53 79.75 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.628 2.219 . . . . 10.0 112.14 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . 0.478 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.46 -50.92 80.29 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 113.12 0.785 . . . . 10.0 113.12 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.478 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 52.7 Cg_exo -57.03 -44.59 42.92 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 122.029 1.819 . . . . 10.0 112.416 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.12 -41.89 97.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.848 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.452 ' HZ1' ' CG ' ' A' ' 185' ' ' ASP . 54.4 mttm -63.91 -41.38 97.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.955 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' ARG . . . . . 0.42 ' CG ' ' HA ' ' A' ' 199' ' ' VAL . 64.3 mtt180 -58.35 -36.8 74.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.285 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -70.5 -38.79 74.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.962 0.41 . . . . 10.0 110.26 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.02 -44.19 85.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.524 -0.762 . . . . 10.0 111.11 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 41.7 m-85 -73.76 -28.2 61.55 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.307 -0.406 . . . . 10.0 111.036 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -76.27 -10.3 59.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.753 0.311 . . . . 10.0 111.274 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -75.12 174.67 9.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.615 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . 0.435 ' HB3' ' HB3' ' A' ' 120' ' ' ALA . 9.4 m-20 -75.44 -38.55 59.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.12 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 66.4 mt -130.84 125.95 59.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.006 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.9 m -115.5 117.21 29.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.917 0.389 . . . . 10.0 111.626 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -96.06 131.21 42.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.998 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -166.43 173.66 41.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.284 -0.96 . . . . 10.0 112.768 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.17 153.54 20.87 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 122.214 0.205 . . . . 10.0 111.074 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -61.48 -36.59 80.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.684 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -63.23 -56.44 16.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.44 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . 0.482 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.5 tp10 -62.81 -37.85 88.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.238 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.67 -34.69 71.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.767 0.318 . . . . 10.0 110.993 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -81.21 -40.3 11.58 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.92 -0.657 . . . . 10.0 111.835 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -64.38 -36.09 83.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.826 0.346 . . . . 10.0 110.75 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . 0.452 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 29.8 m-20 -61.42 -40.74 95.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.333 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -61.53 -38.12 86.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.418 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 54.8 mt -67.24 -41.68 85.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.554 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 72.9 mtm-85 -67.61 -41.71 83.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.951 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.39 -23.79 67.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.19 0.519 . . . . 10.0 111.264 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -90.95 1.66 56.86 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.966 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 66.6 mtp -108.88 -7.11 15.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.736 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -62.42 160.52 13.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.621 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -110.8 -14.9 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.281 0.563 . . . . 10.0 109.932 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -129.24 138.15 32.54 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.481 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -58.3 -29.97 89.57 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.639 2.226 . . . . 10.0 112.743 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -70.77 -16.09 62.73 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.662 0.245 . . . . 10.0 111.662 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -76.36 -15.96 59.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.668 -0.242 . . . . 10.0 111.549 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 75.1 mtt180 -57.88 134.82 56.65 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.959 0.409 . . . . 10.0 111.521 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 199' ' ' VAL . . . . . 0.42 ' HA ' ' CG ' ' A' ' 167' ' ' ARG . 20.5 m -108.07 -20.49 6.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.496 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -89.47 -178.61 5.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.209 0.528 . . . . 10.0 111.729 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -137.73 -179.02 5.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.588 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -52.91 133.56 37.8 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.432 0.635 . . . . 10.0 112.351 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 17.3 mt -87.55 61.99 6.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.473 -0.785 . . . . 10.0 110.034 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -80.06 -50.08 10.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.337 0.495 . . . . 10.0 112.337 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 33.3 t80 -131.22 138.02 49.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.993 0.425 . . . . 10.0 111.701 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.604 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . . . -134.53 125.28 27.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.697 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 30.5 tp -122.68 108.57 13.23 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.877 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.4 p -96.04 129.87 45.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.207 0.527 . . . . 10.0 110.836 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -58.81 -55.9 29.16 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.377 -0.829 . . . . 10.0 111.981 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' GLU . . . . . 0.455 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 23.0 tt0 -126.27 114.72 18.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.867 0.365 . . . . 10.0 110.924 -179.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . 0.443 ' CG2' ' HB ' ' A' ' 391' ' ' THR . 25.5 m -85.22 -9.56 11.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.792 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . 0.411 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 10.0 t70 -52.97 -68.07 0.2 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.363 -0.835 . . . . 10.0 110.99 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 7.8 p -82.4 -50.8 8.49 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.996 -0.547 . . . . 10.0 112.119 -179.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 69.2 mt -55.52 -41.71 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 114.37 1.248 . . . . 10.0 114.37 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 10.8 mt -97.76 -51.95 3.91 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.614 0.968 . . . . 10.0 113.614 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 216' ' ' ILE . . . . . 0.411 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 47.0 mm -70.76 -56.24 11.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 113.387 0.884 . . . . 10.0 113.387 -177.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -74.49 -41.24 61.07 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.87 0.693 . . . . 10.0 112.87 -177.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -91.11 28.21 1.67 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 111.88 0.326 . . . . 10.0 111.88 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -66.78 -52.61 42.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.015 0.436 . . . . 10.0 111.907 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 220' ' ' ARG . . . . . 0.438 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -94.74 16.73 15.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.325 -178.419 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 90.1 m -79.82 116.92 64.51 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 120.819 0.342 . . . . 10.0 110.298 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -92.33 141.49 2.29 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.022 2.481 . . . . 10.0 113.065 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 223' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.71 112.95 25.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.528 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 53.3 mt -115.16 124.43 71.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.405 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 6.5 pt -82.75 173.06 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.974 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 1.4 p -82.63 156.7 23.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.14 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -152.52 157.19 27.14 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 121.291 -0.48 . . . . 10.0 112.042 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -80.14 -23.73 6.21 Favored 'Trans proline' 0 CA--C 1.531 0.365 0 C-N-CA 122.616 2.211 . . . . 10.0 113.885 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -161.77 -168.19 1.89 Allowed 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.872 0.368 . . . . 10.0 111.568 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -147.23 145.54 29.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.149 -0.686 . . . . 10.0 109.149 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 8.5 t70 58.75 -110.87 0.52 Allowed 'General case' 0 N--CA 1.465 0.308 0 O-C-N 123.625 0.578 . . . . 10.0 110.274 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 5.2 p -173.04 115.58 0.27 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.91 0.386 . . . . 10.0 110.708 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.0 -32.47 66.16 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.119 -0.492 . . . . 10.0 111.347 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -63.18 -33.79 76.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.305 0.574 . . . . 10.0 110.461 179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.39 -41.23 80.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.487 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -67.79 -48.48 66.18 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.406 0.521 . . . . 10.0 112.406 -178.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 237' ' ' LYS . . . . . 0.46 ' O ' ' HD3' ' A' ' 241' ' ' LYS . 8.3 ptmm? -63.63 -27.24 69.1 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.914 -0.315 . . . . 10.0 111.573 -178.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 35.7 ttp85 -88.11 -40.33 13.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.643 0.258 . . . . 10.0 111.205 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 2.6 p -67.27 -27.82 40.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 111.722 0.267 . . . . 10.0 111.722 -178.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -77.95 -14.6 59.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.43 0.633 . . . . 10.0 110.126 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 241' ' ' LYS . . . . . 0.46 ' HD3' ' O ' ' A' ' 237' ' ' LYS . 11.7 mptt -97.67 19.17 14.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.43 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 242' ' ' ILE . . . . . 0.477 ' C ' ' HD3' ' A' ' 244' ' ' PRO . 11.3 tt -88.51 -5.69 10.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.596 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 243' ' ' ILE . . . . . . . . . . . . . 54.3 mt -117.67 74.25 8.98 Favored Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.177 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 244' ' ' PRO . . . . . 0.477 ' HD3' ' C ' ' A' ' 242' ' ' ILE . 93.4 Cg_endo -104.46 7.15 0.3 Allowed 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 123.132 2.554 . . . . 10.0 114.212 -179.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.24 15.12 0.9 Allowed 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.872 0.693 . . . . 10.0 112.872 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 62.5 mt -99.21 153.7 18.72 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.501 -0.48 . . . . 10.0 110.691 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 10.7 pt -121.42 165.93 16.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.36 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 3.5 ptt180 -78.66 8.94 4.55 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -88.94 -29.39 19.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.891 0.377 . . . . 10.0 110.446 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 250' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 251' ' ' LYS . 13.8 tt0 -167.4 159.55 12.55 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 250' ' ' GLU . 0.4 OUTLIER 79.2 179.08 0.11 Allowed 'General case' 0 C--O 1.234 0.278 0 O-C-N 124.276 0.985 . . . . 10.0 110.075 -179.119 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 252' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -64.75 97.88 0.24 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.124 0.787 . . . . 10.0 113.124 -178.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -163.4 -45.33 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.62 -1.173 . . . . 10.0 108.28 178.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.08 -179.61 4.45 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.82 179.34 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.06 -35.03 20.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.068 0.461 . . . . 10.0 110.613 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 14.6 t -162.56 -42.41 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 10.0 109.844 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 1.5 t80 59.98 -73.14 0.03 OUTLIER 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.795 0.838 . . . . 10.0 112.225 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 62.31 -170.29 0.17 Allowed 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.051 0.54 . . . . 10.0 110.441 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -85.64 -21.44 53.7 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.56 -0.828 . . . . 10.0 111.421 179.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.85 -53.31 13.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.525 -0.337 . . . . 10.0 110.939 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 77.56 -168.6 54.46 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.755 -0.736 . . . . 10.0 111.483 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -130.61 -92.47 0.42 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.889 0.345 . . . . 10.0 110.112 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -153.79 168.46 26.23 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.643 -0.503 . . . . 10.0 109.643 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 3.0 m -83.65 -9.68 58.71 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.021 0.438 . . . . 10.0 110.082 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.59 -62.64 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.183 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.923 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -140.01 88.27 2.22 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.787 -0.82 . . . . 10.0 108.787 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.94 -47.57 77.2 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.802 -0.635 . . . . 10.0 110.752 -178.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 268' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.62 104.67 0.45 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.578 -0.737 . . . . 10.0 110.637 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 4.8 m -93.78 127.22 39.39 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.856 -179.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 27.0 ttp180 -96.31 78.61 3.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.294 0.569 . . . . 10.0 110.933 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -121.87 133.8 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.745 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 41.4 t -79.25 89.48 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.036 0.446 . . . . 10.0 110.512 -179.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -168.34 -35.42 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.35 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 1.1 tp 69.87 -156.76 0.15 Allowed 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.477 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 6.5 t -132.7 -176.7 4.19 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.628 0.252 . . . . 10.0 110.723 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -164.7 -35.91 0.03 OUTLIER 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.446 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 -79.74 66.34 5.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.085 -0.507 . . . . 10.0 112.006 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . -95.79 -38.28 4.71 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.804 -0.712 . . . . 10.0 111.855 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 2.7 mm? 55.91 -95.05 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.355 0.662 . . . . 10.0 112.36 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 11.5 p -70.73 -24.09 24.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 111.778 0.288 . . . . 10.0 111.778 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 83.9 mt -64.95 -63.0 1.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.913 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 24.2 pt -59.39 -19.98 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.048 -0.524 . . . . 10.0 111.99 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -70.71 -25.03 62.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.922 0.391 . . . . 10.0 110.305 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -89.68 -26.48 20.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.417 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -70.33 -34.82 73.12 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 286' ' ' LEU . . . . . 0.411 ' HG ' ' N ' ' A' ' 287' ' ' VAL . 34.3 tp -64.31 165.49 9.49 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.521 179.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 287' ' ' VAL . . . . . 0.411 ' N ' ' HG ' ' A' ' 286' ' ' LEU . 33.0 t 71.37 161.02 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 109.974 -0.38 . . . . 10.0 109.974 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 81.25 158.94 0.15 Allowed 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.798 0.839 . . . . 10.0 110.901 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 73.92 166.2 0.29 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.339 -0.846 . . . . 10.0 111.607 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 290' ' ' GLY . . . . . 0.475 ' O ' ' HB ' ' A' ' 291' ' ' ILE . . . -82.49 159.36 38.57 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.999 -0.619 . . . . 10.0 112.886 -178.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 291' ' ' ILE . . . . . 0.475 ' HB ' ' O ' ' A' ' 290' ' ' GLY . 78.8 mt 79.35 -47.26 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 123.611 0.764 . . . . 10.0 110.425 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 41.4 ttp -93.95 17.82 11.6 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.199 -1.037 . . . . 10.0 108.199 177.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -77.87 -8.7 58.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.542 -1.208 . . . . 10.0 111.517 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -89.21 176.5 6.93 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.867 0.365 . . . . 10.0 110.739 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -84.62 69.49 3.32 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.203 -0.523 . . . . 10.0 112.815 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -125.13 173.42 8.75 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.153 -0.314 . . . . 10.0 110.153 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 21.0 m -112.39 159.23 18.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.47 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 15.9 tp -85.36 -21.52 28.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.351 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -92.5 5.85 49.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.726 0.298 . . . . 10.0 111.614 -179.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 10.0 m -69.18 141.38 91.53 Favored Pre-proline 0 C--N 1.326 -0.446 0 N-CA-C 110.042 -0.355 . . . . 10.0 110.042 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.44 -27.93 85.78 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.649 2.233 . . . . 10.0 111.885 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -84.75 -4.19 58.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.982 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -122.32 17.86 10.63 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.404 0.621 . . . . 10.0 110.194 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 9.6 tp -63.71 -25.22 37.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.313 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.0 tmm? -63.77 -47.27 81.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.895 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 306' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 309' ' ' HIS . 14.7 tp -70.59 -38.03 73.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.218 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 13.4 tpt -61.42 -42.46 98.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.185 0.517 . . . . 10.0 109.889 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 308' ' ' HIS . . . . . 0.409 ' HE2' ' CG ' ' A' ' 351' ' ' ASP . 5.2 t60 -67.47 -24.09 65.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.294 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 309' ' ' HIS . . . . . 0.423 ' HB2' ' O ' ' A' ' 306' ' ' LEU . 35.5 m170 -71.05 -49.56 43.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.368 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 33.6 m -69.15 -25.78 30.48 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-O 120.798 0.333 . . . . 10.0 110.735 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 88.9 m -62.88 -40.27 97.01 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 312' ' ' ALA . . . . . . . . . . . . . . . -70.72 -39.58 73.3 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.343 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -63.0 -38.25 90.45 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.744 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 19.4 tp -73.4 -34.68 65.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.369 0.604 . . . . 10.0 109.652 178.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 315' ' ' ARG . . . . . 0.693 ' O ' ' HB2' ' A' ' 319' ' ' LEU . 21.1 ttp180 -64.66 -42.34 95.47 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.173 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -88.3 20.57 3.21 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.103 0.478 . . . . 10.0 110.431 179.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -108.06 -59.21 1.88 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.322 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -110.8 -21.32 12.12 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.287 0.477 . . . . 10.0 112.287 -179.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 319' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' A' ' 315' ' ' ARG . 3.9 mm? -78.75 -55.66 5.0 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.944 0.402 . . . . 10.0 110.285 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -99.56 113.55 26.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.277 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.73 142.31 30.45 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.537 0.684 . . . . 10.0 111.726 -179.023 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 322' ' ' ARG . . . . . 0.486 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 4.0 tpt180 -65.49 139.05 58.46 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.35 -0.841 . . . . 10.0 111.616 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 323' ' ' ASP . . . . . 0.486 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 97.2 m-20 83.77 -29.21 0.09 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.311 1.044 . . . . 10.0 113.189 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 2.3 p -103.3 -44.71 9.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 120.705 -0.398 . . . . 10.0 111.574 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -87.57 -40.65 14.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.444 0.64 . . . . 10.0 110.367 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 54.7 p90 -143.36 147.69 35.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.699 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 5.8 tp -123.08 113.96 40.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.336 0.588 . . . . 10.0 110.253 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 21.2 t -90.73 99.27 9.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.795 -0.638 . . . . 10.0 109.489 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 329' ' ' LYS . . . . . 0.442 ' O ' ' HD3' ' A' ' 329' ' ' LYS . 0.0 OUTLIER -117.15 131.14 56.95 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.818 -178.884 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 2.6 p30 42.61 42.24 2.74 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.092 0.957 . . . . 10.0 113.352 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 88.98 -10.64 72.04 Favored Glycine 0 C--N 1.33 0.211 0 C-N-CA 120.836 -0.697 . . . . 10.0 114.531 177.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -103.82 130.6 51.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 117.618 0.709 . . . . 10.0 111.072 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 47.2 t -96.03 102.65 13.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.076 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 43.9 mt -98.56 130.8 46.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.419 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 27.6 mt -83.52 135.31 25.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.4 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 16.3 t -108.57 129.12 63.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.857 0.36 . . . . 10.0 110.304 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -77.33 125.94 30.13 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.387 -0.369 . . . . 10.0 110.537 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -69.2 -30.49 68.69 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.947 0.403 . . . . 10.0 111.12 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -73.7 -65.5 0.82 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -177.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.25 -27.48 26.0 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.716 0.636 . . . . 10.0 112.716 -177.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 77.45 44.82 12.13 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.319 -0.943 . . . . 10.0 112.157 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.9 mmt85 -118.91 144.55 46.35 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.099 -0.334 . . . . 10.0 110.099 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.92 115.8 20.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.873 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 72.6 mtm -113.46 95.84 5.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.982 0.42 . . . . 10.0 110.911 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -81.47 -27.87 34.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.0 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -84.65 49.15 4.19 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.984 -0.627 . . . . 10.0 112.358 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -139.64 126.39 20.66 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -126.73 111.72 14.58 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.768 0.318 . . . . 10.0 110.914 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 75.3 m95 -88.42 139.06 30.87 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.764 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.99 -162.41 0.6 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.408 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 351' ' ' ASP . . . . . 0.409 ' CG ' ' HE2' ' A' ' 308' ' ' HIS . 4.2 t70 61.65 16.59 7.88 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.276 0.631 . . . . 10.0 111.439 179.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 67.8 26.27 73.9 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 116.013 -0.539 . . . . 10.0 113.119 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 50.8 tp -59.35 -52.48 65.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.846 0.323 . . . . 10.0 111.271 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 354' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -78.87 -12.85 60.04 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.827 -0.349 . . . . 10.0 111.267 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 355' ' ' GLN . . . . . 0.441 ' CD ' ' HA ' ' A' ' 368' ' ' GLU . 1.2 mp0 -66.27 -42.92 87.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.035 0.445 . . . . 10.0 110.22 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -69.5 -33.53 72.97 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.131 179.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 94.6 t -62.19 -47.96 90.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.075 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -65.63 -31.93 73.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.924 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -80.51 -20.74 42.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.603 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -89.57 -47.18 8.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.914 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -77.21 168.93 19.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.322 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -81.33 70.4 3.1 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.26 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.0 -176.41 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 122.398 0.279 . . . . 10.0 110.363 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -103.16 148.02 26.29 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.754 -0.461 . . . . 10.0 109.754 179.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 365' ' ' ILE . . . . . . . . . . . . . 72.1 mt -74.11 142.37 14.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.244 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -75.13 -163.26 0.22 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.384 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -74.61 8.05 2.6 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.201 -0.454 . . . . 10.0 112.049 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 368' ' ' GLU . . . . . 0.441 ' HA ' ' CD ' ' A' ' 355' ' ' GLN . 37.9 mt-10 59.94 -96.48 0.06 Allowed 'General case' 0 C--O 1.236 0.384 0 C-N-CA 123.141 0.576 . . . . 10.0 112.494 179.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -146.44 -123.44 0.07 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 121.15 -0.22 . . . . 10.0 111.118 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -173.06 104.95 0.14 Allowed 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 117.788 0.267 . . . . 10.0 111.469 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 46.5 m -159.6 119.52 2.99 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.833 0.349 . . . . 10.0 111.199 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -138.82 -67.35 0.46 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.836 178.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -138.1 147.99 44.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.074 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 374' ' ' SER . . . . . . . . . . . . . 18.9 m -153.82 153.21 31.71 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.42 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.5 tt -146.45 146.22 19.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.754 0.311 . . . . 10.0 110.534 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.71 142.03 28.17 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -56.39 -52.3 65.13 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -56.05 -41.84 75.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.462 . . . . 10.0 110.62 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -69.68 -21.19 63.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.693 -0.685 . . . . 10.0 111.577 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -82.04 -42.71 18.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.857 0.36 . . . . 10.0 110.268 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -70.24 -17.77 63.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.312 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -78.26 -7.48 57.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.835 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 25.5 mt -89.25 -2.86 58.64 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.548 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.604 ' CD2' ' HB3' ' A' ' 206' ' ' ALA . 43.9 m-85 -96.48 137.79 35.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.793 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -70.64 -74.04 0.15 Allowed 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.169 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -88.86 98.51 11.77 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 56.2 tp -109.08 111.48 23.14 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.019 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -124.57 154.78 40.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.987 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -156.02 158.49 28.64 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.21 -0.995 . . . . 10.0 112.573 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 24.5 mtm -115.71 160.88 19.5 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.684 0.278 . . . . 10.0 110.419 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 391' ' ' THR . . . . . 0.443 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 6.6 t -164.31 169.79 17.01 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.111 178.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -93.71 166.21 27.58 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.832 -0.907 . . . . 10.0 110.832 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 393' ' ' THR . . . . . 0.451 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 0.2 OUTLIER -60.77 102.55 0.2 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.558 0.218 . . . . 10.0 110.594 179.719 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -141.79 -29.26 0.62 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.546 0.572 . . . . 10.0 112.546 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 38.8 t70 55.76 -119.63 1.41 Allowed 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 110.12 -0.326 . . . . 10.0 110.12 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 396' ' ' THR . . . . . 0.466 ' HB ' ' OE1' ' A' ' 397' ' ' GLU . 2.3 m 51.99 -100.9 0.1 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.97 0.73 . . . . 10.0 112.97 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 397' ' ' GLU . . . . . 0.466 ' OE1' ' HB ' ' A' ' 396' ' ' THR . 3.7 mp0 -76.91 9.8 2.68 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -58.8 -30.5 67.65 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.247 0.462 . . . . 10.0 112.247 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -72.2 -17.0 61.96 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.103 0.409 . . . . 10.0 112.103 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -81.59 -13.43 58.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.657 0.265 . . . . 10.0 111.277 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -61.16 -44.98 96.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.619 -0.264 . . . . 10.0 111.487 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 11.9 m -74.64 -4.44 37.22 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 48.9 m -111.15 -54.89 2.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.037 0.384 . . . . 10.0 112.037 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 49.3 mt -71.31 -47.95 56.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -106.3 -5.77 18.86 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm 60.5 47.5 8.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.37 0.605 . . . . 10.0 110.288 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 42.0 mt -117.04 135.81 53.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.626 -0.715 . . . . 10.0 109.866 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . 0.648 ' OD1' ' HD2' ' A' ' 13' ' ' ARG . 1.1 t0 -75.69 175.87 8.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 10.2 m -138.78 125.61 21.0 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.947 -0.47 . . . . 10.0 111.881 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 47.2 t -130.97 137.39 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.851 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.9 t -92.74 134.67 29.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 110.195 -0.298 . . . . 10.0 110.195 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 38.8 t -95.16 127.71 41.53 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.125 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -64.19 154.26 71.81 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.843 2.362 . . . . 10.0 112.055 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.3 p -84.11 154.42 23.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.196 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -66.85 -36.66 82.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.284 0.564 . . . . 10.0 109.588 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 41.2 mtm180 -129.45 154.19 80.72 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.001 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.48 115.3 2.94 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.429 2.086 . . . . 10.0 111.973 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 51.1 ttp -75.71 105.37 6.71 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.959 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -97.58 62.06 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.212 0.53 . . . . 10.0 110.936 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 36.2 ttp180 -98.42 115.57 28.78 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 47.0 mtpt -82.95 100.84 10.67 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.495 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 422' ' ' ASP . . . . . 0.446 ' HA ' ' OG ' ' A' ' 584' ' ' SER . 8.2 m-20 -89.0 102.35 14.99 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 68.1 mt -82.82 153.31 67.27 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.295 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.49 168.26 6.87 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.12 2.547 . . . . 10.0 113.444 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -88.17 124.31 33.69 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.312 -0.858 . . . . 10.0 110.706 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 58.3 mt -98.49 86.89 3.7 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.5 -0.556 . . . . 10.0 109.5 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 22.6 t -81.18 129.45 37.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.394 -179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 428' ' ' TYR . . . . . 0.533 ' CE2' ' HA ' ' A' ' 614' ' ' PRO . 6.9 m-85 -112.42 -178.17 3.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.358 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 62.9 mtm -80.99 -74.22 0.33 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.909 -0.317 . . . . 10.0 111.166 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 67.8 p -89.5 162.56 15.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.912 0.387 . . . . 10.0 111.415 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -63.09 -29.8 71.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.175 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -59.43 -46.01 89.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.768 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -61.2 -44.46 97.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.23 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -58.69 -50.3 74.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.544 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 45.7 mm -61.25 -46.0 97.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.904 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 55.9 tp60 -58.13 -43.5 87.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.876 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.52 86.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.811 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 92.0 mt -62.42 -49.64 83.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.051 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 45.6 mm -60.24 -38.76 78.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.253 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -61.83 -44.52 96.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.675 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . 0.6 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 14.8 t70 -63.98 -45.15 90.36 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.161 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 86.6 mt -58.65 -39.62 76.71 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.692 -0.686 . . . . 10.0 110.964 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -58.29 -40.62 82.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.676 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -69.18 -40.14 78.28 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.765 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 17.7 mmt180 -65.66 -45.52 82.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.548 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 7.6 m -63.04 -38.48 91.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.593 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.7 -31.61 72.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.252 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.86 -23.15 25.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.233 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 95.93 29.25 8.71 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.838 -0.696 . . . . 10.0 111.825 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' GLN . . . . . 0.41 ' OE1' ' HD2' ' A' ' 445' ' ' ARG . 64.2 tt0 -101.43 130.99 23.61 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 120.451 0.167 . . . . 10.0 111.046 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.96 140.58 50.63 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.676 2.251 . . . . 10.0 111.282 178.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 23.9 t -121.61 133.69 67.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.692 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 60.4 tp -120.68 106.27 11.57 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 22.5 t -95.09 127.77 46.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.752 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -115.5 115.17 3.34 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.958 -0.639 . . . . 10.0 111.911 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 21.8 p -103.72 148.58 25.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.633 0.254 . . . . 10.0 110.839 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 21.1 pt -92.36 -4.54 10.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.853 0.358 . . . . 10.0 111.107 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 7.5 m -148.82 146.98 28.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.082 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 47.6 mt -63.09 -36.68 76.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.396 -0.366 . . . . 10.0 111.127 -179.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.86 -37.23 71.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.036 0.446 . . . . 10.0 110.326 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -67.48 -40.03 85.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.04 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.87 -43.75 91.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.481 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -61.99 -43.05 99.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.637 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 40.6 tp -65.13 -50.17 67.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.901 -0.591 . . . . 10.0 111.546 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 9.3 p -64.88 -33.93 66.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 121.048 -0.261 . . . . 10.0 111.393 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 71.1 m -65.44 -38.91 91.27 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 120.84 0.352 . . . . 10.0 110.363 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -63.32 -48.27 78.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.261 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . 0.465 ' CD ' ' HZ2' ' A' ' 471' ' ' LYS . 8.7 mm-40 -62.94 -39.7 95.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.76 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 18.8 mt -63.49 -37.24 86.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.891 0.377 . . . . 10.0 110.432 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 20.7 m -68.92 -39.93 79.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.43 0.633 . . . . 10.0 109.807 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.465 ' HZ2' ' CD ' ' A' ' 468' ' ' GLU . 28.5 ttpt -64.7 -32.11 73.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.215 -0.902 . . . . 10.0 110.493 179.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -87.41 -4.61 59.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.293 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 68.31 31.55 74.53 Favored Glycine 0 C--N 1.329 0.169 0 CA-C-N 116.116 -0.493 . . . . 10.0 112.963 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 57.5 mt -101.06 136.68 31.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.731 0.301 . . . . 10.0 110.62 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.479 ' O ' ' HB ' ' A' ' 500' ' ' VAL . 52.8 mttm -61.0 134.63 57.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.135 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 -152.84 125.4 8.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.066 0.46 . . . . 10.0 111.289 -179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -110.13 124.25 51.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.868 -0.606 . . . . 10.0 109.467 178.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 19.1 t -94.16 122.24 45.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.805 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . 0.414 HD21 ' HG3' ' A' ' 487' ' ' GLU . 21.0 mt -79.5 72.83 6.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.429 0.633 . . . . 10.0 110.412 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -68.8 126.03 28.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.473 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -66.95 -18.57 65.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.618 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -72.51 -29.88 63.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.003 0.43 . . . . 10.0 110.567 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -107.71 74.33 0.95 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.955 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -65.71 -32.55 74.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.921 0.391 . . . . 10.0 110.68 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.36 -38.74 90.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.572 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -80.44 -29.88 37.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.098 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.414 ' HG3' HD21 ' A' ' 479' ' ' LEU . 26.4 tt0 -54.49 -47.41 73.07 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.516 -0.766 . . . . 10.0 110.864 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -56.82 -41.45 77.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.288 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -68.64 -41.33 79.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.956 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.2 mt -64.35 -47.82 87.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.911 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 97.4 t -63.58 -36.96 78.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.918 0.389 . . . . 10.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -62.9 -33.95 76.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.672 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -113.0 23.16 13.67 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.972 0.415 . . . . 10.0 111.106 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -73.18 -18.81 61.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.107 0.48 . . . . 10.0 110.928 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -94.38 15.0 64.21 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.867 -0.682 . . . . 10.0 111.744 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -71.27 140.63 85.3 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 110.365 -0.235 . . . . 10.0 110.365 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -56.54 128.11 28.69 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.398 2.065 . . . . 10.0 112.371 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 64.6 32.94 11.14 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.031 179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -111.52 121.6 45.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.566 -0.288 . . . . 10.0 110.274 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' VAL . . . . . 0.479 ' HB ' ' O ' ' A' ' 475' ' ' LYS . 44.5 t -101.92 117.75 47.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.035 0.445 . . . . 10.0 110.927 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.6 m -109.47 135.88 49.77 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.282 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 25.9 mt -115.99 123.47 71.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.706 0.289 . . . . 10.0 110.548 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -122.51 136.89 54.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.777 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 10.3 m -107.48 122.23 46.22 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.702 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 16.7 m120 53.37 68.04 0.9 Allowed 'General case' 0 N--CA 1.465 0.294 0 O-C-N 123.682 0.614 . . . . 10.0 110.743 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.03 135.04 57.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.176 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.9 172.59 12.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.712 -0.677 . . . . 10.0 110.848 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -68.9 167.1 46.17 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 121.009 -0.615 . . . . 10.0 112.422 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.455 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 74.8 mtt180 64.96 -86.71 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.023 0.529 . . . . 10.0 111.179 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.2 133.23 5.68 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.835 -0.697 . . . . 10.0 112.376 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.35 153.88 39.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.714 0.292 . . . . 10.0 111.046 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -76.96 112.98 14.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.806 0.336 . . . . 10.0 110.462 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 82.5 mt -84.56 125.0 40.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.186 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 2.0 t -85.84 125.47 40.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.788 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 72.4 mt -74.99 132.07 41.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.585 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 91.94 -4.31 78.24 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.505 -0.638 . . . . 10.0 111.505 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 113.0 -175.32 16.55 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.608 -0.997 . . . . 10.0 110.608 -179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 1.6 p -123.26 93.83 4.07 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.304 0.552 . . . . 10.0 111.018 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 34.8 p-90 -59.22 -32.99 70.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.009 0.433 . . . . 10.0 110.405 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -66.54 -23.58 66.25 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.32 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -92.96 -33.22 14.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.095 0.474 . . . . 10.0 109.864 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -68.2 -39.83 82.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.748 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 26.8 m -73.53 -23.1 19.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.973 0.416 . . . . 10.0 110.318 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -81.94 -27.67 33.18 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.716 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -66.26 -27.77 68.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.442 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 25.2 mt -75.98 136.5 40.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.979 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -69.33 -32.21 71.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.987 0.422 . . . . 10.0 110.027 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -134.36 88.11 31.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.312 179.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -84.34 103.01 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.462 2.108 . . . . 10.0 112.06 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 20.8 p -75.83 162.7 27.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.52 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -60.37 -34.42 73.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.937 0.398 . . . . 10.0 110.364 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.38 -47.39 76.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.107 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -64.26 -43.08 95.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.826 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 72.4 mt -59.46 -42.78 88.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.609 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.64 -36.84 68.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.541 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 9.5 tptt -64.18 -50.27 68.78 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.327 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.6 -36.05 74.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 110.114 -0.328 . . . . 10.0 110.114 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -62.3 -45.79 91.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.064 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -68.32 -40.5 81.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.449 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.56 -45.16 94.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.574 -0.739 . . . . 10.0 109.454 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 50.0 t90 -61.68 -37.63 84.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.842 -1.072 . . . . 10.0 110.877 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 40.2 tp60 -57.39 -44.9 84.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.778 0.323 . . . . 10.0 110.879 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 42.2 t -64.03 -42.74 96.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.083 0.468 . . . . 10.0 110.314 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -68.83 -38.14 79.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.588 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -62.27 -45.21 94.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.963 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.08 -34.22 77.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.271 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -60.22 -39.39 86.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.732 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 99.6 t -69.69 -39.05 77.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.526 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.88 -45.94 90.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.598 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -69.51 -15.52 63.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.503 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -86.02 -25.86 25.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.974 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 123.89 22.75 2.14 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.567 -0.825 . . . . 10.0 112.896 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 71.12 -162.51 54.14 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.007 -0.616 . . . . 10.0 112.636 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 50.7 tp -74.36 126.71 31.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.089 -0.337 . . . . 10.0 110.089 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 555' ' ' HIS . . . . . 0.402 ' HA ' ' O ' ' A' ' 583' ' ' SER . 65.9 t60 -97.86 110.97 23.44 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.328 -179.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 16.7 mm -92.8 132.88 35.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.427 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 26.4 mt -127.5 124.51 63.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.909 0.385 . . . . 10.0 110.239 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -110.13 129.92 9.62 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 111.32 -0.712 . . . . 10.0 111.32 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 16.1 p -79.58 -34.31 40.96 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.155 0.502 . . . . 10.0 110.62 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -142.04 160.19 40.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.074 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -98.11 150.35 21.53 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.257 -0.645 . . . . 10.0 109.257 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 562' ' ' HIS . . . . . 0.42 ' CE1' HD11 ' A' ' 567' ' ' ILE . 6.3 t-80 -93.91 145.35 24.69 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -62.33 -57.54 10.96 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.2 107.96 6.7 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.064 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 41.8 ttt85 -60.53 -16.96 42.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.952 -0.567 . . . . 10.0 112.275 -178.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -55.85 -41.96 75.1 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 121.236 0.541 . . . . 10.0 110.299 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 567' ' ' ILE . . . . . 0.42 HD11 ' CE1' ' A' ' 562' ' ' HIS . 58.9 mt -84.59 -28.99 6.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.367 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -61.52 -48.08 82.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.415 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -64.13 -36.27 83.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.667 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -70.89 -28.79 64.8 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.196 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . 0.405 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 25.5 tp -66.44 -39.84 89.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.994 0.426 . . . . 10.0 110.467 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 32.5 mtm105 -82.4 -16.03 50.51 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.19 0.519 . . . . 10.0 110.009 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.26 4.2 34.7 Favored Glycine 0 CA--C 1.52 0.355 0 CA-C-N 115.731 -0.668 . . . . 10.0 113.225 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 574' ' ' ARG . . . . . 0.405 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 2.4 mmt180 -77.08 -24.29 51.85 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 3.8 t -106.97 162.39 13.88 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.915 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 66.67 40.91 94.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.224 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -87.43 143.81 27.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.178 -0.305 . . . . 10.0 110.178 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 578' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 105' ' ' GLY . 60.4 mt-30 64.75 23.56 12.74 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.637 0.586 . . . . 10.0 110.371 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 69.85 45.14 59.22 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.524 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -107.52 -167.27 1.24 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.296 -0.261 . . . . 10.0 110.296 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -88.82 167.82 12.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.22 0.533 . . . . 10.0 111.877 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 168.86 166.06 27.29 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.512 -0.635 . . . . 10.0 111.512 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.402 ' O ' ' HA ' ' A' ' 555' ' ' HIS . 4.8 p -152.51 142.38 22.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.919 0.359 . . . . 10.0 110.52 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 584' ' ' SER . . . . . 0.446 ' OG ' ' HA ' ' A' ' 422' ' ' ASP . 84.6 p -126.61 139.67 53.01 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.07 0.462 . . . . 10.0 110.554 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 4.3 tpm_? -135.83 109.42 7.98 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.909 -0.775 . . . . 10.0 108.909 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -102.34 145.31 29.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.269 0.557 . . . . 10.0 111.671 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 587' ' ' TYR . . . . . 0.442 ' HH ' ' HB2' ' A' ' 441' ' ' ASP . 68.6 m-85 -127.5 164.45 21.91 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.193 -0.912 . . . . 10.0 109.39 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 588' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 587' ' ' TYR . 5.5 mt -163.57 166.89 22.01 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.194 -0.299 . . . . 10.0 110.194 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 589' ' ' SER . . . . . 0.401 ' HA ' ' O ' ' A' ' 428' ' ' TYR . 0.3 OUTLIER -139.01 150.43 45.81 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 178.262 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 590' ' ' MET . . . . . 0.404 ' HA ' ' HG3' ' A' ' 595' ' ' MET . 75.3 mmm -68.47 -8.51 41.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.563 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -93.66 2.12 56.41 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.875 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -80.58 154.46 27.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.849 0.357 . . . . 10.0 110.864 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -68.15 -17.86 64.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.746 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 9.1 tp -65.61 -24.01 66.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.992 0.425 . . . . 10.0 110.998 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.404 ' HG3' ' HA ' ' A' ' 590' ' ' MET . 13.6 mmt -73.89 1.63 10.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.652 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -96.84 -3.11 42.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.24 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 24.0 pt -84.9 -3.22 7.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.07 0.462 . . . . 10.0 110.971 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -89.78 1.55 55.99 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.696 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.84 -66.03 0.23 Allowed 'General case' 0 N--CA 1.466 0.35 0 O-C-N 124.001 0.813 . . . . 10.0 111.827 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.7 m -86.74 120.53 28.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.011 0.434 . . . . 10.0 110.918 -179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.16 -19.39 64.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.656 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -61.26 -34.57 75.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.69 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 49.4 t -65.13 -49.36 79.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.067 0.46 . . . . 10.0 109.885 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.0 -35.63 81.08 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.378 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -64.94 -38.02 94.99 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 116.076 -0.511 . . . . 10.0 112.237 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 37.8 tpp -68.16 -28.36 67.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.905 0.383 . . . . 10.0 110.543 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 58.0 mtt -68.28 -24.61 64.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.809 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 80.1 mtt-85 -69.59 -17.99 63.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.866 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -82.39 9.21 9.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.072 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 4.2 tp -78.79 -11.01 59.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.056 0.455 . . . . 10.0 110.461 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 611' ' ' GLY . . . . . 0.44 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 87.79 -45.64 3.36 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.575 -0.821 . . . . 10.0 111.776 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 612' ' ' MET . . . . . 0.44 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.6 OUTLIER 73.36 -56.8 0.65 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.625 0.77 . . . . 10.0 111.912 179.154 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 18.2 mtpp 61.21 80.79 0.25 Allowed Pre-proline 0 N--CA 1.463 0.204 0 O-C-N 123.523 0.515 . . . . 10.0 111.153 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 614' ' ' PRO . . . . . 0.533 ' HA ' ' CE2' ' A' ' 428' ' ' TYR . 32.5 Cg_exo -58.93 106.86 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.018 2.479 . . . . 10.0 112.451 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 120.0 -22.29 8.61 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.921 -0.657 . . . . 10.0 112.009 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -106.1 116.65 32.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.814 0.34 . . . . 10.0 110.1 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -69.14 102.01 1.57 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.873 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 10.5 tp -71.99 -33.09 46.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.174 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 619' ' ' GLU . . . . . 0.402 ' OE1' ' HA ' ' A' ' 619' ' ' GLU . 7.4 mm-40 48.14 86.29 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.428 0.691 . . . . 10.0 112.853 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -120.51 96.75 48.95 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.245 179.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.59 -29.49 85.35 Favored 'Trans proline' 0 N--CA 1.476 0.446 0 C-N-CA 123.49 2.793 . . . . 10.0 114.456 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 56.0 p-90 -63.21 -24.44 67.88 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.638 -0.425 . . . . 10.0 111.374 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 95.9 t -65.71 -48.24 83.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 91.3 m -61.1 -38.86 87.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.463 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -35.22 79.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.27 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -68.7 -45.04 72.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.196 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 77.9 mt -66.28 -41.48 89.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.706 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.03 -41.49 92.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.976 0.417 . . . . 10.0 110.75 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -70.07 -38.77 75.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.125 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -61.36 -42.09 98.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.943 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -58.93 -42.21 89.22 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.299 0.571 . . . . 10.0 110.022 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -70.48 -34.81 72.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.563 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -59.47 -38.05 79.77 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.786 0.327 . . . . 10.0 110.327 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 95.1 t -57.09 -52.64 53.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.423 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -73.07 -25.7 61.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.353 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 56.9 m -64.19 -38.27 90.44 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -77.44 -34.93 54.45 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.21 -0.663 . . . . 10.0 109.21 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 28.6 t30 -64.67 -40.51 95.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.088 -0.96 . . . . 10.0 110.606 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.09 -37.7 83.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.75 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 640' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 3.4 t70 -62.09 -27.6 69.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.084 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 58.0 mt -81.6 -37.24 15.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.408 -0.589 . . . . 10.0 109.408 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 53.9 mtm-85 -62.02 -38.49 88.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.33 179.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 14.6 pttm -65.56 -27.16 68.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.958 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -65.44 -41.7 93.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.159 0.504 . . . . 10.0 109.734 179.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.98 -41.61 77.67 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.043 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 646' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 650' ' ' ASP . 96.1 mt -61.07 -40.7 94.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.696 -0.683 . . . . 10.0 110.939 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -56.46 -36.37 68.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.101 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -83.8 -41.47 17.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.673 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -70.95 -32.09 68.88 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 650' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 0.3 OUTLIER -63.59 -32.58 74.09 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.892 0.377 . . . . 10.0 110.731 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 651' ' ' VAL . . . . . 0.462 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 44.8 t -63.53 -44.08 98.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.382 0.61 . . . . 10.0 109.435 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -73.6 -24.42 60.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.412 -0.813 . . . . 10.0 110.34 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -61.83 -51.57 67.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.584 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.84 -43.93 97.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.798 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 655' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 29.7 mt-30 -61.89 -44.57 96.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.368 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 16.6 ttp-105 -61.79 -42.89 99.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.124 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 45.3 ttp180 -66.39 -43.19 86.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.656 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.7 -47.11 79.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.125 -0.489 . . . . 10.0 112.014 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.8 tp -67.79 -39.84 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 120.935 -0.306 . . . . 10.0 111.389 -179.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -70.55 -31.19 68.14 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.672 -0.411 . . . . 10.0 110.088 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 27.6 t -61.34 -51.0 70.65 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -59.29 -46.52 88.34 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.34 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -60.11 -43.28 95.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.085 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -74.6 -35.19 62.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.756 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -64.57 -43.01 95.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.874 0.369 . . . . 10.0 110.038 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 79.7 mt -76.42 -17.08 59.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.343 0.592 . . . . 10.0 109.98 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 24.4 tp -76.54 -37.44 56.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.247 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -54.38 28.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.584 -0.735 . . . . 10.0 111.288 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 26.8 m -76.39 149.05 6.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.079 -0.509 . . . . 10.0 111.603 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.61 -24.0 16.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.334 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -83.37 108.63 16.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.273 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 7.9 p -113.59 -3.94 11.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.221 0.534 . . . . 10.0 109.863 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -42.16 72.63 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.338 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.85 -46.74 88.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.916 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 3.8 m -64.26 -48.03 77.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.297 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.29 -43.86 82.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.45 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.81 -40.34 75.99 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.045 -0.262 . . . . 10.0 111.372 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 69.6 m -61.43 -44.07 97.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.573 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 45.0 pt -77.26 -23.62 14.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 120.839 -0.344 . . . . 10.0 111.285 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 36.2 ttm-85 -60.4 -46.07 91.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.951 0.405 . . . . 10.0 110.61 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -63.84 -37.84 88.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.744 -0.662 . . . . 10.0 111.014 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -70.29 -47.56 60.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.205 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 75.8 t -59.79 -46.81 93.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.969 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -63.44 -42.72 98.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.482 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.4 tttm -60.54 -50.87 71.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.457 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.81 89.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.908 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 95.5 m -62.84 -46.27 88.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.727 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 95.8 mt -66.29 -41.29 88.79 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 116.58 -0.282 . . . . 10.0 110.381 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -56.61 -29.73 62.46 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.677 0.391 . . . . 10.0 111.921 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -72.97 -23.25 60.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 10.0 112.033 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -111.71 -30.41 7.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.894 0.378 . . . . 10.0 111.184 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 86.1 mt -127.84 108.03 20.34 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.454 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.14 132.1 20.52 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.352 2.035 . . . . 10.0 111.001 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -52.04 116.21 2.64 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.633 2.222 . . . . 10.0 112.69 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 63.57 74.06 0.43 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.801 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 17.1 p -135.25 -162.2 1.23 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.557 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 88.9 mt -98.41 159.29 15.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.598 -0.273 . . . . 10.0 110.585 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.41 -38.63 71.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.883 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -67.24 -16.19 64.14 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.96 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 43.0 mtt -92.49 -6.1 50.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.983 0.42 . . . . 10.0 110.482 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 701' ' ' TRP . . . . . . . . . . . . . 46.5 m0 -90.75 103.67 16.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.431 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -80.81 77.96 7.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.364 0.602 . . . . 10.0 110.006 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 703' ' ' ILE . . . . . 0.476 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.5 mm -61.65 -48.09 90.86 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.304 -0.862 . . . . 10.0 111.197 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 704' ' ' PRO . . . . . 0.476 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.2 Cg_exo -55.85 -47.27 25.94 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 121.889 1.726 . . . . 10.0 112.134 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -65.03 -43.01 96.41 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.033 -0.603 . . . . 10.0 112.293 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 61.9 tp -61.63 -46.58 89.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.767 0.318 . . . . 10.0 110.466 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -63.64 -40.46 96.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.788 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -56.52 -41.62 77.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.994 0.426 . . . . 10.0 110.862 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 709' ' ' ARG . 1.2 tpt180 -75.77 -47.62 25.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.176 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 66.6 mt -60.67 -45.68 93.23 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 44.8 mttt -75.38 -5.88 47.16 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -178.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -116.6 -57.37 2.19 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.09 0.774 . . . . 10.0 113.09 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -89.29 -16.76 30.39 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.929 0.715 . . . . 10.0 112.929 -177.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -108.48 -7.22 15.83 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.14 -0.624 . . . . 10.0 111.603 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.16 27.28 17.07 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.068 0.461 . . . . 10.0 110.786 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 1.9 mp -108.53 100.76 9.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.486 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -86.26 77.25 9.57 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.013 -0.539 . . . . 10.0 109.712 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.64 131.52 21.72 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.346 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 719' ' ' PRO . . . . . 0.475 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 85.4 Cg_endo -83.75 65.81 7.33 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.152 2.568 . . . . 10.0 112.23 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 52.6 mt -59.53 -43.77 91.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.689 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -66.45 -27.27 67.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.022 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 722' ' ' GLU . . . . . 0.475 ' HB2' ' HB2' ' A' ' 719' ' ' PRO . 1.0 OUTLIER -98.58 27.58 4.74 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.776 -179.581 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 4.7 m0 -115.41 -47.44 2.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.636 179.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 94.8 mt -63.84 -21.1 66.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.089 -0.505 . . . . 10.0 112.081 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -78.4 -17.32 56.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.039 0.447 . . . . 10.0 110.613 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -107.39 -29.9 9.0 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.784 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 727' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' A' ' 730' ' ' LEU . 33.7 mt-10 -123.65 87.35 52.44 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.53 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . 0.404 ' HD2' ' OE2' ' A' ' 729' ' ' GLU . 29.0 Cg_exo -63.75 -30.73 69.23 Favored 'Trans proline' 0 CA--C 1.528 0.195 0 C-N-CA 122.577 2.185 . . . . 10.0 112.218 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . 0.404 ' OE2' ' HD2' ' A' ' 728' ' ' PRO . 2.3 mp0 -91.11 20.11 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.411 -0.358 . . . . 10.0 111.258 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 730' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 727' ' ' GLU . 0.5 OUTLIER -66.75 -30.09 70.22 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.829 -0.434 . . . . 10.0 109.829 178.938 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 32.4 m170 62.44 -167.71 0.2 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.54 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.84 -45.0 6.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.164 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -61.22 -55.12 35.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.636 -0.257 . . . . 10.0 111.154 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 734' ' ' THR . . . . . 0.519 ' HB ' ' O ' ' A' ' 730' ' ' LEU . 1.3 m -58.27 -32.89 68.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.839 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 37.5 tp -63.56 -42.94 98.31 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 51.7 mtt180 -62.84 -44.85 95.04 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.949 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -62.09 -36.18 80.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.91 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 20.8 mmm-85 -61.08 -50.64 72.45 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.943 -0.391 . . . . 10.0 109.943 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 59.7 mt -60.08 -43.36 92.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.381 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 34.1 tp -63.29 -48.12 79.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.767 -0.651 . . . . 10.0 111.029 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.18 -40.21 95.62 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.869 0.366 . . . . 10.0 111.014 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -39.36 93.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.919 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 48.3 p -61.27 -38.3 86.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.76 0.314 . . . . 10.0 110.444 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 58.2 mt -70.2 -41.89 78.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.192 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -60.87 -46.59 90.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.553 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 87.6 t -69.49 -37.27 74.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.433 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -61.04 -51.95 67.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.341 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 748' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 21.9 mt-30 -63.84 -28.05 69.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.438 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -46.03 79.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.847 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -67.13 -33.6 75.79 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.154 -0.476 . . . . 10.0 109.824 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.44 -25.24 67.87 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.367 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 752' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 85.5 mt-10 -62.15 -24.8 67.39 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.895 0.332 . . . . 10.0 111.895 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 1.7 t -102.59 4.93 10.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.266 0.555 . . . . 10.0 110.611 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 47.8 t -113.64 -49.68 5.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.17 145.82 6.96 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.047 -0.821 . . . . 10.0 111.047 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 756' ' ' ALA . . . . . 0.454 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -59.98 -66.25 0.55 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.056 0.428 . . . . 10.0 111.785 -178.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.48 -27.48 66.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.068 0.461 . . . . 10.0 110.742 -179.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.5 tpt -66.56 -46.91 74.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.876 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 759' ' ' MET . . . . . 0.406 ' O ' ' HG3' ' A' ' 763' ' ' GLU . 12.4 tpt -62.39 -38.66 90.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.556 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.9 mmp_? -59.13 -35.11 72.9 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.267 0.556 . . . . 10.0 110.41 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -69.96 -38.41 76.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.581 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -65.51 -44.93 85.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.085 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 759' ' ' MET . 84.9 mt-10 -58.95 -49.29 78.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.857 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -59.74 -42.97 94.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.306 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.89 -46.82 92.79 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.946 -0.645 . . . . 10.0 112.011 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.15 -42.09 91.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-O 120.686 0.279 . . . . 10.0 110.637 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 23.7 mtp -59.09 -48.47 81.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.606 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.7 -44.94 92.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.53 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 -59.35 -46.26 89.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.115 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 9.2 m -65.74 -39.94 91.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.974 0.416 . . . . 10.0 110.416 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.2 tt -61.46 -49.88 75.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.942 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -64.29 -30.98 72.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.934 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 7.8 t -64.69 -52.67 55.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.214 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 71.4 mt -72.79 -26.96 61.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.245 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 9.3 t-105 -60.5 -47.01 88.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.621 -0.263 . . . . 10.0 110.835 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.445 ' HZ3' ' HB2' ' B' ' 22' ' ' MET . 8.3 ptpp? -69.96 -31.34 69.02 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.768 -0.373 . . . . 10.0 110.337 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.24 -47.16 74.66 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 38.1 t60 -60.06 -40.46 89.54 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.69 -1.141 . . . . 10.0 110.64 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 19.7 mt -63.46 -46.77 84.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.537 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -65.69 -43.29 89.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.382 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.57 -46.43 89.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.03 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 50.8 mmm -63.1 -41.58 99.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.762 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.21 -46.95 86.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.828 0.347 . . . . 10.0 110.52 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -65.24 -38.81 91.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.03 0.443 . . . . 10.0 110.458 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . 0.498 ' O ' ' HB ' ' A' ' 789' ' ' ILE . 15.8 tp -67.4 -38.89 85.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.468 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -57.06 -42.51 80.73 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.63 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -84.31 -31.86 24.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.388 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -78.74 -26.01 59.46 Favored Glycine 0 CA--C 1.52 0.362 0 C-N-CA 120.695 -0.764 . . . . 10.0 113.054 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 789' ' ' ILE . . . . . 0.498 ' HB ' ' O ' ' A' ' 785' ' ' LEU . 0.4 OUTLIER -57.99 -22.66 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 122.871 0.468 . . . . 10.0 111.506 -179.566 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 33.8 m170 -60.49 -34.23 73.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.631 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 53.9 mt -77.18 -33.43 56.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.535 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -75.49 -13.36 60.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.091 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -79.35 77.18 1.87 Allowed Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 111.153 -0.779 . . . . 10.0 111.153 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -80.0 -176.37 5.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.876 0.369 . . . . 10.0 111.254 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -63.79 142.74 58.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.537 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 67.12 10.92 8.08 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.954 -179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -122.61 126.95 48.73 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.317 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -84.52 120.28 74.02 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.251 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.0 -16.43 49.5 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 122.9 2.4 . . . . 10.0 113.314 -178.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 22.1 mtmm -90.88 -49.6 6.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.947 0.403 . . . . 10.0 110.022 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -65.07 -39.46 93.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.104 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -65.9 -41.97 90.8 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -59.83 -37.03 78.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.479 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -67.01 -25.7 66.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.466 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 44.9 ttp85 -80.16 -47.95 13.92 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -58.1 -43.46 87.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.644 -0.707 . . . . 10.0 111.048 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 3.9 p -66.86 -37.73 85.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.265 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -66.11 -48.44 70.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.555 -0.293 . . . . 10.0 110.416 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 15.0 m -63.11 -34.78 78.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.092 0.472 . . . . 10.0 110.169 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 35.0 ttm -66.78 -36.48 82.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.86 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -70.55 -44.08 68.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.334 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -59.67 -47.07 87.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.385 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.64 81.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.799 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 23.6 ttp -62.78 -36.25 82.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.447 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 95.7 mt -71.88 -30.02 64.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.479 . . . . 10.0 109.876 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 816' ' ' GLU . . . . . 0.463 ' HA ' ' CE ' ' A' ' 819' ' ' LYS . 74.4 mm-40 -69.8 -45.14 68.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.474 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 1.3 p -70.11 -28.73 65.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.615 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 58.8 tp -56.7 -63.15 1.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.705 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 819' ' ' LYS . . . . . 0.463 ' CE ' ' HA ' ' A' ' 816' ' ' GLU . 31.0 pttt -62.31 -32.8 73.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.797 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -60.91 -59.22 5.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.271 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -66.42 -32.58 74.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.309 -0.405 . . . . 10.0 111.584 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 20.3 t -60.87 -53.25 51.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-O 120.792 0.33 . . . . 10.0 110.211 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 33.7 mm -65.36 -37.46 80.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.42 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 45.5 t -58.44 -57.88 10.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.229 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 22.1 m -59.19 -42.61 91.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.377 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 68.2 mt -65.39 -43.26 91.26 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 4.9 m -75.03 -26.06 59.2 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.974 0.416 . . . . 10.0 111.059 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -87.06 11.95 12.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.451 0.538 . . . . 10.0 112.451 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.8 p -64.17 128.98 27.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -101.69 115.26 30.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.035 0.445 . . . . 10.0 111.15 -179.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 4.4 m -135.19 155.26 37.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.607 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 25.3 ptt-85 -74.1 93.25 2.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.168 0.508 . . . . 10.0 110.455 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 72.3 mtp -80.08 139.34 52.99 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.543 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -68.15 147.36 72.81 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.667 2.245 . . . . 10.0 111.701 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.53 105.06 11.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.962 0.411 . . . . 10.0 110.208 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 . . . . . 0 C--O 1.245 0.839 0 CA-C-O 118.562 -0.732 . . . . 10.0 110.332 -179.922 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.767 0.317 . . . . 10.0 110.721 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.0 168.76 20.11 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 41.0 mt -64.12 97.82 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.586 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.6 m -84.31 -31.64 24.76 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.158 0.504 . . . . 10.0 110.528 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 43.5 tp -88.18 110.73 20.92 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.264 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.1 171.99 17.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.133 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -54.52 115.92 2.39 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 123.757 0.661 . . . . 10.0 110.032 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -100.78 14.53 31.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.034 0.445 . . . . 10.0 111.42 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -83.41 87.97 6.98 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.141 0.496 . . . . 10.0 110.541 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -79.42 138.96 37.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.468 -0.787 . . . . 10.0 110.338 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 72.0 mt -111.1 99.89 44.87 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.164 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -68.12 -15.32 42.81 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.068 2.512 . . . . 10.0 112.621 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 70.8 mt -58.2 -34.99 70.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.528 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.48 -48.92 78.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.235 -0.439 . . . . 10.0 112.009 -179.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 32.4 m -79.25 -13.83 13.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.919 0.39 . . . . 10.0 111.569 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.24 -30.77 62.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.062 0.458 . . . . 10.0 110.361 179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 72.8 t -64.26 -41.19 91.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.516 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.23 -25.84 67.33 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.3 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.66 -48.66 30.62 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.87 -26.44 60.58 Favored Glycine 0 N--CA 1.452 -0.292 0 CA-C-N 115.546 -0.752 . . . . 10.0 112.908 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 85.6 t -63.25 -20.99 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 120.952 0.406 . . . . 10.0 111.196 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.445 ' HB2' ' HZ3' ' A' ' 776' ' ' LYS . 2.4 tpt -85.09 -4.49 59.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.865 0.364 . . . . 10.0 111.268 -179.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.4 m -134.67 -174.52 3.61 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.141 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -88.11 62.89 7.01 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -80.09 115.53 19.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.496 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -105.19 -5.44 20.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.892 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 30.3 ttm -83.49 66.97 9.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.798 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.956 0 CA-C-O 118.886 -0.578 . . . . 10.0 110.365 179.916 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 47.4 t . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -126.57 120.58 29.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.703 0.287 . . . . 10.0 110.773 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 109.76 -168.43 13.18 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.117 -0.563 . . . . 10.0 111.94 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.417 ' O ' ' HB3' ' A' ' 16' ' ' ARG . 0.3 OUTLIER -57.0 140.38 49.16 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.942 0.401 . . . . 10.0 110.452 179.472 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.458 ' HD2' ' OD1' ' A' ' 408' ' ' ASP . 16.9 mmt85 -88.98 164.15 15.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.696 -178.143 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.402 ' HB3' ' H ' ' A' ' 15' ' ' ASP . 5.9 t30 64.84 -88.4 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.167 -0.924 . . . . 10.0 112.652 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.402 ' H ' ' HB3' ' A' ' 14' ' ' ASN . 13.9 t70 -55.52 -60.07 3.94 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.825 0.676 . . . . 10.0 112.825 -177.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.417 ' HB3' ' O ' ' A' ' 12' ' ' SER . 11.7 ttt85 -63.56 -38.13 89.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.668 -0.242 . . . . 10.0 111.437 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -57.85 -51.54 69.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.739 0.304 . . . . 10.0 110.982 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.429 HD12 ' O ' ' A' ' 411' ' ' VAL . 45.4 mt -64.72 -35.38 80.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.203 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.7 ttp-105 -66.87 -44.42 80.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.807 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -39.47 90.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.149 0.499 . . . . 10.0 110.133 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 55.4 mtt -71.84 -28.28 63.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.644 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -29.96 69.09 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.366 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -71.07 -39.92 71.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.714 -0.675 . . . . 10.0 109.584 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.1 t -65.84 -38.44 82.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.62 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 98.7 t -58.79 -37.42 66.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.233 178.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -63.4 -41.34 98.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.431 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.1 mt -62.32 -44.65 99.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.079 0.466 . . . . 10.0 109.885 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 48.8 mt -62.66 -44.57 99.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.341 179.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -63.35 -38.77 92.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.787 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.476 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -75.01 -26.06 59.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.477 -0.328 . . . . 10.0 111.531 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 15.9 ttt -84.25 -12.55 54.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.066 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.489 ' OE1' ' HD3' ' A' ' 72' ' ' ARG . 7.1 tt0 -57.2 -51.96 77.74 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 116.371 -0.377 . . . . 10.0 111.34 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 61.1 Cg_exo -54.11 -30.64 61.34 Favored 'Trans proline' 0 C--N 1.363 1.296 0 C-N-CA 122.207 1.938 . . . . 10.0 112.429 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -70.13 -44.24 69.33 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 23.3 mmt -66.92 -31.07 71.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.749 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -63.06 -20.36 65.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.902 0.382 . . . . 10.0 111.0 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.6 mtmt -96.42 1.55 51.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.566 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 mp -100.14 148.85 24.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.095 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.4 p -81.66 166.81 19.82 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -58.58 -38.74 78.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.965 0.412 . . . . 10.0 110.999 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -68.89 -33.14 73.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.977 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -68.55 -35.65 77.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.836 0.35 . . . . 10.0 110.144 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.3 mt -66.58 -46.97 74.24 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -60.64 -33.75 73.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.338 -0.846 . . . . 10.0 110.305 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.64 -33.25 86.72 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 115.538 -0.755 . . . . 10.0 111.873 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -69.09 -36.87 78.06 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.5 m -60.07 -46.25 90.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.946 0.403 . . . . 10.0 110.221 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.37 -34.93 79.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.932 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -62.26 -45.04 95.09 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.995 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -60.36 -42.57 96.03 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.102 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -58.35 -38.23 76.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.872 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.89 -40.38 32.52 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.967 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -60.51 -40.49 91.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.571 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 32.2 mt -63.94 -20.9 66.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.707 0.289 . . . . 10.0 111.62 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -106.34 9.85 31.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.07 0.462 . . . . 10.0 110.857 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -117.52 -50.29 2.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.365 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 168.57 64.51 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.602 -0.809 . . . . 10.0 112.309 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -144.35 149.42 36.12 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.7 t -97.3 142.53 14.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.52 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 39.1 tp -61.3 -47.14 87.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.945 0.403 . . . . 10.0 111.238 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -73.82 1.35 10.74 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.265 -0.425 . . . . 10.0 111.45 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -105.54 -11.05 16.54 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.311 0.577 . . . . 10.0 109.839 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.6 mt -93.56 -4.64 50.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.798 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.452 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 73.9 mt -49.58 -56.64 15.53 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 115.806 -0.634 . . . . 10.0 112.62 -179.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' A' ' 64' ' ' ILE . 11.3 Cg_endo -54.32 -47.28 27.78 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.34 2.027 . . . . 10.0 113.474 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -71.44 -42.96 67.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.84 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.64 -48.25 72.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.898 -179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -63.72 -31.55 72.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.512 -0.313 . . . . 10.0 111.11 -179.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.45 -44.73 93.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.832 0.348 . . . . 10.0 110.288 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 81.9 t -62.82 -43.93 99.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.442 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 40.4 t -64.06 -44.34 97.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.835 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.489 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 1.1 ttm180 -59.01 -39.73 82.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.843 0.354 . . . . 10.0 110.212 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.8 tp10 -68.45 -49.81 57.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.664 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.28 -30.75 69.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.654 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.6 m -57.79 -40.6 80.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.505 -0.316 . . . . 10.0 111.392 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.0 mtmt -77.65 -17.86 57.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.699 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -95.65 -29.92 14.05 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.938 0.348 . . . . 10.0 111.938 -178.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 64.9 t -94.31 -55.51 6.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.618 0.246 . . . . 10.0 111.458 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -90.95 -40.84 11.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.88 0.371 . . . . 10.0 111.039 -179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.45 9.94 34.71 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.681 -0.771 . . . . 10.0 111.94 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.1 mtt -122.83 151.72 41.41 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.444 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 11.7 ttp180 -98.79 138.48 35.88 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.979 0.418 . . . . 10.0 111.192 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.02 110.89 4.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.584 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -56.9 156.88 6.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.299 0.571 . . . . 10.0 112.003 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.38 -38.17 79.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.229 -0.896 . . . . 10.0 111.182 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.77 -31.64 51.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.839 0.352 . . . . 10.0 111.082 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -67.08 -34.04 76.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.82 -36.16 82.69 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.6 mt -66.46 -49.62 66.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.705 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.437 ' O ' ' HG ' ' A' ' 94' ' ' LEU . . . -60.12 -43.85 97.91 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.842 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.26 -32.75 85.22 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.03 -0.605 . . . . 10.0 112.096 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 8.7 ttm -69.2 -42.11 76.21 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.901 -0.407 . . . . 10.0 109.901 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 85.2 t -65.9 -36.42 77.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.656 -0.702 . . . . 10.0 110.071 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 90' ' ' GLY . 79.9 mt -68.14 -8.83 41.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.734 -0.666 . . . . 10.0 111.993 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -81.36 -20.68 40.09 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.499 0.666 . . . . 10.0 109.236 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -102.18 174.56 5.87 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.315 -0.857 . . . . 10.0 110.236 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -83.63 67.88 9.62 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.308 0.575 . . . . 10.0 109.564 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 16.4 m -141.01 161.77 37.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.4 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.0 mm -103.17 131.0 52.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.734 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -110.06 122.97 48.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.891 0.377 . . . . 10.0 111.793 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.608 ' CD ' ' HA ' ' A' ' 393' ' ' THR . 42.5 tt0 -94.72 130.08 41.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.134 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 41.6 mtm -145.34 176.94 9.19 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.707 0.289 . . . . 10.0 110.78 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.47 ' HB2' ' HG2' ' A' ' 106' ' ' GLU . 16.9 mmm180 -105.76 175.77 5.39 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.808 -0.442 . . . . 10.0 109.808 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 18.9 p -77.2 -36.65 54.69 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.757 0.313 . . . . 10.0 111.821 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -72.55 -9.4 73.81 Favored Glycine 0 N--CA 1.453 -0.23 0 CA-C-N 116.08 -0.509 . . . . 10.0 113.888 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.47 ' HG2' ' HB2' ' A' ' 103' ' ' ARG . 3.2 mm-40 -90.86 -1.29 57.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.226 0.513 . . . . 10.0 110.6 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.94 62.16 4.44 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.381 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -52.94 -45.54 67.74 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 111.884 0.327 . . . . 10.0 111.884 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -33.97 76.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.707 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 25.5 tp -70.46 -28.98 65.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.936 0.398 . . . . 10.0 110.494 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 64.8 m -70.81 -30.24 66.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.327 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.17 -15.94 63.56 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.3 0.852 . . . . 10.0 113.3 -178.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 41.1 p -72.41 -25.4 61.47 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 31.1 mt -68.18 -57.26 9.37 Favored Pre-proline 0 CA--C 1.537 0.478 0 N-CA-C 112.411 0.523 . . . . 10.0 112.411 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -62.38 -31.42 81.27 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 121.994 1.796 . . . . 10.0 111.85 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.67 -49.48 68.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.431 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.465 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 59.1 t80 -62.5 -45.74 91.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.961 0.41 . . . . 10.0 110.66 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 62.8 tp -59.77 -49.36 78.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.668 -0.697 . . . . 10.0 111.616 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 14.0 m-80 -72.41 -26.43 61.86 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.13 -26.08 67.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.7 0.286 . . . . 10.0 111.137 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 60.7 mt -60.71 -21.25 62.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.75 -179.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.7 p -79.92 -17.31 53.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.704 0.288 . . . . 10.0 111.027 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.53 6.83 59.59 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.099 -0.572 . . . . 10.0 112.802 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.92 -24.08 44.31 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.857 -0.202 . . . . 10.0 111.326 -179.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 109.21 123.85 4.81 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.342 -0.932 . . . . 10.0 113.546 179.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 68.9 t -102.15 119.05 49.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -99.73 107.13 19.13 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.894 0.378 . . . . 10.0 110.806 -179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 64.0 t -96.27 122.03 47.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.242 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 26.5 t -102.02 110.0 27.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.527 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.52 162.31 13.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.528 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 4.4 m -67.23 -40.42 84.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 111.876 0.324 . . . . 10.0 111.876 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -145.41 161.07 40.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.359 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -64.68 -24.61 67.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.892 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -59.18 -55.85 29.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.474 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 89.8 mt -73.68 -31.49 63.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.512 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.85 -52.0 67.28 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.696 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -33.8 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.417 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -59.17 -57.15 14.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.488 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.32 -29.65 67.53 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.518 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.521 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -60.24 -41.64 93.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.811 0.339 . . . . 10.0 110.69 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -89.16 -25.33 21.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.337 -0.392 . . . . 10.0 111.329 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -75.56 -43.28 49.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.79 0.329 . . . . 10.0 111.466 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.7 m-20 -90.35 -1.92 57.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.936 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 59.2 ttm-85 -60.44 -48.83 92.68 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 116.102 -0.499 . . . . 10.0 112.084 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' PRO . . . . . 0.571 ' O ' ' HB2' ' A' ' 149' ' ' PHE . 34.1 Cg_exo -61.86 -12.69 26.82 Favored 'Trans proline' 0 C--N 1.359 1.092 0 C-N-CA 122.083 1.855 . . . . 10.0 112.946 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.3 tp -88.52 -53.96 4.41 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.982 0.42 . . . . 10.0 110.322 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -70.89 -42.79 69.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.868 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.43 -10.13 59.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.803 0.335 . . . . 10.0 111.54 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.571 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 19.1 t80 -83.97 -26.01 29.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.365 0.603 . . . . 10.0 109.714 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 37.4 mt -95.47 -8.19 36.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.434 -0.803 . . . . 10.0 110.805 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 106.28 15.31 18.02 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.619 -0.8 . . . . 10.0 113.634 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 90.0 mt -101.84 136.76 41.12 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.15 0.475 . . . . 10.0 109.903 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.8 p -90.6 130.18 36.66 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.062 0.458 . . . . 10.0 111.298 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 61.4 t -102.46 120.06 51.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.379 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -111.54 139.63 15.68 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.746 -0.74 . . . . 10.0 111.701 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.2 tp -117.28 130.21 72.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.833 0.349 . . . . 10.0 110.125 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -115.26 129.75 56.72 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.11 -0.495 . . . . 10.0 109.913 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 66.0 mt -121.61 147.8 48.83 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.362 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' PRO . . . . . 0.517 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 17.9 Cg_endo -59.92 102.11 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.212 2.608 . . . . 10.0 112.658 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 110.72 4.03 28.33 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.695 -0.764 . . . . 10.0 112.611 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' MET . . . . . 0.469 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 48.1 ttm -64.33 138.97 97.6 Favored Pre-proline 0 C--N 1.327 -0.394 0 C-N-CA 122.254 0.222 . . . . 10.0 110.696 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -52.06 144.32 37.75 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.801 2.334 . . . . 10.0 112.601 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . 0.432 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.77 -48.34 93.79 Favored Pre-proline 0 CA--C 1.54 0.586 0 N-CA-C 113.054 0.761 . . . . 10.0 113.054 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.432 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.8 Cg_exo -55.51 -41.57 76.58 Favored 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 121.935 1.757 . . . . 10.0 112.39 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -69.16 -39.89 78.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.642 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.469 ' HE2' ' O ' ' A' ' 161' ' ' MET . 58.7 mttm -58.78 -45.12 90.56 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.33 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -59.94 -29.26 68.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.625 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -78.8 -43.63 24.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.919 0.39 . . . . 10.0 110.288 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.7 -38.47 91.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.377 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -78.11 -26.63 48.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.307 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.22 -11.29 59.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.178 0.513 . . . . 10.0 110.424 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -70.84 177.94 3.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.591 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -76.18 -46.31 29.08 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.597 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 49.2 mt -127.49 125.95 66.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.207 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.9 m -111.46 126.87 55.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.408 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -103.33 137.17 41.82 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -179.19 177.19 48.31 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.368 -0.92 . . . . 10.0 112.727 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -93.7 158.86 15.47 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.713 0.292 . . . . 10.0 110.835 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -68.37 -32.65 72.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.816 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -59.68 -53.93 52.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.123 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . 0.517 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.9 tp10 -68.13 -35.6 78.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.768 0.318 . . . . 10.0 110.661 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -54.85 -42.93 72.59 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.286 -0.416 . . . . 10.0 111.005 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -72.84 -41.0 50.95 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.844 -0.694 . . . . 10.0 112.147 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -64.94 -37.39 87.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 10.0 110.464 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . 0.468 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 15.1 m-20 -62.3 -41.76 98.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.021 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -62.13 -41.84 98.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.666 -0.697 . . . . 10.0 110.051 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' A' ' 191' ' ' MET . 67.8 mt -62.35 -45.19 94.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.828 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 58.3 mtm-85 -67.91 -38.94 83.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.888 0.375 . . . . 10.0 110.885 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -62.82 -50.95 68.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.76 -0.655 . . . . 10.0 111.618 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.22 1.66 20.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.569 0.581 . . . . 10.0 112.569 -178.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' MET . . . . . 0.451 ' HB2' ' O ' ' A' ' 187' ' ' LEU . 23.1 ttp -106.52 2.84 26.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.048 0.451 . . . . 10.0 110.568 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.423 ' HB1' ' HB2' ' A' ' 197' ' ' GLU . . . -73.3 167.67 20.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.199 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -105.56 -29.77 9.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.126 0.488 . . . . 10.0 110.004 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.12 144.88 35.7 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.813 179.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.77 -24.87 74.66 Favored 'Trans proline' 0 CA--C 1.527 0.163 0 C-N-CA 122.364 2.042 . . . . 10.0 112.629 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 45.1 mp0 -75.29 -10.44 59.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.361 -0.381 . . . . 10.0 111.384 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.423 ' HB2' ' HB1' ' A' ' 192' ' ' ALA . 46.1 mt-10 -89.03 -3.27 58.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.778 0.323 . . . . 10.0 110.544 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 198' ' ' ARG . 30.5 mtt85 -61.42 158.67 14.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.569 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 4.8 m -136.32 -18.41 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.756 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -88.81 177.87 6.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.15 0.5 . . . . 10.0 111.085 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -137.44 176.6 8.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.462 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.7 tmtm? -60.01 126.95 29.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.277 0.56 . . . . 10.0 111.143 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . 0.413 HD21 ' CZ ' ' A' ' 384' ' ' TYR . 14.2 mt -80.47 91.08 5.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.528 -0.76 . . . . 10.0 109.691 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 29.9 t-80 -99.91 -63.28 1.14 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.295 -0.412 . . . . 10.0 111.082 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -128.54 138.06 52.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.139 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.503 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . . . -133.37 129.55 37.58 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.476 -0.783 . . . . 10.0 109.659 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 45.7 tp -119.53 110.53 17.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.167 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 2.4 p -92.43 126.22 44.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.521 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -58.26 -65.58 0.62 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.617 -0.72 . . . . 10.0 111.269 -179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' GLU . . . . . 0.464 ' CD ' HH21 ' A' ' 509' ' ' ARG . 0.5 OUTLIER -112.64 113.91 26.28 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.923 0.392 . . . . 10.0 110.745 -179.83 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . 0.461 ' CG2' ' HB ' ' A' ' 391' ' ' THR . 27.6 m -76.56 -14.13 14.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.041 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . 0.524 ' OD2' ' HD3' ' A' ' 566' ' ' ARG . 1.1 m-20 -45.91 -78.17 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 124.061 0.851 . . . . 10.0 112.247 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.34 -47.09 9.68 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.455 -0.793 . . . . 10.0 112.17 -178.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 53.2 mt -53.25 -31.89 18.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 N-CA-C 113.876 1.065 . . . . 10.0 113.876 -177.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 10.6 mt -106.26 -58.46 1.92 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 39.1 mm -68.22 -54.46 21.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 113.207 0.817 . . . . 10.0 113.207 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -73.27 -45.04 58.11 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.798 0.666 . . . . 10.0 112.798 -177.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -73.45 1.7 9.25 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.36 0.504 . . . . 10.0 112.36 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.47 -25.37 68.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.689 0.281 . . . . 10.0 111.73 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 220' ' ' ARG . . . . . 0.475 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -114.31 19.38 16.33 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.069 -0.253 . . . . 10.0 111.306 -179.241 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 5.6 m -97.45 106.28 31.48 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 120.951 -0.3 . . . . 10.0 110.605 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 222' ' ' PRO . . . . . 0.475 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 81.7 Cg_endo -92.84 131.46 0.93 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.925 2.417 . . . . 10.0 113.202 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 223' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' A' ' 374' ' ' SER . 47.6 mt -85.56 124.02 31.64 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 83.3 mt -117.68 130.67 72.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.787 0.327 . . . . 10.0 111.663 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 20.8 pt -105.11 138.01 31.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 178.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 3.9 m -80.04 157.95 26.62 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.323 0.49 . . . . 10.0 112.323 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -170.98 110.03 0.34 Allowed Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 110.888 -0.885 . . . . 10.0 110.888 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 228' ' ' PRO . . . . . 0.56 ' O ' ' HB3' ' A' ' 229' ' ' ALA . 65.6 Cg_endo -94.22 106.29 0.14 Allowed 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.066 2.511 . . . . 10.0 114.803 -178.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 229' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 228' ' ' PRO . . . 162.06 69.08 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.886 1.274 . . . . 10.0 108.459 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.76 174.53 7.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.266 -0.879 . . . . 10.0 112.989 -176.268 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.6 -26.77 55.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.913 -1.039 . . . . 10.0 111.175 -179.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 232' ' ' SER . . . . . 0.421 ' HB2' ' HG2' ' A' ' 355' ' ' GLN . 0.6 OUTLIER -55.15 -37.22 66.69 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.745 -178.789 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 49.7 m -57.55 -25.71 60.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.783 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -108.38 -49.17 3.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.055 0.455 . . . . 10.0 111.344 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 48.7 tpp -57.22 -44.6 83.87 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.114 0.783 . . . . 10.0 113.114 -177.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . 0.459 ' HB3' ' CB ' ' A' ' 359' ' ' ALA . 26.7 m-85 -69.37 -17.3 63.67 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -67.81 -26.95 66.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.836 0.35 . . . . 10.0 110.617 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -106.39 -35.91 6.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.664 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 55.6 t -64.86 -45.51 94.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 111.902 0.334 . . . . 10.0 111.902 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -71.84 -5.56 35.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.85 0.357 . . . . 10.0 111.826 -178.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -97.83 -5.67 34.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.741 0.305 . . . . 10.0 110.894 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 49.5 mm -98.42 -31.89 3.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.287 0.565 . . . . 10.0 110.368 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 243' ' ' ILE . . . . . 0.475 ' N ' ' HD2' ' A' ' 244' ' ' PRO . 55.6 mt -54.28 -47.95 95.96 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-N 115.486 -0.779 . . . . 10.0 112.872 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 244' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 243' ' ' ILE . 39.0 Cg_endo -67.22 13.07 0.16 Allowed 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.159 1.906 . . . . 10.0 113.571 179.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 245' ' ' HIS . . . . . 0.436 ' H ' ' C ' ' A' ' 243' ' ' ILE . 10.6 t-80 -114.44 8.42 16.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.226 0.536 . . . . 10.0 110.11 179.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 40.6 mt -89.57 170.47 10.46 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.766 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 72.7 mt -91.93 126.66 44.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.448 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -73.24 71.21 1.19 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.574 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 179.17 -40.41 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.79 -0.641 . . . . 10.0 109.86 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -154.95 159.98 40.8 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.143 -178.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt 76.24 87.89 0.08 Allowed 'General case' 0 N--CA 1.465 0.28 0 O-C-N 124.106 0.879 . . . . 10.0 112.068 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 252' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 55.39 12.23 0.7 Allowed 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 115.018 1.488 . . . . 10.0 115.018 177.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -80.58 -43.48 20.53 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.735 -0.603 . . . . 10.0 109.613 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -99.78 163.36 12.5 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.267 -0.879 . . . . 10.0 109.629 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.66 -24.75 26.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.004 0.431 . . . . 10.0 110.67 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 17.9 m -149.86 -74.26 0.17 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.418 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 12.7 t80 66.23 -71.04 0.09 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.313 0.645 . . . . 10.0 111.687 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 258' ' ' GLN . . . . . 0.44 ' OE1' ' HG3' ' A' ' 277' ' ' ARG . 12.2 tp60 62.61 -178.62 0.14 Allowed 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.136 0.574 . . . . 10.0 110.886 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 259' ' ' GLY . . . . . 0.422 ' H ' ' HG3' ' A' ' 258' ' ' GLN . . . -84.65 49.29 4.21 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.682 -0.771 . . . . 10.0 111.727 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -141.29 -64.49 0.44 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.745 0.307 . . . . 10.0 110.791 -179.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 79.3 -156.79 41.86 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.671 -0.776 . . . . 10.0 111.951 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.65 -162.18 0.85 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -52.14 143.36 14.45 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.389 0.431 . . . . 10.0 111.57 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.07 50.18 0.87 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 10.0 112.076 -178.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 17.1 t -123.45 -41.12 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.312 0.577 . . . . 10.0 109.769 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 266' ' ' ASP . . . . . 0.553 ' OD1' ' HG2' ' A' ' 268' ' ' LYS . 27.3 t0 -134.34 144.24 48.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.25 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -111.67 0.13 16.23 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.594 0.22 . . . . 10.0 111.594 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 268' ' ' LYS . . . . . 0.63 ' HD3' ' O ' ' A' ' 318' ' ' ALA . 5.1 ptpp? -108.07 144.8 34.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.357 0.599 . . . . 10.0 111.459 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 6.2 m -91.63 77.17 5.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.542 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 11.6 ttt85 -71.31 9.33 0.8 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.707 -178.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -92.62 -5.58 51.22 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 122.061 -0.4 . . . . 10.0 110.427 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 59.9 t 74.36 129.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.133 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -166.15 -73.1 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.203 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 9.1 mp 61.68 81.23 0.2 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.688 0.617 . . . . 10.0 111.844 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 29.0 m -138.52 119.48 14.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.618 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -74.47 135.45 42.28 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.719 -0.475 . . . . 10.0 109.719 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 277' ' ' ARG . . . . . 0.44 ' HG3' ' OE1' ' A' ' 258' ' ' GLN . 3.7 ptp180 -160.91 27.64 0.14 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.172 0.511 . . . . 10.0 110.508 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.401 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . -114.05 -44.39 0.74 Allowed Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.978 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 278' ' ' GLY . 4.2 mm? 71.54 -52.71 0.69 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.577 0.751 . . . . 10.0 111.589 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 15.0 p -62.23 -22.23 28.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.943 0.402 . . . . 10.0 111.157 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 22.2 mt -72.91 -65.2 0.83 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.868 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 34.4 pt -58.1 -19.59 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.59 -179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.72 -21.11 64.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.798 0.332 . . . . 10.0 110.791 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.79 -3.12 19.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.169 0.509 . . . . 10.0 110.341 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.7 -34.25 62.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.441 -0.948 . . . . 10.0 108.441 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 6.8 mt -92.16 -156.2 0.45 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.933 -1.031 . . . . 10.0 109.967 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 287' ' ' VAL . . . . . . . . . . . . . 3.4 t 57.99 42.63 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.581 0.705 . . . . 10.0 110.922 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.95 178.16 4.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.495 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 69.18 -162.05 0.18 Allowed 'General case' 0 C--O 1.235 0.308 0 O-C-N 123.579 0.55 . . . . 10.0 110.632 -179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -129.21 34.32 2.84 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.56 -0.829 . . . . 10.0 112.588 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 291' ' ' ILE . . . . . . . . . . . . . 4.1 tt -166.56 127.72 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.785 -0.45 . . . . 10.0 109.785 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 8.9 tpt 64.37 29.76 13.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.598 0.713 . . . . 10.0 109.92 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 293' ' ' ASP . . . . . 0.485 ' CG ' ' HZ2' ' B' ' 7' ' ' LYS . 11.6 p-10 -94.35 1.3 55.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.305 -0.861 . . . . 10.0 111.603 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -75.41 -176.8 3.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.31 -0.405 . . . . 10.0 111.055 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -75.85 70.78 1.98 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 121.022 -0.609 . . . . 10.0 112.462 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -124.21 177.65 5.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.825 0.345 . . . . 10.0 110.699 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 6.4 m -129.02 171.46 12.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.976 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 6.8 tp -87.6 5.59 38.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.197 0.523 . . . . 10.0 110.064 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -104.78 -5.63 21.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.278 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 13.4 m -62.35 124.05 81.01 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.043 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -76.86 4.26 5.85 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.927 2.418 . . . . 10.0 112.432 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -65.13 -36.59 84.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.866 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -153.36 108.51 3.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.674 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 5.1 mp -93.15 -11.2 9.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.4 0.619 . . . . 10.0 110.156 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 305' ' ' MET . . . . . 0.447 ' HG3' ' HG2' ' A' ' 777' ' ' GLU . 71.5 mmm -60.22 -52.86 63.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.192 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 6.1 mp -60.11 -38.96 84.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.524 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 22.3 ttt -60.83 -47.83 84.58 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.618 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -74.84 -25.22 58.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.845 0.355 . . . . 10.0 110.766 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -71.5 -44.42 64.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.516 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 27.5 m -69.74 -37.8 74.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 121.035 -0.266 . . . . 10.0 111.571 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -67.84 -36.94 81.24 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.126 0.489 . . . . 10.0 110.437 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 312' ' ' ALA . . . . . . . . . . . . . . . -66.71 -30.86 71.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.195 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -76.93 -32.78 57.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.208 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.12 -42.53 72.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.542 . . . . 10.0 110.733 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 315' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -67.51 -17.12 64.55 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 120.984 0.421 . . . . 10.0 110.631 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -88.61 10.53 20.2 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.287 0.565 . . . . 10.0 110.235 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 23.9 m80 -118.62 -42.13 2.77 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.832 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.63 ' O ' ' HD3' ' A' ' 268' ' ' LYS . . . -107.74 -50.72 3.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.198 -0.456 . . . . 10.0 112.055 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -60.17 -55.93 27.78 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.698 0.259 . . . . 10.0 111.698 -179.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -102.97 132.49 49.18 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.086 0.469 . . . . 10.0 110.243 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -114.89 136.28 53.28 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.827 -178.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 322' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -66.96 159.51 28.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.989 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 323' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 77.55 -25.24 0.2 Allowed 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.846 0.858 . . . . 10.0 112.387 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 14.2 p -113.96 -40.14 3.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.618 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -93.9 -22.3 18.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.154 0.502 . . . . 10.0 110.927 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -163.1 159.13 22.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.109 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 10.5 tp -140.09 139.1 37.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.011 0.434 . . . . 10.0 109.94 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 43.0 t -102.5 104.29 16.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.312 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -96.96 87.58 4.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.57 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 2.8 t70 53.15 56.48 7.43 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.476 -0.783 . . . . 10.0 111.615 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 93.56 -29.91 7.92 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.709 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -79.59 101.37 8.27 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.83 0.348 . . . . 10.0 111.37 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 23.2 t -79.29 111.73 16.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.201 -0.454 . . . . 10.0 109.848 178.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 84.0 mt -113.42 136.53 49.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.891 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 335' ' ' ILE . . . . . 0.434 ' HB ' ' HB2' ' A' ' 344' ' ' MET . 74.1 mt -82.07 135.05 25.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.254 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 58.6 t -106.93 113.56 43.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.033 0.444 . . . . 10.0 110.115 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.48 128.56 36.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.633 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -84.73 -4.89 59.25 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.039 -0.528 . . . . 10.0 112.179 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -84.94 -55.79 3.89 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.099 -0.376 . . . . 10.0 111.528 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -120.35 -25.15 5.7 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.081 0.401 . . . . 10.0 112.081 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 106.98 29.04 4.75 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.035 -0.826 . . . . 10.0 111.035 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.2 tpp180 -74.83 125.86 29.7 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.865 0.364 . . . . 10.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.56 102.07 13.8 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.942 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 344' ' ' MET . . . . . 0.434 ' HB2' ' HB ' ' A' ' 335' ' ' ILE . 64.1 mtt -86.73 93.46 9.25 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -86.73 -25.06 24.91 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.684 -178.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -95.96 17.81 58.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.458 -0.877 . . . . 10.0 113.137 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 19.8 mmt85 -141.77 145.56 34.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.85 0.325 . . . . 10.0 110.533 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -144.13 144.37 31.55 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.259 -0.428 . . . . 10.0 109.998 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 349' ' ' TRP . . . . . 0.43 ' O ' ' HB3' ' A' ' 354' ' ' HIS . 61.9 m95 -50.61 126.22 14.95 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.724 1.009 . . . . 10.0 113.724 -177.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.88 -163.18 0.99 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.287 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 14.5 t70 63.81 17.51 10.55 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.377 0.608 . . . . 10.0 111.442 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 352' ' ' GLY . . . . . 0.405 ' HA3' ' OE1' ' A' ' 355' ' ' GLN . . . 82.43 23.11 57.37 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.772 -0.728 . . . . 10.0 112.67 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 34.0 tp -91.0 -40.95 11.37 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.067 0.395 . . . . 10.0 112.067 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 354' ' ' HIS . . . . . 0.49 ' HD1' ' CD ' ' A' ' 358' ' ' GLU . 14.5 p80 -62.82 -28.9 70.33 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 122.0 -0.437 . . . . 10.0 110.682 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 355' ' ' GLN . . . . . 0.421 ' HG2' ' HB2' ' A' ' 232' ' ' SER . 18.7 mp0 -68.46 -30.91 69.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.238 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -72.3 -27.98 62.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.203 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 77.0 t -80.77 -46.95 20.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.084 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.49 ' CD ' ' HD1' ' A' ' 354' ' ' HIS . 28.7 mt-10 -67.52 -11.4 57.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.347 -0.842 . . . . 10.0 111.941 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 359' ' ' ALA . . . . . 0.459 ' CB ' ' HB3' ' A' ' 236' ' ' TYR . . . -109.53 -4.01 16.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.775 0.322 . . . . 10.0 111.272 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp -95.38 -54.58 3.35 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.954 0.407 . . . . 10.0 110.169 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -73.33 177.58 5.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.622 -0.717 . . . . 10.0 109.911 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -78.4 57.1 4.11 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 120.724 -0.75 . . . . 10.0 112.941 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 11.0 m -138.54 -172.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 110.181 -0.303 . . . . 10.0 110.181 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 364' ' ' GLN . . . . . 0.46 ' HG2' ' N ' ' A' ' 365' ' ' ILE . 4.7 tt0 -125.05 150.08 47.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.473 -0.33 . . . . 10.0 110.469 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 365' ' ' ILE . . . . . 0.46 ' N ' ' HG2' ' A' ' 364' ' ' GLN . 4.2 mp -63.89 144.21 14.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.28 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 37.0 mm-40 -71.24 -171.0 0.54 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.621 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 367' ' ' ASN . . . . . 0.422 ' ND2' ' HB2' ' A' ' 228' ' ' PRO . 0.2 OUTLIER -72.41 -24.6 61.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 10.0 112.036 -179.021 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 65.31 -161.44 0.27 Allowed 'General case' 0 C--O 1.239 0.521 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 43.2 t30 174.78 119.9 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.607 0.763 . . . . 10.0 109.866 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -129.0 178.74 6.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.239 0.543 . . . . 10.0 111.424 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 56.1 m -85.97 102.23 13.59 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.405 -0.816 . . . . 10.0 110.402 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 53.2 mt -65.79 -46.22 79.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.243 0.544 . . . . 10.0 110.365 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -153.4 154.24 34.09 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.732 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 374' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 4.2 t -153.33 152.92 31.66 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.763 0.316 . . . . 10.0 110.519 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 14.4 tt -156.9 140.51 7.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.47 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.91 147.77 22.56 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.424 178.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -59.44 -37.97 79.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.478 0.18 . . . . 10.0 111.301 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 378' ' ' GLN . . . . . 0.42 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.5 tm0? -59.84 -39.04 83.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.305 0.574 . . . . 10.0 110.12 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -82.96 -2.49 55.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.344 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -101.12 -46.13 5.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.278 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -70.31 -20.66 62.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.169 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 42.8 mtp180 -76.54 -9.05 58.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.805 0.336 . . . . 10.0 111.031 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 80.3 mt -83.25 -19.56 36.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.016 0.436 . . . . 10.0 110.001 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.503 ' CD2' ' HB3' ' A' ' 206' ' ' ALA . 49.1 m-85 -77.39 141.45 39.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.304 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -71.17 -67.61 0.5 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.154 0.502 . . . . 10.0 110.235 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -100.75 102.32 13.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.169 0.509 . . . . 10.0 110.039 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 50.1 tp -111.05 115.72 29.93 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.879 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -121.3 158.21 28.68 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.104 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -154.52 158.28 28.13 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.198 -1.001 . . . . 10.0 112.61 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 39.6 mtm -115.47 154.79 28.66 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 391' ' ' THR . . . . . 0.461 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 14.7 t -149.94 159.52 44.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.533 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -88.49 157.83 28.13 Favored Glycine 0 N--CA 1.441 -1.016 0 N-CA-C 109.99 -1.244 . . . . 10.0 109.99 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 393' ' ' THR . . . . . 0.608 ' HA ' ' CD ' ' A' ' 101' ' ' GLU . 9.5 m -56.69 99.99 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.11 0.455 . . . . 10.0 111.218 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . 0.448 ' HA ' HD21 ' A' ' 569' ' ' ASN . . . -160.11 -27.96 0.06 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.816 -0.629 . . . . 10.0 112.037 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 6.7 t70 59.26 -95.27 0.05 Allowed 'General case' 0 N--CA 1.474 0.729 0 O-C-N 123.326 0.391 . . . . 10.0 110.499 -179.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 5.7 m 55.97 -105.6 0.28 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.045 0.757 . . . . 10.0 113.045 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -84.24 25.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.118 0.414 . . . . 10.0 112.118 -177.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 398' ' ' ALA . . . . . 0.51 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -67.69 -31.02 70.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.9 0.381 . . . . 10.0 110.858 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -65.99 -18.61 65.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.587 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -83.41 -19.67 35.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.682 -0.235 . . . . 10.0 111.235 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 401' ' ' PHE . . . . . 0.51 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 17.5 m-85 -60.56 -42.02 95.74 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.909 0.337 . . . . 10.0 111.909 -179.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 6.8 m -70.39 -19.87 62.98 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.423 0.527 . . . . 10.0 112.423 -178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 26.7 m -98.82 -43.68 6.67 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.998 0.37 . . . . 10.0 111.998 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 60.4 mt -77.87 -62.01 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 112.843 0.683 . . . . 10.0 112.843 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 405' ' ' TYR . . . . . 0.42 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 81.9 m-85 -97.36 -2.7 41.83 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -177.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt 62.73 48.1 4.37 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.161 0.505 . . . . 10.0 110.427 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 16.2 mt -113.2 142.08 46.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.028 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . 0.458 ' OD1' ' HD2' ' A' ' 13' ' ' ARG . 9.5 t0 -80.79 166.09 21.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.599 0.238 . . . . 10.0 110.602 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 2.0 m -118.42 109.18 15.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.717 0.294 . . . . 10.0 110.953 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 42.1 t -121.6 115.91 47.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.966 0.412 . . . . 10.0 110.918 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . 0.429 ' O ' HD12 ' A' ' 18' ' ' LEU . 53.3 t -83.99 108.67 16.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.017 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 58.6 t -79.15 130.47 69.28 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.927 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.21 146.46 81.43 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.49 2.127 . . . . 10.0 111.507 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 74.3 p -89.14 149.34 23.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.809 0.337 . . . . 10.0 111.136 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -83.65 -28.16 28.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 178.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -97.87 128.26 34.57 Favored Pre-proline 0 N--CA 1.448 -0.573 0 CA-C-N 114.765 -1.107 . . . . 10.0 109.13 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.36 124.91 12.19 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.62 2.213 . . . . 10.0 113.451 -178.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 48.9 mtm -90.26 82.1 6.03 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.527 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 5.9 pt -92.31 42.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.118 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 420' ' ' ARG . . . . . 0.552 ' HA ' ' O ' ' A' ' 581' ' ' ALA . 38.5 ttp180 -73.83 137.46 43.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.413 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 83.0 mttt -93.38 95.65 9.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.248 0.547 . . . . 10.0 110.398 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -80.26 125.33 29.74 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.51 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 89.9 mt -109.43 152.08 42.5 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.259 -0.428 . . . . 10.0 109.951 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.77 160.14 42.1 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.586 2.19 . . . . 10.0 112.895 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -81.72 119.6 24.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.568 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 12.6 mt -99.87 102.75 14.25 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.241 0.543 . . . . 10.0 110.661 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 6.0 t -94.65 125.49 47.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.817 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 428' ' ' TYR . . . . . 0.497 ' O ' ' HG2' ' A' ' 590' ' ' MET . 2.7 m-85 -104.29 179.86 4.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.636 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 28.4 mmm -73.54 -76.78 0.12 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.682 0.277 . . . . 10.0 111.383 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 64.4 p -88.26 159.75 17.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.971 0.415 . . . . 10.0 111.389 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.79 -31.5 70.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.624 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -61.63 -38.05 86.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.93 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 433' ' ' GLU . . . . . 0.425 ' HG2' ' HG3' ' A' ' 614' ' ' PRO . 31.8 mt-10 -65.58 -39.42 91.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.039 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -59.53 -48.5 81.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.948 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 41.1 mm -61.81 -43.38 97.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.458 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -56.67 -44.7 81.66 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.709 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.36 -38.91 91.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.732 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 92.4 mt -62.47 -49.91 81.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.658 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 47.9 mm -58.45 -43.25 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.268 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -63.13 -44.81 94.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.717 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . 0.606 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 14.1 t70 -63.56 -44.88 92.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.775 0.321 . . . . 10.0 110.326 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 54.8 mt -59.9 -42.17 88.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.378 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -57.3 -42.8 82.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.5 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.41 ' CD ' ' HZ2' ' A' ' 448' ' ' LYS . 0.1 OUTLIER -62.18 -41.71 98.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.408 179.417 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.606 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 15.7 mmt180 -68.25 -39.63 82.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.485 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 13.3 m -62.94 -37.15 85.88 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.773 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.12 71.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.035 -0.529 . . . . 10.0 111.363 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' LYS . . . . . 0.41 ' HZ2' ' CD ' ' A' ' 444' ' ' GLU . 47.7 mttp -85.48 -19.4 31.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.215 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 89.41 33.55 9.29 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.67 -0.776 . . . . 10.0 111.321 -178.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' GLN . . . . . 0.526 ' OE1' ' HD2' ' A' ' 445' ' ' ARG . 60.2 tt0 -105.37 129.58 24.51 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 120.432 0.158 . . . . 10.0 110.836 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.28 141.71 63.66 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.683 2.255 . . . . 10.0 111.462 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 51.7 t -121.94 128.11 75.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.396 -178.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 57.1 tp -115.07 109.1 17.55 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 18.9 t -95.93 127.93 47.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.358 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -110.26 109.86 2.74 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.887 -0.673 . . . . 10.0 112.391 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 15.9 p -105.06 146.84 28.56 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.397 -0.223 . . . . 10.0 110.397 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 24.3 pt -94.13 -17.66 7.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.829 0.347 . . . . 10.0 111.294 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 23.2 m -130.75 137.85 49.68 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.339 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 39.4 mt -60.4 -32.24 50.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.091 0.472 . . . . 10.0 110.886 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.67 -33.74 71.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.712 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 -33.8 47.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.512 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.3 m -61.33 -43.74 98.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.545 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -68.62 -36.79 79.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.16 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.48 -53.71 50.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.81 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 10.2 p -65.04 -32.7 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 120.775 0.321 . . . . 10.0 110.322 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 47.0 t -65.0 -43.49 92.37 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.464 -0.569 . . . . 10.0 109.464 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -60.4 -49.38 77.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.661 -0.699 . . . . 10.0 110.294 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . 0.418 ' CD ' ' HZ2' ' A' ' 471' ' ' LYS . 10.7 mm-40 -62.16 -38.89 90.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.706 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 24.0 mt -63.16 -38.15 90.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.078 0.466 . . . . 10.0 110.279 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.1 m -72.09 -34.38 68.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.762 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.418 ' HZ2' ' CD ' ' A' ' 468' ' ' GLU . 35.3 ttpt -63.57 -36.91 85.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.437 -0.801 . . . . 10.0 110.004 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -79.45 -30.78 42.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.743 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 97.91 34.31 5.49 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.955 -0.641 . . . . 10.0 112.281 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 70.6 mt -102.71 127.98 55.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.641 0.258 . . . . 10.0 110.849 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -63.63 129.31 39.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.141 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -155.38 153.74 30.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.832 0.349 . . . . 10.0 111.195 -179.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -130.48 132.87 45.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.033 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 19.2 t -100.03 130.0 49.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.356 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 36.6 mt -75.76 94.17 3.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.856 0.36 . . . . 10.0 110.574 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -78.66 108.13 11.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.636 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -65.2 -7.69 13.98 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.888 0.699 . . . . 10.0 112.888 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -88.05 -11.44 47.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.988 0.423 . . . . 10.0 110.254 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -126.66 90.95 3.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.036 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -60.72 -30.67 70.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.3 -179.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.97 -37.25 87.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.069 0.461 . . . . 10.0 109.939 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.66 -38.71 64.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.431 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -52.32 -60.91 2.65 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.692 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -59.63 -36.67 76.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.243 -0.89 . . . . 10.0 111.953 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.41 86.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.876 0.37 . . . . 10.0 111.529 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 83.1 mt -70.91 -45.99 70.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.241 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 71.6 t -58.88 -35.26 55.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 120.836 0.351 . . . . 10.0 111.305 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -59.29 -33.21 70.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.998 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -121.11 24.37 10.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.642 0.258 . . . . 10.0 111.165 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.77 -19.38 62.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.042 0.449 . . . . 10.0 111.198 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -97.88 14.44 62.81 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.858 -0.687 . . . . 10.0 112.023 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -73.4 143.04 82.23 Favored Pre-proline 0 C--N 1.327 -0.407 0 N-CA-C 110.07 -0.345 . . . . 10.0 110.07 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.98 123.8 14.01 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.591 2.194 . . . . 10.0 113.167 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.8 17.65 7.59 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -91.8 113.71 26.05 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.017 0.437 . . . . 10.0 110.315 179.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 33.0 t -92.3 112.05 25.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.598 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 12.0 m -108.35 131.62 54.56 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.526 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 55.5 mt -109.84 117.6 55.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 120.827 0.346 . . . . 10.0 110.311 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -111.95 122.84 48.89 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.811 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 8.8 m -103.28 124.15 48.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.19 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 52.88 68.71 0.79 Allowed 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.864 0.728 . . . . 10.0 110.763 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.0 132.87 36.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.838 -179.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.57 177.02 7.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.066 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -67.09 163.19 45.45 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.125 -0.56 . . . . 10.0 112.486 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.464 HH21 ' CD ' ' A' ' 210' ' ' GLU . 98.5 mtt180 64.83 -92.98 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 122.849 0.46 . . . . 10.0 111.016 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 86.43 141.16 6.22 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.941 -0.647 . . . . 10.0 112.252 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.84 137.06 58.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.762 0.315 . . . . 10.0 110.835 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.17 116.48 8.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.641 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 59.2 mt -80.32 123.12 36.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.557 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 3.4 t -83.31 133.51 28.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.601 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 52.0 mt -70.8 130.49 41.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.566 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 84.65 10.15 79.91 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.103 -0.799 . . . . 10.0 111.103 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 93.55 -175.15 35.57 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 110.432 -1.067 . . . . 10.0 110.432 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 13.0 p -124.68 111.44 15.58 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 117.517 0.659 . . . . 10.0 110.539 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 41.7 p-90 -61.51 -20.2 62.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.049 0.452 . . . . 10.0 110.096 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -59.63 -40.95 89.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.421 -0.809 . . . . 10.0 110.277 178.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -74.63 -32.44 62.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.755 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -70.43 -45.19 66.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.91 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 27.7 m -69.3 -28.36 38.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.966 0.412 . . . . 10.0 110.265 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -75.11 -22.96 57.88 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.498 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -78.29 -24.13 46.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.009 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 63.0 mt -75.7 145.56 40.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.741 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -75.7 -46.0 33.62 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.018 0.437 . . . . 10.0 110.295 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -138.15 84.39 20.61 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.263 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 529' ' ' PRO . . . . . 0.448 ' HA ' ' OE1' ' A' ' 533' ' ' GLN . 64.6 Cg_endo -78.88 104.15 1.76 Allowed 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.758 2.305 . . . . 10.0 112.66 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 72.2 p -82.4 175.07 10.53 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.309 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.11 -39.88 72.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.545 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 57.9 mp0 -60.89 -43.01 99.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.142 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . 0.448 ' OE1' ' HA ' ' A' ' 529' ' ' PRO . 52.4 mt-30 -69.72 -51.14 37.0 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.169 -0.468 . . . . 10.0 110.727 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.04 -42.8 87.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 10.0 111.024 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -64.13 -40.61 96.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.036 0.446 . . . . 10.0 110.45 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.456 ' HG3' ' N ' ' A' ' 537' ' ' ILE . 0.0 OUTLIER -67.1 -43.22 83.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.478 179.804 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . 0.456 ' N ' ' HG3' ' A' ' 536' ' ' LYS . 77.2 mt -64.21 -41.83 93.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-N 116.398 -0.365 . . . . 10.0 110.755 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -59.84 -41.15 90.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.799 0.333 . . . . 10.0 110.547 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -67.36 -45.63 75.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.384 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -42.31 99.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.348 0.594 . . . . 10.0 110.028 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 66.4 t90 -63.81 -38.72 92.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.274 -0.875 . . . . 10.0 110.59 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 31.7 tp60 -56.37 -44.41 80.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.551 -0.295 . . . . 10.0 110.591 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 16.9 t -59.77 -46.7 93.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.033 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -65.49 -44.6 86.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.572 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -57.88 -52.72 64.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.147 -0.933 . . . . 10.0 111.922 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.11 -27.12 63.36 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.657 -178.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.7 91.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.994 0.426 . . . . 10.0 110.065 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 64.7 t -65.5 -43.74 94.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.072 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 24.9 mt -62.29 -41.32 98.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.191 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.85 -36.06 81.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.808 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.16 -38.38 82.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.963 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 148.26 6.74 0.24 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.379 -0.915 . . . . 10.0 113.584 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 82.75 -164.24 42.85 Favored Glycine 0 CA--C 1.516 0.103 0 C-N-CA 120.762 -0.732 . . . . 10.0 112.062 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 36.0 tp -74.06 118.09 16.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.27 0.557 . . . . 10.0 110.864 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -91.45 119.6 31.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.807 0.337 . . . . 10.0 110.808 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 29.9 mm -104.19 132.07 51.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.554 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 557' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.1 mt -128.19 123.04 59.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.972 0.415 . . . . 10.0 110.052 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -106.02 129.72 9.88 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.741 -0.742 . . . . 10.0 111.667 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 23.7 p -86.13 -34.13 20.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.233 0.54 . . . . 10.0 110.584 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -134.14 162.28 32.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.335 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -109.46 138.68 45.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.511 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 66.2 t60 -86.58 141.15 29.22 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -52.21 -63.85 1.01 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.607 0.567 . . . . 10.0 111.037 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.64 131.9 41.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.112 178.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 565' ' ' ARG . . . . . 0.444 ' HA ' ' HB3' ' A' ' 568' ' ' ASP . 9.3 tpt180 -64.1 -19.58 65.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.381 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 566' ' ' ARG . . . . . 0.524 ' HD3' ' OD2' ' A' ' 212' ' ' ASP . 9.9 ttm180 -52.08 -64.64 0.75 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.528 -179.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 25.8 mt -75.59 -28.28 19.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.965 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 568' ' ' ASP . . . . . 0.444 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 20.5 t70 -61.73 -49.28 77.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.245 0.545 . . . . 10.0 111.005 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 569' ' ' ASN . . . . . 0.448 HD21 ' HA ' ' A' ' 394' ' ' ALA . 40.2 t30 -73.12 -31.6 64.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.473 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -67.94 -29.45 68.51 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.773 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 32.1 tp -66.89 -34.08 77.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.443 0.639 . . . . 10.0 109.474 178.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 26.5 ttp180 -83.3 -22.82 32.84 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.15 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -71.88 12.94 2.66 Favored Glycine 0 CA--C 1.522 0.5 0 CA-C-N 115.862 -0.608 . . . . 10.0 113.972 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 574' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 1.5 mmt180 -77.15 -35.48 56.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 117.277 0.538 . . . . 10.0 109.806 179.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.576 ' OG ' ' HA2' ' A' ' 582' ' ' GLY . 41.2 t -94.96 165.29 12.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.422 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 576' ' ' GLY . . . . . 0.57 ' HA3' ' O ' ' A' ' 580' ' ' ASP . . . 76.64 39.07 30.53 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.718 -0.753 . . . . 10.0 111.281 -179.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -111.07 136.71 49.69 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.56 0.219 . . . . 10.0 110.488 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 59.93 21.65 10.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.905 -0.589 . . . . 10.0 112.423 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 105.31 1.75 41.17 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.404 -0.903 . . . . 10.0 113.338 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 580' ' ' ASP . . . . . 0.57 ' O ' ' HA3' ' A' ' 576' ' ' GLY . 2.8 t70 -66.06 148.01 52.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.726 0.298 . . . . 10.0 110.316 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . 0.552 ' O ' ' HA ' ' A' ' 420' ' ' ARG . . . -84.3 -85.54 0.13 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.79 -0.819 . . . . 10.0 108.79 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . 0.576 ' HA2' ' OG ' ' A' ' 575' ' ' SER . . . 83.77 174.71 50.54 Favored Glycine 0 N--CA 1.439 -1.133 0 C-N-CA 120.59 -0.814 . . . . 10.0 113.396 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -153.64 121.44 6.0 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -97.97 110.34 22.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.872 0.367 . . . . 10.0 110.985 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 585' ' ' ARG . . . . . 0.45 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 3.3 tpm_? -119.36 112.96 20.08 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.714 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -106.9 137.68 44.49 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.975 0.417 . . . . 10.0 111.012 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -124.75 141.93 51.76 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 8.6 mt -142.71 171.32 14.21 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.923 0.392 . . . . 10.0 110.863 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.39 155.56 48.23 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.988 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 590' ' ' MET . . . . . 0.497 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 90.7 mmm -71.18 -5.37 31.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.771 0.32 . . . . 10.0 111.131 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -99.33 -4.39 31.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.408 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -73.13 149.73 42.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.369 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -60.25 -17.25 40.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.525 -0.761 . . . . 10.0 112.224 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 20.4 tp -64.2 -28.35 69.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.831 0.348 . . . . 10.0 110.842 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.451 ' SD ' ' HB3' ' A' ' 604' ' ' SER . 14.8 mmt -81.75 5.37 18.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.984 0.421 . . . . 10.0 111.297 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -97.9 -15.92 19.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.439 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 42.6 pt -86.41 11.34 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.188 0.518 . . . . 10.0 110.764 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -90.25 22.56 3.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.799 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.1 -58.42 0.57 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.684 0.794 . . . . 10.0 111.842 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.2 m -127.53 136.62 51.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.746 0.307 . . . . 10.0 110.567 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.11 -20.3 63.9 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.249 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 602' ' ' ARG . . . . . 0.422 ' HD3' ' O ' ' A' ' 602' ' ' ARG . 0.9 OUTLIER -64.64 -33.7 76.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.75 -179.793 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 16.2 t -67.57 -50.19 63.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.177 0.513 . . . . 10.0 109.752 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 604' ' ' SER . . . . . 0.451 ' HB3' ' SD ' ' A' ' 595' ' ' MET . 0.0 OUTLIER -65.93 -35.8 81.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.08 179.173 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -61.25 -28.73 69.68 Favored Glycine 0 N--CA 1.45 -0.433 0 CA-C-N 115.788 -0.642 . . . . 10.0 112.637 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 14.9 tpt -66.6 -32.21 73.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.191 0.52 . . . . 10.0 110.253 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 67.5 mtt -74.12 -11.27 60.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.698 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -77.39 -0.61 26.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.08 0.467 . . . . 10.0 110.686 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -108.31 22.7 15.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.527 179.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.68 -12.29 57.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.436 -0.802 . . . . 10.0 111.235 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 93.67 -57.16 2.27 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.949 -0.643 . . . . 10.0 112.339 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 66.85 -79.34 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.27 0.628 . . . . 10.0 112.219 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? 67.62 95.4 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.34 0 O-C-N 123.67 0.606 . . . . 10.0 110.172 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 614' ' ' PRO . . . . . 0.425 ' HG3' ' HG2' ' A' ' 433' ' ' GLU . 53.6 Cg_exo -51.79 110.62 0.45 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.211 2.607 . . . . 10.0 113.412 -178.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 117.98 -22.21 9.92 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.012 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -92.79 98.44 11.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.189 0.518 . . . . 10.0 110.449 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -95.06 88.11 5.12 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.489 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -86.45 -12.2 11.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.777 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 69.62 142.41 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.66 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -144.13 93.25 6.04 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.337 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -62.73 -29.92 77.76 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.15 2.567 . . . . 10.0 113.805 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 64.8 p-90 -68.82 -17.72 64.05 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.055 0.391 . . . . 10.0 112.055 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 44.2 t -66.07 -51.25 62.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.779 0.323 . . . . 10.0 110.3 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 27.9 m -59.03 -34.65 72.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.233 0.54 . . . . 10.0 110.437 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -68.04 -41.93 81.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.988 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -65.45 -43.65 89.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.523 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 92.1 mt -63.34 -45.11 99.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.686 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -59.49 -42.68 92.71 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.914 0.388 . . . . 10.0 110.721 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -68.5 -39.41 81.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.351 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -62.11 -39.68 93.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.969 0.414 . . . . 10.0 110.154 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -61.46 -46.39 90.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.626 178.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.7 -34.09 69.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.432 -0.803 . . . . 10.0 110.915 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -62.75 -48.15 80.45 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.95 0.405 . . . . 10.0 110.519 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 48.1 t -62.97 -43.29 98.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.477 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -64.54 -43.23 94.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.676 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 49.9 m -62.91 -32.89 74.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.991 0.424 . . . . 10.0 110.161 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -67.89 -42.81 80.62 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -65.59 -40.29 92.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.302 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -59.38 -40.57 86.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.255 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 640' ' ' ASP . . . . . 0.565 ' O ' ' HG2' ' A' ' 644' ' ' GLN . 33.1 t70 -60.11 -43.59 95.48 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 179.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 58.2 mt -66.11 -43.03 92.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.159 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 642' ' ' ARG . . . . . 0.418 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 7.6 mtm-85 -59.77 -40.71 89.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.731 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 19.7 ttpp -60.85 -41.98 96.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.494 -0.776 . . . . 10.0 110.599 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 644' ' ' GLN . . . . . 0.565 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 9.8 mm100 -64.07 -43.33 95.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.577 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 87.3 mt -63.97 -44.14 93.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.198 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 646' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 97.1 mt -66.09 -30.24 70.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.277 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 647' ' ' GLU . . . . . 0.407 ' CD ' ' HZ3' ' A' ' 804' ' ' LYS . 1.0 OUTLIER -61.07 -27.79 68.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.24 -179.75 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -100.61 -32.41 10.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.888 0.375 . . . . 10.0 110.731 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -35.69 80.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.234 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -69.73 -22.98 63.34 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.988 0.423 . . . . 10.0 110.897 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 651' ' ' VAL . . . . . 0.425 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 48.5 t -64.71 -47.18 89.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.163 -0.68 . . . . 10.0 109.163 178.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -70.7 -28.49 64.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.517 -0.765 . . . . 10.0 109.503 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -60.79 -52.31 65.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.617 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -60.04 -45.95 91.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.937 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 655' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 35.5 mt-30 -62.2 -41.73 98.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.626 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 11.4 ttp-105 -63.8 -48.53 76.52 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 52.0 ttp180 -57.54 -44.92 85.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.91 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.19 -53.55 51.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.902 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 8.5 tp -66.21 -33.31 62.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 121.028 -0.269 . . . . 10.0 111.356 -178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -69.86 -33.49 72.33 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 110.257 -0.275 . . . . 10.0 110.257 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 57.1 m -65.08 -39.13 92.78 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.78 -44.22 74.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.712 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 44.5 ttt-85 -62.97 -37.84 88.71 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.238 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -68.6 -35.71 77.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.325 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.62 -51.51 64.9 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 52.0 mt -65.91 -18.25 65.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.601 -0.727 . . . . 10.0 110.472 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 47.6 tp -80.42 -44.43 19.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.457 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.49 -43.15 60.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.991 -0.549 . . . . 10.0 112.351 -178.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 34.3 m -67.68 149.31 11.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.203 0.525 . . . . 10.0 111.73 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.47 -31.71 11.85 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.672 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -101.61 146.47 27.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.125 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 9.5 p -143.47 10.75 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.958 0.409 . . . . 10.0 110.69 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.85 -43.61 86.01 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.036 0.446 . . . . 10.0 110.942 -179.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -62.33 -50.34 72.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.84 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 1.8 m -56.95 -46.41 82.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.022 -0.536 . . . . 10.0 111.33 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 46.4 mm -61.73 -44.23 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.942 0.401 . . . . 10.0 110.932 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -67.27 -41.41 85.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.459 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 40.2 m -62.35 -44.98 95.21 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 47.2 pt -74.79 -26.38 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 C-N-CA 120.535 -0.466 . . . . 10.0 110.669 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -59.63 -42.04 91.82 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.209 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -60.88 -47.13 87.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.657 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.75 -47.7 77.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.152 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 81.0 t -58.66 -51.91 66.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.314 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -60.57 -42.84 97.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.126 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.1 tttm -63.39 -49.77 72.49 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 121.16 -0.216 . . . . 10.0 110.554 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.92 -41.85 88.3 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.44 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 23.9 m -65.41 -40.77 93.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.022 0.439 . . . . 10.0 110.597 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 84.1 mt -67.43 -42.2 86.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.487 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -57.23 -24.96 58.14 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 122.755 0.422 . . . . 10.0 111.946 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -75.63 -28.45 58.82 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -108.21 -24.64 11.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.096 0.474 . . . . 10.0 111.161 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 84.6 mt -132.91 99.89 14.87 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.41 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -62.14 139.91 80.89 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.427 2.085 . . . . 10.0 111.571 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.82 113.88 1.59 Allowed 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.813 2.342 . . . . 10.0 112.855 -179.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 58.13 67.37 0.96 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.215 -0.902 . . . . 10.0 111.942 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 14.3 p -127.35 177.81 6.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.199 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 18.6 mt -75.88 154.54 35.99 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.18 -26.98 65.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.378 . . . . 10.0 111.598 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -67.06 -14.23 62.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.554 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -104.96 7.43 34.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.626 -0.261 . . . . 10.0 111.041 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 701' ' ' TRP . . . . . . . . . . . . . 41.7 m0 -101.23 106.3 17.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.742 0.306 . . . . 10.0 111.099 -179.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 58.7 t0 -82.51 77.58 9.26 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 703' ' ' ILE . . . . . 0.493 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 24.2 mm -57.76 -49.9 91.17 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.652 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 704' ' ' PRO . . . . . 0.493 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 32.2 Cg_exo -60.14 -42.0 46.9 Favored 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 121.894 1.729 . . . . 10.0 111.718 179.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -63.81 -44.8 95.67 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.622 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 55.6 tp -65.06 -40.99 95.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.189 -0.301 . . . . 10.0 110.189 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -62.04 -48.11 81.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.512 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -59.42 -42.23 91.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.02 -0.537 . . . . 10.0 110.235 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -63.46 -43.44 97.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.548 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 49.6 mt -64.07 -42.62 96.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.297 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 14.3 mtpp -76.1 -6.05 49.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.881 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -111.84 -56.54 2.37 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.484 0.55 . . . . 10.0 112.484 -178.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -83.73 -19.22 35.56 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.879 0.696 . . . . 10.0 112.879 -177.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -123.02 -8.92 8.27 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.465 -0.494 . . . . 10.0 112.123 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.98 21.79 12.59 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.019 0.438 . . . . 10.0 110.758 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 12.8 tp -97.65 109.88 22.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.407 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -91.47 92.32 8.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.918 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 40.0 mt -123.4 122.7 26.65 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.399 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -82.36 77.99 3.57 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.8 2.334 . . . . 10.0 112.186 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 44.7 mt -61.43 -37.24 77.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.197 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.45 4.35 4.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.883 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -109.18 -0.88 19.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.865 0.364 . . . . 10.0 110.211 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 15.9 m0 -114.44 -44.92 3.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.676 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 11.1 tp -60.33 -16.51 35.47 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.358 0.873 . . . . 10.0 113.358 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -90.27 -32.67 16.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.994 0.426 . . . . 10.0 111.075 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 726' ' ' LYS . . . . . 0.507 ' O ' ' HD3' ' A' ' 728' ' ' PRO . 40.3 mttp -93.34 -23.19 18.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.925 -178.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -109.36 94.74 16.54 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-O 120.752 0.311 . . . . 10.0 110.725 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . 0.507 ' HD3' ' O ' ' A' ' 726' ' ' LYS . 11.7 Cg_exo -71.66 -16.81 30.06 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.939 2.426 . . . . 10.0 112.41 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.28 21.42 17.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.111 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.73 -28.35 66.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 731' ' ' HIS . . . . . 0.404 ' HB3' ' H ' ' A' ' 732' ' ' GLU . 0.2 OUTLIER 61.71 -134.58 0.57 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.44 179.312 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 732' ' ' GLU . . . . . 0.404 ' H ' ' HB3' ' A' ' 731' ' ' HIS . 0.0 OUTLIER -128.35 -56.25 1.24 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.066 0.46 . . . . 10.0 110.564 -179.517 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 733' ' ' GLU . . . . . 0.5 ' HG2' ' N ' ' A' ' 734' ' ' THR . 20.2 pm0 -60.67 -38.95 86.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.758 -0.655 . . . . 10.0 111.8 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 734' ' ' THR . . . . . 0.5 ' N ' ' HG2' ' A' ' 733' ' ' GLU . 0.1 OUTLIER -65.68 -27.59 68.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.974 0.416 . . . . 10.0 110.794 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 50.2 tp -69.04 -40.41 78.6 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 -64.38 -41.15 96.84 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.858 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -60.21 -40.82 91.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.701 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 21.6 mmm-85 -61.15 -50.64 72.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.795 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 55.4 mt -60.38 -43.6 94.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.652 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 16.5 tp -63.93 -50.95 66.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.001 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.83 86.54 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.24 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -64.95 -39.51 93.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.744 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 24.5 p -63.44 -33.54 75.77 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.062 0.458 . . . . 10.0 110.033 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 744' ' ' ILE . . . . . 0.525 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 66.7 mt -70.41 -43.98 77.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -48.93 79.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.34 -0.846 . . . . 10.0 111.114 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 57.9 t -64.32 -36.66 77.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.065 0.46 . . . . 10.0 110.261 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.48 -43.22 99.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.332 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 748' ' ' GLN . . . . . 0.525 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 23.4 mt-30 -58.75 -37.93 77.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.748 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -46.01 90.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.477 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -65.5 -37.56 87.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.08 0.467 . . . . 10.0 109.888 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -64.1 -41.89 97.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.222 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -64.52 -29.82 70.85 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 54.9 t -78.74 -48.96 21.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.824 0.345 . . . . 10.0 111.37 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 38.9 t -74.07 -52.04 21.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.961 0.41 . . . . 10.0 111.637 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 139.77 141.61 4.09 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.301 -0.719 . . . . 10.0 111.301 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 756' ' ' ALA . . . . . 0.492 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -60.94 -63.2 1.38 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.783 0.291 . . . . 10.0 111.458 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -60.19 -37.87 81.54 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.729 0.299 . . . . 10.0 110.701 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 14.6 tpt -61.19 -45.21 95.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.27 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 45.0 mmm -65.23 -41.34 94.48 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.49 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.4 mmp_? -59.35 -41.4 89.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.255 0.55 . . . . 10.0 109.997 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -70.48 -33.86 71.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.829 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -65.24 -52.41 54.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.542 -0.754 . . . . 10.0 109.772 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -58.91 -45.31 90.64 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.175 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 764' ' ' LYS . . . . . 0.402 ' O ' ' HG ' ' A' ' 768' ' ' LEU . 50.9 tttp -56.11 -47.7 77.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.163 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -68.64 -38.88 86.53 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 121.003 -0.617 . . . . 10.0 112.079 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 30.2 t -61.89 -45.41 98.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 110.523 -0.177 . . . . 10.0 110.523 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 37.8 mtp -59.2 -46.13 89.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.73 -0.213 . . . . 10.0 110.516 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 768' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 764' ' ' LYS . 85.1 mt -64.46 -47.92 77.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.494 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -58.42 -46.58 86.19 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.94 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 19.3 m -63.7 -38.77 92.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.925 0.393 . . . . 10.0 110.563 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.65 -50.56 72.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.788 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.46 -29.95 71.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.702 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 773' ' ' SER . . . . . 0.47 ' HA ' ' HZ3' ' A' ' 776' ' ' LYS . 69.1 m -68.05 -43.86 77.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.911 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.16 -25.44 34.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.731 0.301 . . . . 10.0 111.109 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 27.2 t-105 -63.68 -49.45 73.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.565 -0.289 . . . . 10.0 111.3 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.47 ' HZ3' ' HA ' ' A' ' 773' ' ' SER . 8.5 ptpp? -59.58 -39.26 83.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.81 0.338 . . . . 10.0 110.547 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 777' ' ' GLU . . . . . 0.447 ' HG2' ' HG3' ' A' ' 305' ' ' MET . 10.6 tt0 -68.42 -39.93 81.4 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.204 0.526 . . . . 10.0 109.985 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 68.0 t60 -62.24 -38.17 88.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.274 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 80.7 mt -65.41 -47.16 77.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.488 179.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -63.81 -46.16 86.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.759 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -60.56 -41.62 94.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.128 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 51.1 mmm -63.16 -42.33 99.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.734 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -68.31 -36.64 79.62 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.099 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -69.69 -32.99 71.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.43 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.55 -37.29 60.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.962 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -60.96 -50.79 71.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.35 -0.841 . . . . 10.0 111.075 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -70.29 -16.51 63.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.944 0.402 . . . . 10.0 110.986 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -97.93 11.23 64.24 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.015 -0.612 . . . . 10.0 112.224 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 16.3 tt -61.77 -19.71 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 121.056 0.455 . . . . 10.0 111.069 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -64.95 -25.8 68.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.332 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 34.9 tp -98.99 -16.47 18.71 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.314 0.578 . . . . 10.0 110.437 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 792' ' ' ARG . . . . . 0.484 ' HD2' ' OE2' ' A' ' 806' ' ' GLU . 12.8 mmt180 -82.91 -45.0 14.73 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.637 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -74.93 107.22 2.23 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.735 -0.745 . . . . 10.0 112.263 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 26.4 p90 -99.73 176.59 5.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.892 0.377 . . . . 10.0 111.046 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -63.36 149.31 46.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.348 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 65.33 25.65 12.1 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.648 -0.706 . . . . 10.0 111.094 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -147.01 152.73 39.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.601 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -100.26 134.52 20.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.137 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.99 -27.44 84.78 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.676 2.25 . . . . 10.0 112.0 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -81.46 155.39 25.86 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 73.09 -49.43 0.7 Allowed 'General case' 0 N--CA 1.468 0.448 0 O-C-N 123.578 0.549 . . . . 10.0 111.166 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . 0.447 ' OE2' ' HD3' ' A' ' 805' ' ' ARG . 3.1 tp10 -65.16 -47.65 76.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.069 0.461 . . . . 10.0 109.83 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -61.8 -34.73 76.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.87 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 804' ' ' LYS . . . . . 0.407 ' HZ3' ' CD ' ' A' ' 647' ' ' GLU . 95.2 mttt -63.63 -36.24 83.17 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.922 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 805' ' ' ARG . . . . . 0.447 ' HD3' ' OE2' ' A' ' 802' ' ' GLU . 44.8 mtp180 -58.5 -43.59 89.1 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.153 0.502 . . . . 10.0 109.718 178.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 806' ' ' GLU . . . . . 0.484 ' OE2' ' HD2' ' A' ' 792' ' ' ARG . 2.8 mm-40 -62.6 -44.79 95.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.964 179.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 6.2 m -61.02 -39.82 91.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.713 -0.676 . . . . 10.0 110.966 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -71.99 -38.01 69.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.865 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 40.2 m -62.94 -39.66 95.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.06 0.457 . . . . 10.0 109.946 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 18.9 ttm -66.74 -37.21 84.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.086 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 811' ' ' PHE . . . . . 0.419 ' O ' ' HG ' ' A' ' 815' ' ' LEU . 27.4 t80 -65.7 -41.98 91.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.348 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.29 -45.88 92.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.654 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.72 -37.27 85.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.13 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 22.9 ttt -62.83 -44.31 96.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.597 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 815' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 811' ' ' PHE . 94.1 mt -62.06 -41.53 98.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.846 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -64.21 -45.95 86.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.241 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 11.7 m -65.02 -35.8 82.34 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.992 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 63.6 tp -56.07 -51.01 69.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.639 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -62.49 -42.09 99.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.225 0.536 . . . . 10.0 110.399 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -58.88 -57.45 12.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.196 -0.911 . . . . 10.0 111.629 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -59.97 -42.95 95.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.076 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 30.4 t -58.44 -52.55 57.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.561 0.219 . . . . 10.0 110.614 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 35.4 mm -63.77 -41.24 91.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.695 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 37.1 t -56.83 -49.42 75.47 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.736 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 16.7 m -63.16 -37.96 89.28 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.323 -0.398 . . . . 10.0 111.75 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 93.5 mt -75.56 -17.03 60.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.553 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 16.3 m -95.94 -41.75 8.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.997 0.427 . . . . 10.0 110.627 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -77.34 -1.01 27.78 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.867 -0.606 . . . . 10.0 112.453 -178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.0 p -64.59 118.37 6.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.439 0.638 . . . . 10.0 110.065 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -80.44 106.16 12.25 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.237 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 61.5 t -119.66 137.87 52.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.148 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 27.9 ptt-85 -63.83 133.95 54.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.06 0.457 . . . . 10.0 110.635 179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -93.05 136.97 23.97 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.235 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -78.81 -162.45 0.18 Allowed 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.669 2.246 . . . . 10.0 112.363 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.55 105.95 4.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.66 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.5 -0.762 . . . . 10.0 110.188 179.788 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.597 ' HG3' ' SD ' ' B' ' 2' ' ' MET . 16.1 tpt . . . . . 0 N--CA 1.478 0.945 0 N-CA-C 110.287 -0.264 . . . . 10.0 110.287 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' MET . . . . . 0.597 ' SD ' ' HG3' ' B' ' 1' ' ' MET . 0.4 OUTLIER -112.32 109.59 19.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.705 -0.225 . . . . 10.0 110.918 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 25.1 pt -136.11 158.85 38.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.186 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 23.9 p -93.0 153.9 18.46 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.368 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . 0.431 ' O ' ' HD3' ' B' ' 7' ' ' LYS . 10.5 tp -66.24 131.31 45.85 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.711 -0.477 . . . . 10.0 109.711 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 1.5 tpp180 -94.68 86.58 4.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.193 0.521 . . . . 10.0 110.015 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . 0.485 ' HZ2' ' CG ' ' A' ' 293' ' ' ASP . 0.0 OUTLIER -85.64 154.67 21.53 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.565 -0.743 . . . . 10.0 110.352 -179.738 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 20.6 ttp-105 -80.14 -25.37 39.9 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 178.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -95.61 120.32 35.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.115 -0.948 . . . . 10.0 108.724 178.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 23.6 pttt -142.94 108.82 5.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.73 0.3 . . . . 10.0 110.78 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 18.2 tp -166.92 70.22 1.02 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.974 0.416 . . . . 10.0 110.546 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -71.79 -26.57 19.01 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.484 2.123 . . . . 10.0 111.688 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.59 1.57 22.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.333 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.47 -36.57 61.78 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.398 -0.365 . . . . 10.0 111.904 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 14.5 t -64.65 -60.38 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.788 0.328 . . . . 10.0 111.142 -179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.27 88.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.855 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.29 -42.39 95.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.733 0.301 . . . . 10.0 110.706 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.73 -39.87 88.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.858 0.361 . . . . 10.0 111.144 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.83 -13.4 59.9 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.31 0.576 . . . . 10.0 110.764 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -89.15 -7.03 70.61 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.486 -0.779 . . . . 10.0 112.7 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 64.8 t -59.96 -39.41 80.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-O 120.958 0.409 . . . . 10.0 110.048 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.446 ' HB3' ' HE2' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -78.04 77.89 4.53 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.114 0.483 . . . . 10.0 109.966 178.998 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.2 m -146.34 -164.91 2.08 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.251 -0.886 . . . . 10.0 109.323 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.1 123.75 18.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.943 0.401 . . . . 10.0 110.613 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -90.63 103.81 16.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.61 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.71 85.01 2.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.332 0.586 . . . . 10.0 110.736 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 50.3 mtm -80.31 113.91 18.83 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.652 -0.704 . . . . 10.0 111.073 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.56 -0.733 . . . . 10.0 110.267 179.375 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 38.3 t . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.614 0.245 . . . . 10.0 110.385 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -77.09 150.23 35.68 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.864 -179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 142.58 165.16 10.46 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.842 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.411 ' H ' ' HD3' ' A' ' 16' ' ' ARG . 0.7 OUTLIER -57.28 133.45 55.11 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 122.413 0.285 . . . . 10.0 110.566 179.661 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.499 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 5.1 mmp_? -58.52 137.72 57.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.739 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 68.17 -83.67 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.328 -0.851 . . . . 10.0 112.543 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -41.08 -68.13 0.2 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.497 1.295 . . . . 10.0 114.497 -177.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.411 ' HD3' ' H ' ' A' ' 12' ' ' SER . 44.0 ttt180 -64.32 -43.01 96.01 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.48 0.548 . . . . 10.0 112.48 -177.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.89 -39.34 88.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.15 0.426 . . . . 10.0 112.15 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.5 mt -61.17 -53.94 50.66 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.08 0.4 . . . . 10.0 112.08 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -66.66 -24.22 66.25 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.57 -0.452 . . . . 10.0 110.953 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.07 -42.44 56.89 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 60.5 mtt -68.5 -32.3 72.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.817 -0.628 . . . . 10.0 109.667 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -57.5 -32.96 67.54 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.453 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -63.36 -43.72 96.85 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.182 0.515 . . . . 10.0 109.843 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.64 -41.94 91.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.391 -0.822 . . . . 10.0 109.943 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.5 t -60.72 -37.07 74.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.681 -0.69 . . . . 10.0 110.117 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -63.24 -43.12 98.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.66 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 82.3 mt -61.95 -45.57 98.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.986 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 55.8 mt -59.66 -40.29 81.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.346 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -63.84 -33.55 75.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.862 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.436 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -82.56 -26.94 31.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.479 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 13.4 ttt -83.3 -16.42 46.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.69 0.281 . . . . 10.0 110.814 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.458 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 27.5 tt0 -59.49 -51.93 77.77 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 116.352 -0.385 . . . . 10.0 111.728 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.458 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 51.8 Cg_exo -56.28 -28.3 70.98 Favored 'Trans proline' 0 C--N 1.361 1.214 0 C-N-CA 121.844 1.696 . . . . 10.0 111.949 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -73.1 -42.09 63.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.835 -0.62 . . . . 10.0 109.908 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 25.4 mmt -66.31 -27.83 68.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.435 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 83.7 mt-10 -62.48 -23.48 66.94 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.839 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 mtpt -86.17 -14.32 44.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.069 0.461 . . . . 10.0 110.589 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 7.8 mp -87.48 140.51 29.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.321 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.6 p -76.28 171.67 14.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.649 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.04 -38.24 82.18 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.894 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -70.55 -32.01 69.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.554 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -66.94 -34.74 78.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.276 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.2 mt -62.93 -44.79 95.12 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.896 -0.779 . . . . 10.0 108.896 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -63.4 -28.05 69.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.926 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.65 -34.3 72.65 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 115.421 -0.808 . . . . 10.0 111.449 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -68.89 -39.34 79.82 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.6 m -60.21 -44.24 95.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.103 0.478 . . . . 10.0 109.915 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -38.32 88.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.653 -0.703 . . . . 10.0 110.055 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -60.5 -40.07 90.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.375 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -62.77 -43.42 98.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.321 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -58.48 -46.83 85.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.357 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.563 ' O ' ' HG3' ' A' ' 56' ' ' LYS . . . -68.83 -44.39 73.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.302 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 33.5 mtp180 -58.23 -40.27 81.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.786 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 72.6 mt -62.76 -38.5 90.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 10.0 110.626 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -72.45 -23.93 61.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.301 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.563 ' HG3' ' O ' ' A' ' 52' ' ' ALA . 20.5 mtpp -83.22 -66.96 0.83 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.77 0.319 . . . . 10.0 110.422 179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 178.22 67.07 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 121.071 -0.585 . . . . 10.0 111.918 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -133.39 150.6 51.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.809 0.338 . . . . 10.0 110.203 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.1 t -100.15 133.66 42.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.892 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' ' 118' ' ' LEU . 17.1 tp -60.35 -41.41 93.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.096 0.474 . . . . 10.0 110.608 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.7 mp0 -68.04 -8.99 42.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.255 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -100.15 -15.18 18.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.38 0.61 . . . . 10.0 109.963 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 55.4 mt -89.1 -5.49 57.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.516 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.487 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 66.6 mt -49.54 -51.01 62.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 113.256 0.835 . . . . 10.0 113.256 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.487 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 32.1 Cg_exo -57.3 -48.19 18.83 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.829 1.686 . . . . 10.0 112.957 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -71.01 -43.47 67.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.719 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.88 -51.44 68.19 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.061 0.393 . . . . 10.0 112.061 -178.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -61.92 -34.17 75.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.325 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.44 -45.01 92.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.415 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 85.6 t -60.86 -46.39 96.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.334 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.1 t -60.87 -46.08 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.677 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.405 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 2.7 ttt180 -59.82 -43.02 94.76 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.682 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.3 tp10 -64.49 -47.56 78.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.83 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.41 72.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.572 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.5 m -58.45 -40.94 83.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.301 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -71.14 -21.21 62.22 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -96.21 -44.38 7.3 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.731 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 67.1 t -74.1 -53.13 18.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.647 0.261 . . . . 10.0 111.628 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -98.87 -47.47 5.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.131 0.491 . . . . 10.0 111.213 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 119.54 -34.24 4.33 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.217 -0.753 . . . . 10.0 111.217 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.6 mpt? -77.99 139.62 39.15 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.01 -0.367 . . . . 10.0 110.01 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -91.13 139.04 31.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.583 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.89 114.96 3.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.079 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -61.31 152.48 29.16 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.056 0.455 . . . . 10.0 111.822 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -41.83 94.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.511 -0.768 . . . . 10.0 111.77 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -63.65 -31.61 53.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.116 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.424 HE22 HD22 ' A' ' 110' ' ' LEU . 97.9 mt-30 -70.19 -31.34 68.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.253 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.22 -31.75 73.07 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.1 mt -73.77 -48.82 28.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.806 -0.634 . . . . 10.0 109.438 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.88 -40.84 99.38 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.779 -0.646 . . . . 10.0 112.508 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.32 -28.66 73.34 Favored Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 112.026 -0.43 . . . . 10.0 112.026 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 16.4 ttm -74.34 -37.6 63.5 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.8 t -66.82 -33.78 65.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.03 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.1 mt -74.29 -2.69 26.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.562 -0.745 . . . . 10.0 112.141 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -83.13 -35.05 25.9 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 178.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -96.35 178.02 5.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.194 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -79.07 71.33 5.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.066 0.46 . . . . 10.0 110.443 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 56.2 m -143.74 154.35 43.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.445 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 41.1 mm -103.29 136.48 35.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -116.18 126.99 54.42 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 111.929 0.344 . . . . 10.0 111.929 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -87.54 121.04 29.46 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.402 ' SD ' ' HG2' ' A' ' 108' ' ' LYS . 45.5 ttm -112.63 158.58 19.82 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.974 0.416 . . . . 10.0 111.271 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 103' ' ' ARG . 9.9 mmm180 -95.02 157.38 15.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.25 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.43 108.04 7.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.39 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 132.31 -28.36 3.47 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.485 -0.864 . . . . 10.0 112.926 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.595 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 4.4 mm-40 -60.47 -51.02 71.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.018 0.437 . . . . 10.0 110.542 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 114.71 99.52 2.28 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.806 -0.711 . . . . 10.0 112.469 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.402 ' HG2' ' SD ' ' A' ' 102' ' ' MET . 40.2 mtmt -69.8 -45.5 67.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.657 0.265 . . . . 10.0 111.054 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 73.4 m -62.07 -34.16 75.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.269 0.556 . . . . 10.0 110.68 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.424 HD22 HE22 ' A' ' 87' ' ' GLN . 13.3 tp -81.14 -1.99 46.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.998 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 42.2 m -110.81 -42.71 3.95 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.895 0.378 . . . . 10.0 110.464 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.52 -13.56 59.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.975 -0.557 . . . . 10.0 112.155 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -24.98 63.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.462 -0.335 . . . . 10.0 111.799 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.406 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 55.5 mt -73.63 -57.16 2.68 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 31.6 Cg_endo -62.11 -32.34 83.31 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.108 1.872 . . . . 10.0 112.118 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.29 77.16 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.385 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.407 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 57.1 t80 -63.47 -46.97 83.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.488 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.554 ' O ' HD12 ' A' ' 60' ' ' LEU . 52.1 tp -58.85 -51.1 71.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.706 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -72.26 -21.78 61.32 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.693 0.257 . . . . 10.0 111.693 -178.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.22 -26.64 63.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.877 0.37 . . . . 10.0 110.861 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 58.8 mt -58.72 -32.32 69.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.218 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 69.0 p -64.23 -35.56 81.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.244 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.06 19.26 59.51 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.914 -0.66 . . . . 10.0 112.303 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 64.1 mmtt -87.36 -26.77 23.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.938 0.399 . . . . 10.0 110.881 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 109.1 105.77 2.99 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.771 -0.728 . . . . 10.0 112.922 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 78.4 t -79.35 115.66 22.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -93.56 99.05 11.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.741 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 40.5 t -92.21 118.9 38.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.957 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 52.4 t -104.8 119.71 54.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.854 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.11 155.7 19.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.275 -0.42 . . . . 10.0 110.764 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 5.1 m -64.71 -36.94 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.899 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -139.0 162.66 34.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.766 0.317 . . . . 10.0 110.631 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.88 -24.12 63.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.406 -178.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -62.68 -55.24 28.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.82 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 83.2 mt -68.71 -33.08 73.34 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.595 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.75 -50.8 69.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.976 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -72.55 -35.63 68.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.725 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -58.92 -57.33 13.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.724 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.76 -32.63 74.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.001 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.7 -49.15 77.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.997 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -78.53 -28.26 46.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.472 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -71.38 -43.0 67.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.015 0.436 . . . . 10.0 111.08 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -88.77 -1.66 58.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.119 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.485 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 60.6 ttm-85 -64.87 -50.16 64.68 Favored Pre-proline 0 CA--C 1.535 0.404 0 N-CA-C 112.484 0.55 . . . . 10.0 112.484 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' PRO . . . . . 0.485 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 32.4 Cg_exo -60.69 -14.39 31.28 Favored 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 122.102 1.868 . . . . 10.0 112.62 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 14.3 tp -89.07 -56.49 3.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.405 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -65.87 -46.74 77.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 10.0 112.186 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -64.95 -25.57 67.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.781 0.324 . . . . 10.0 111.591 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -77.45 -22.93 50.68 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.071 0.462 . . . . 10.0 110.306 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 81.8 mt -93.17 -6.73 47.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.659 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 103.74 8.16 40.45 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.515 -0.85 . . . . 10.0 113.585 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 91.8 mt -96.91 138.7 34.06 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.1 0.45 . . . . 10.0 110.592 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.35 130.65 34.44 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.279 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.45 123.03 66.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.941 0.4 . . . . 10.0 110.689 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -120.57 150.46 17.37 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.993 -0.622 . . . . 10.0 112.278 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 4.3 tp -123.81 133.2 69.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -118.98 116.48 26.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.407 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.502 ' O ' ' HB2' ' A' ' 161' ' ' MET . 94.7 mt -109.06 146.07 33.08 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.482 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' PRO . . . . . 0.559 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 15.2 Cg_endo -58.46 115.08 2.28 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 122.655 2.236 . . . . 10.0 112.22 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.85 5.24 56.6 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.785 -0.722 . . . . 10.0 112.746 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' MET . . . . . 0.502 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.3 OUTLIER -65.87 151.96 94.15 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.555 0.177 . . . . 10.0 110.809 179.496 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -61.33 147.0 96.69 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.496 2.131 . . . . 10.0 111.866 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . 0.459 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.82 -49.71 87.79 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 112.384 0.513 . . . . 10.0 112.384 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.459 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 52.2 Cg_exo -56.59 -44.87 41.45 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 121.819 1.68 . . . . 10.0 112.205 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.69 98.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.67 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.418 ' HZ1' ' CG ' ' A' ' 185' ' ' ASP . 48.1 mttm -62.25 -44.47 96.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.456 179.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' ARG . . . . . 0.432 ' CG ' ' HA ' ' A' ' 199' ' ' VAL . 74.9 mtt180 -59.68 -40.52 88.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.005 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.99 -35.07 74.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.882 0.373 . . . . 10.0 110.437 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -68.62 -39.11 80.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.746 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -80.94 -12.84 59.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.59 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -85.66 -9.6 56.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.32 0.581 . . . . 10.0 109.463 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -80.13 165.03 22.87 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.285 -0.87 . . . . 10.0 109.895 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -70.54 -37.05 74.0 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.805 0.336 . . . . 10.0 110.76 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.3 mp -126.52 122.59 61.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.061 179.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 5.8 m -115.7 121.01 41.24 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.886 0.374 . . . . 10.0 111.18 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -99.74 141.67 32.23 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -177.83 172.62 45.26 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.34 -0.933 . . . . 10.0 112.895 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.87 153.45 21.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.805 0.336 . . . . 10.0 111.15 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -63.31 -35.92 81.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.899 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -59.49 -52.19 66.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.169 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . 0.559 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.8 tp10 -69.79 -37.53 76.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.102 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -56.8 -36.04 69.43 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.974 0.416 . . . . 10.0 110.834 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -77.88 -40.03 22.66 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.804 -0.713 . . . . 10.0 111.694 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -64.3 -40.03 95.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.581 0.229 . . . . 10.0 110.58 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . 0.418 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 20.4 m-20 -60.43 -41.43 93.99 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.104 0.478 . . . . 10.0 109.973 179.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -62.25 -39.54 93.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.518 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 87.1 mt -67.4 -44.02 79.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.989 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 64.1 mtm-85 -65.48 -43.56 89.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.953 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' ASP . . . . . 0.403 ' OD1' ' HA ' ' A' ' 198' ' ' ARG . 16.3 m-20 -62.93 -32.91 74.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.79 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -85.27 -0.61 55.24 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.484 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 24.8 ttp -121.58 10.6 10.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.819 0.343 . . . . 10.0 110.848 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -69.74 172.18 7.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.07 -0.513 . . . . 10.0 111.111 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -107.09 -30.02 9.04 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.167 0.508 . . . . 10.0 110.394 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' SER . . . . . 0.411 ' O ' ' HB2' ' A' ' 197' ' ' GLU . 0.1 OUTLIER -115.42 140.07 25.4 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.734 -0.667 . . . . 10.0 109.577 179.136 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.15 -28.61 87.33 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.696 2.264 . . . . 10.0 113.031 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.02 0.63 52.87 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 121.151 -0.219 . . . . 10.0 111.417 -179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 194' ' ' SER . 32.9 mt-10 -80.06 -11.32 59.78 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 121.234 -0.186 . . . . 10.0 110.71 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' ARG . . . . . 0.403 ' HA ' ' OD1' ' A' ' 189' ' ' ASP . 66.2 mtt180 -58.17 142.42 47.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.622 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 199' ' ' VAL . . . . . 0.432 ' HA ' ' CG ' ' A' ' 167' ' ' ARG . 28.9 m -94.77 -26.7 4.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.482 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -107.63 159.73 16.23 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.889 0.376 . . . . 10.0 110.705 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 55.3 mtm180 -82.4 -66.18 0.92 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.75 172.82 7.61 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.497 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . 0.43 HD21 ' CZ ' ' A' ' 384' ' ' TYR . 19.5 mt -102.68 124.97 49.21 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -140.59 -56.5 0.52 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.916 0.388 . . . . 10.0 110.325 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -127.12 136.37 52.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.64 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.534 ' HB3' ' CD1' ' A' ' 384' ' ' TYR . . . -132.05 127.29 35.84 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.084 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 47.5 tp -125.65 109.89 13.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.702 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.16 132.26 46.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.214 0.53 . . . . 10.0 111.109 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -49.54 77.38 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.237 -0.892 . . . . 10.0 112.243 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.52 103.97 6.44 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.927 0.394 . . . . 10.0 110.362 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . 0.441 ' CG2' ' HB ' ' A' ' 391' ' ' THR . 30.9 m -74.05 -18.35 17.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.754 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . 0.423 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.3 m-20 -46.11 -74.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.561 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 66.0 m -86.84 -19.86 28.34 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.78 0.659 . . . . 10.0 112.78 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 50.3 mt -77.7 -38.98 26.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.316 0.488 . . . . 10.0 112.316 -178.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 18.4 mt -98.44 -42.35 7.37 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 216' ' ' ILE . . . . . 0.423 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 49.5 mm -81.83 -59.04 3.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 112.575 0.583 . . . . 10.0 112.575 -178.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.6 -34.36 76.85 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.05 0.759 . . . . 10.0 113.05 -177.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 218' ' ' GLU . . . . . 0.428 ' O ' ' HB2' ' A' ' 377' ' ' PHE . 7.5 mm-40 -97.69 15.8 22.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.66 0.267 . . . . 10.0 111.718 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.14 -49.54 77.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.936 0.398 . . . . 10.0 111.84 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 220' ' ' ARG . . . . . 0.556 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -97.59 32.8 2.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.1 0.476 . . . . 10.0 111.511 -178.436 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 10.0 m -105.25 106.69 56.79 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -91.52 125.65 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.918 2.412 . . . . 10.0 113.318 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 223' ' ' LEU . . . . . 0.526 ' O ' ' HA ' ' A' ' 374' ' ' SER . 88.0 mt -79.8 110.43 15.15 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 178.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 55.7 mt -108.48 130.64 60.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.035 0.445 . . . . 10.0 111.715 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 9.4 mt -101.19 144.88 12.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 1.5 m -81.24 119.97 24.3 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.903 0.382 . . . . 10.0 111.581 -179.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -108.23 -157.0 19.08 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 121.249 -0.5 . . . . 10.0 112.665 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -87.99 -32.07 0.18 Allowed 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 123.125 2.55 . . . . 10.0 114.216 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . 65.58 -159.46 0.27 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.046 0.539 . . . . 10.0 111.487 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -68.75 102.04 1.45 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.222 0.534 . . . . 10.0 110.987 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.11 -47.05 10.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.61 -0.723 . . . . 10.0 111.256 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.67 87.3 2.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.357 -178.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 69.8 m -78.16 40.43 0.34 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.297 0.57 . . . . 10.0 111.489 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -65.82 -25.78 67.37 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.806 -0.634 . . . . 10.0 111.262 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 12.7 ttm -70.32 -31.79 69.25 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.815 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . 0.431 ' CE2' ' HB3' ' A' ' 355' ' ' GLN . 0.3 OUTLIER -63.31 -48.58 77.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.383 -179.232 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.44 -7.7 27.44 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.019 0.377 . . . . 10.0 112.019 -179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -98.9 -40.29 8.16 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.487 -0.324 . . . . 10.0 110.77 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 11.4 p -82.79 -33.73 10.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-O 120.986 0.422 . . . . 10.0 111.462 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 240' ' ' ASN . . . . . 0.403 ' HB2' ' O ' ' A' ' 236' ' ' TYR . 2.5 m120 -73.38 -6.64 47.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.936 0.347 . . . . 10.0 111.936 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.9 -11.3 19.89 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.986 0.365 . . . . 10.0 111.986 -179.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 12.7 tt -90.62 -22.05 6.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.092 0.472 . . . . 10.0 110.954 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 243' ' ' ILE . . . . . 0.533 ' C ' ' H ' ' A' ' 245' ' ' HIS . 37.4 mt -68.24 -44.78 38.11 Favored Pre-proline 0 CA--C 1.54 0.569 0 N-CA-C 112.776 0.658 . . . . 10.0 112.776 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 244' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -67.89 22.65 0.12 Allowed 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 122.289 1.993 . . . . 10.0 112.775 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 245' ' ' HIS . . . . . 0.533 ' H ' ' C ' ' A' ' 243' ' ' ILE . 18.2 t-80 -122.5 9.34 9.64 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 41.1 mt -100.59 -178.35 3.76 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.035 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 53.4 mt -117.02 128.75 74.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.046 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -67.56 75.88 0.18 Allowed 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.617 0.573 . . . . 10.0 111.335 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -173.3 -34.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.103 -0.498 . . . . 10.0 111.028 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -157.59 -179.81 8.52 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.261 -0.274 . . . . 10.0 110.261 -179.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . 0.4 ' HD3' ' HA ' ' A' ' 281' ' ' LEU . 14.2 mmtt 59.52 65.69 1.12 Allowed 'General case' 0 C--O 1.233 0.219 0 O-C-N 123.742 0.651 . . . . 10.0 111.576 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 252' ' ' GLU . . . . . 0.443 ' OE2' HD11 ' A' ' 281' ' ' LEU . 8.3 mm-40 71.12 -37.28 0.39 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.982 0.913 . . . . 10.0 112.653 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -74.49 5.18 4.96 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.223 0.535 . . . . 10.0 110.724 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.36 -4.12 59.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.092 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 55.79 -142.35 0.79 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.387 -0.824 . . . . 10.0 111.032 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.9 7.54 44.6 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.763 0.316 . . . . 10.0 111.184 -179.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -67.86 -40.31 83.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.116 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 53.39 -103.61 0.17 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.474 -0.784 . . . . 10.0 111.693 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -129.52 29.01 3.9 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.708 -0.758 . . . . 10.0 111.868 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -143.45 -64.04 0.39 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.026 0.441 . . . . 10.0 110.458 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 78.33 -117.25 4.6 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.832 -0.699 . . . . 10.0 111.865 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -169.05 -80.52 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -163.68 160.84 23.2 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 4.5 m -69.19 116.25 9.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.925 0.393 . . . . 10.0 110.994 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 14.5 p -160.58 -33.45 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.25 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -155.06 -169.2 3.11 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -120.59 -1.88 10.02 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.337 0.589 . . . . 10.0 109.809 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 268' ' ' LYS . . . . . 0.558 ' HE3' ' OG1' ' A' ' 321' ' ' THR . 0.1 OUTLIER -141.95 145.57 34.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.372 -179.37 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 7.5 m -87.82 144.89 26.36 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.947 0.403 . . . . 10.0 110.413 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -88.84 5.67 42.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.178 0.513 . . . . 10.0 110.399 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -118.05 -65.3 1.19 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.681 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 58.4 t 70.89 -60.52 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.962 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 50.2 20.56 0.65 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.238 1.015 . . . . 10.0 112.982 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 83.4 mt 69.18 166.53 0.27 Allowed 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.598 0.759 . . . . 10.0 112.251 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 275' ' ' THR . . . . . 0.456 HG21 ' H ' ' A' ' 276' ' ' GLU . 0.0 OUTLIER -121.88 -72.26 0.69 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.148 -0.478 . . . . 10.0 112.046 -179.068 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 276' ' ' GLU . . . . . 0.456 ' H ' HG21 ' A' ' 275' ' ' THR . 0.7 OUTLIER 62.42 22.94 13.58 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.042 0.449 . . . . 10.0 111.499 -179.566 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -145.56 158.27 43.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.802 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 134.53 -52.05 0.82 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.199 -0.524 . . . . 10.0 111.887 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 70.55 -58.58 0.55 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.691 0.796 . . . . 10.0 112.675 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 11.0 p -58.02 -24.11 22.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 N-CA-C 112.445 0.535 . . . . 10.0 112.445 -178.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 281' ' ' LEU . . . . . 0.443 HD11 ' OE2' ' A' ' 252' ' ' GLU . 0.1 OUTLIER -80.31 -44.27 19.83 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.079 0.4 . . . . 10.0 112.079 -179.028 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 34.9 pt -80.05 -4.38 7.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 112.398 0.518 . . . . 10.0 112.398 -178.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.98 -60.06 3.08 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.483 0.549 . . . . 10.0 112.483 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -100.49 5.44 44.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.017 0.437 . . . . 10.0 111.332 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.56 -39.87 44.35 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.866 -0.79 . . . . 10.0 108.866 178.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 16.5 mt -73.07 160.28 32.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.35 -0.841 . . . . 10.0 110.87 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 287' ' ' VAL . . . . . . . . . . . . . 17.0 t 66.03 160.99 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.491 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.98 138.56 0.07 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.846 0.858 . . . . 10.0 112.72 178.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 68.86 -58.55 0.49 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.713 -1.131 . . . . 10.0 112.842 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -81.38 -148.25 6.15 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.794 -0.717 . . . . 10.0 112.663 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 291' ' ' ILE . . . . . 0.516 ' O ' ' HB3' ' A' ' 292' ' ' MET . 18.3 tt -88.03 161.31 2.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 292' ' ' MET . . . . . 0.587 ' SD ' ' HB2' ' A' ' 296' ' ' GLU . 20.7 ttp 76.04 95.82 0.07 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.578 0.704 . . . . 10.0 110.981 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 11.2 p30 -109.88 3.23 20.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.439 -0.8 . . . . 10.0 109.468 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -85.11 -68.76 0.7 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.959 -1.018 . . . . 10.0 109.901 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 146.48 114.01 0.82 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.91 -0.662 . . . . 10.0 112.248 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . 0.587 ' HB2' ' SD ' ' A' ' 292' ' ' MET . 1.3 mm-40 -148.19 176.8 9.93 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 110.098 -0.334 . . . . 10.0 110.098 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.97 153.99 20.7 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.052 0.454 . . . . 10.0 111.453 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.3 tp -70.35 -29.36 66.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.238 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -89.75 19.77 4.51 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.278 0.473 . . . . 10.0 112.278 -178.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 62.7 m -80.63 137.79 51.11 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.6 -26.73 66.2 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.997 2.465 . . . . 10.0 113.104 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -71.63 -12.29 61.27 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.138 0.494 . . . . 10.0 110.961 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -106.65 94.08 4.93 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.57 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 6.7 tp -127.47 -52.35 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.973 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -50.0 69.49 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 178.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.4 -42.12 99.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.8 178.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 15.5 tpt -59.05 -50.53 73.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.498 -0.774 . . . . 10.0 111.096 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -62.05 -21.15 64.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.482 -0.327 . . . . 10.0 111.176 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.67 -40.99 32.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.5 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 7.1 m -72.01 -34.21 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 C-N-CA 121.074 -0.25 . . . . 10.0 110.737 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 2.2 m -64.17 -34.98 79.32 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.384 0.611 . . . . 10.0 109.961 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 312' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 315' ' ' ARG . . . -68.77 -42.93 76.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.347 -0.842 . . . . 10.0 110.854 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 313' ' ' ALA . . . . . 0.417 ' HA ' ' HB2' ' A' ' 356' ' ' ALA . . . -65.67 -25.39 67.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.5 -179.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 34.7 tp -81.47 -44.22 17.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.074 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 315' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 312' ' ' ALA . 33.8 ptt180 -64.77 -24.45 67.56 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.793 0.33 . . . . 10.0 110.76 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -90.11 13.84 13.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.948 0.404 . . . . 10.0 110.676 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -123.67 -0.85 8.54 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.055 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -142.79 -62.9 0.42 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.679 0.276 . . . . 10.0 111.268 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.41 -57.94 9.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.745 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -85.27 112.81 21.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.943 0.402 . . . . 10.0 110.417 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 321' ' ' THR . . . . . 0.564 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 1.0 OUTLIER -104.17 138.78 40.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.277 -179.409 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 322' ' ' ARG . . . . . 0.555 ' HD3' ' OE1' ' A' ' 361' ' ' GLU . 7.0 tpt180 -62.0 141.29 58.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.846 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 323' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 0.7 OUTLIER 78.69 -45.35 0.39 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.991 0.916 . . . . 10.0 113.165 177.541 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 324' ' ' VAL . . . . . 0.564 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 7.1 p -83.99 -37.46 13.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.73 -0.388 . . . . 10.0 111.852 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 321' ' ' THR . 9.8 m-20 -95.53 -31.43 13.33 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 120.983 0.42 . . . . 10.0 110.869 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 53.8 p90 -151.83 142.09 22.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.706 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 6.6 tp -115.8 124.18 71.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.057 -0.719 . . . . 10.0 109.057 178.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 49.8 t -102.26 119.6 50.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.19 -179.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 5.9 ptmm? -126.06 119.79 28.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.684 -0.689 . . . . 10.0 109.669 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 1.9 p30 48.93 29.14 2.22 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.145 0.978 . . . . 10.0 113.087 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 102.8 -23.04 35.08 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.743 -0.742 . . . . 10.0 112.857 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -77.81 114.31 16.55 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.953 0.406 . . . . 10.0 110.315 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 31.3 t -88.65 107.32 17.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.386 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 68.3 mt -99.96 127.84 52.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.103 -0.499 . . . . 10.0 109.904 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 77.1 mt -78.51 132.86 31.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.699 0.285 . . . . 10.0 110.534 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 44.9 t -102.14 115.65 44.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.512 -0.551 . . . . 10.0 109.512 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -66.2 127.01 30.52 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.271 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 338' ' ' GLU . . . . . 0.403 ' O ' ' HG2' ' A' ' 338' ' ' GLU . 17.4 tt0 -80.82 -7.65 59.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.71 -178.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 70.6 m80 -84.64 -60.8 1.95 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.27 -0.269 . . . . 10.0 111.717 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 30.1 p -111.89 3.72 17.77 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 65.93 41.35 95.43 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.602 -0.809 . . . . 10.0 112.079 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -101.53 138.44 38.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.899 0.38 . . . . 10.0 110.672 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -86.86 117.68 25.76 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.976 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 66.4 mtt -106.05 97.97 7.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.993 0.425 . . . . 10.0 110.223 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -89.54 -20.38 23.87 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.525 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -101.31 32.41 7.52 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.384 -0.687 . . . . 10.0 111.384 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -145.07 135.97 24.68 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.0 129.43 14.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.73 -0.214 . . . . 10.0 110.594 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 36.0 m95 -74.73 149.77 39.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.661 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.62 -161.26 0.82 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.579 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 28.6 t70 64.4 10.11 5.46 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.364 0.602 . . . . 10.0 111.052 179.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 71.43 27.61 71.11 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.734 -0.746 . . . . 10.0 111.552 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.503 HD13 ' CZ ' ' A' ' 315' ' ' ARG . 4.2 tp -57.16 -41.98 80.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.817 0.341 . . . . 10.0 110.966 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 354' ' ' HIS . . . . . 0.451 ' CE1' HE22 ' A' ' 355' ' ' GLN . 13.6 p80 -98.58 -5.64 31.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 355' ' ' GLN . . . . . 0.451 HE22 ' CE1' ' A' ' 354' ' ' HIS . 1.4 mp0 -65.77 -38.91 90.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.441 0.638 . . . . 10.0 109.981 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 356' ' ' ALA . . . . . 0.417 ' HB2' ' HA ' ' A' ' 313' ' ' ALA . . . -70.33 -21.66 62.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.237 179.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 357' ' ' VAL . . . . . 0.422 ' HB ' ' O ' ' A' ' 354' ' ' HIS . 33.7 t -73.23 -49.85 35.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.34 178.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -65.55 -26.15 67.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.432 -0.804 . . . . 10.0 110.671 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -80.35 -30.37 37.98 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.852 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -74.88 -47.7 28.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.602 -0.726 . . . . 10.0 111.074 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 361' ' ' GLU . . . . . 0.555 ' OE1' ' HD3' ' A' ' 322' ' ' ARG . 14.4 mt-10 -94.1 176.98 6.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.888 -179.34 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -84.01 75.2 2.4 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.084 -0.579 . . . . 10.0 112.861 -178.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.06 167.27 5.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 110.317 -0.253 . . . . 10.0 110.317 179.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.37 122.73 29.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.277 -0.42 . . . . 10.0 110.376 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 365' ' ' ILE . . . . . . . . . . . . . 53.4 mt -64.46 126.49 23.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.37 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -71.01 124.01 23.4 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.162 -0.472 . . . . 10.0 109.922 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -68.71 124.24 23.09 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.218 -179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -79.66 154.86 28.35 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.486 ' O ' ' HB2' ' A' ' 370' ' ' GLN . 2.3 t-20 -127.69 -175.05 3.35 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 121.073 -0.251 . . . . 10.0 110.604 -179.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 370' ' ' GLN . . . . . 0.486 ' HB2' ' O ' ' A' ' 369' ' ' ASN . 5.1 mt-30 77.33 -175.1 0.1 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.396 0.678 . . . . 10.0 110.651 -179.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 3.0 m 73.64 93.86 0.08 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.006 -0.543 . . . . 10.0 112.21 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 372' ' ' LEU . . . . . 0.69 ' O ' ' HD2' ' A' ' 776' ' ' LYS . 0.4 OUTLIER -134.48 -69.24 0.53 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.838 178.751 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -138.37 150.83 46.94 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.858 -0.423 . . . . 10.0 109.858 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 374' ' ' SER . . . . . 0.526 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 16.4 m -152.04 136.53 16.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.655 0.264 . . . . 10.0 111.161 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 17.2 tt -155.83 137.17 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.337 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.38 145.64 27.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.398 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 377' ' ' PHE . . . . . 0.428 ' HB2' ' O ' ' A' ' 218' ' ' GLU . 36.2 m-85 -57.53 -37.65 73.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.654 0.264 . . . . 10.0 110.657 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -57.32 -39.94 76.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.404 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -74.38 -39.16 62.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.024 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -63.68 -46.43 85.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.378 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -74.65 -16.78 60.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.831 0.308 . . . . 10.0 111.831 -179.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -80.7 -3.29 50.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.856 0.36 . . . . 10.0 110.539 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 60.7 mt -99.37 4.76 46.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.385 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.534 ' CD1' ' HB3' ' A' ' 206' ' ' ALA . 21.1 m-85 -99.79 143.68 29.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.147 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -79.27 -70.8 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.928 0.394 . . . . 10.0 110.526 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -89.13 91.92 8.99 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.627 -0.508 . . . . 10.0 109.627 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 54.5 tp -103.27 110.03 21.86 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.012 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -128.96 161.68 29.33 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.18 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.83 165.26 37.01 Favored Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.255 -0.974 . . . . 10.0 112.158 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 46.0 mtm -107.65 143.32 36.28 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.119 -0.326 . . . . 10.0 110.119 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 391' ' ' THR . . . . . 0.441 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 7.1 t -129.51 155.57 45.54 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -80.66 163.57 46.23 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.501 -0.856 . . . . 10.0 112.044 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.63 91.58 0.43 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.166 -0.309 . . . . 10.0 110.166 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . 0.531 ' HA ' HD21 ' A' ' 569' ' ' ASN . . . -151.58 -28.72 0.18 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.229 0.455 . . . . 10.0 112.229 -178.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 31.9 t70 58.83 -108.94 0.43 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 109.205 -0.665 . . . . 10.0 109.205 -178.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 6.7 m 58.81 -89.8 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.239 0.829 . . . . 10.0 113.239 177.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -88.76 22.75 2.53 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.003 0.371 . . . . 10.0 112.003 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -60.84 -35.19 75.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.044 0.449 . . . . 10.0 110.946 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -66.51 -20.05 65.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.487 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.64 -22.36 46.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.712 -0.222 . . . . 10.0 110.847 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -63.64 -46.69 84.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 10.0 110.556 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.36 -20.74 58.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.599 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 41.7 m -87.6 -42.5 12.66 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.328 0.492 . . . . 10.0 112.328 -178.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 56.4 mt -91.44 -61.56 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 N-CA-C 112.763 0.653 . . . . 10.0 112.763 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -88.11 -4.76 58.72 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt 60.48 44.42 11.95 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.788 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 20.7 mt -109.8 141.4 42.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.828 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . 0.499 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 47.7 t0 -76.87 166.87 22.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 6.9 m -134.35 101.49 5.01 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.057 0.456 . . . . 10.0 111.149 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 62.0 t -106.84 133.53 51.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.068 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 23.6 t -87.15 126.08 40.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.509 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 54.2 t -86.69 128.46 56.43 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.385 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.96 146.35 82.38 Favored 'Trans proline' 0 N--CA 1.463 -0.292 0 C-N-CA 122.436 2.091 . . . . 10.0 112.095 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.75 145.4 45.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.873 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -56.89 -38.03 72.21 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.268 0.556 . . . . 10.0 110.514 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 416' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 578' ' ' GLN . 71.1 mtm180 -129.66 151.32 77.86 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.451 179.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -61.77 116.26 3.33 Favored 'Trans proline' 0 N--CA 1.465 -0.167 0 C-N-CA 122.6 2.2 . . . . 10.0 111.84 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 48.8 mtm -64.32 118.53 8.81 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.969 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 6.4 pt -108.29 30.9 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.359 0.6 . . . . 10.0 110.348 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -77.2 122.66 25.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.279 -0.873 . . . . 10.0 109.45 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 27.0 mmtp -88.76 101.47 14.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.996 0.427 . . . . 10.0 111.104 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -88.4 114.99 25.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.01 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 74.5 mt -94.32 156.09 39.14 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.493 -0.322 . . . . 10.0 110.542 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -65.94 170.28 11.88 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.694 2.263 . . . . 10.0 113.006 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -85.67 129.15 34.9 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.461 -0.791 . . . . 10.0 110.596 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.28 92.08 4.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.353 0.596 . . . . 10.0 110.189 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 25.6 t -87.75 122.04 38.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.545 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 428' ' ' TYR . . . . . 0.41 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 2.5 m-85 -105.36 -176.71 3.16 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 429' ' ' MET . . . . . 0.533 ' HE2' ' O ' ' A' ' 608' ' ' ARG . 12.8 mmt -78.09 -74.16 0.28 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.94 0.4 . . . . 10.0 111.342 -178.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 73.2 p -89.53 174.01 8.01 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.869 -178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -71.91 -36.04 69.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.39 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.63 -41.12 85.23 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.571 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 433' ' ' GLU . . . . . 0.414 ' OE2' ' HB2' ' A' ' 429' ' ' MET . 33.1 mt-10 -62.51 -45.38 93.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.143 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 434' ' ' LYS . . . . . 0.489 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 38.7 ttpt -58.67 -50.46 73.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.706 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 49.7 mm -62.33 -43.48 98.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.905 -179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -59.6 -39.92 85.78 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.615 0.245 . . . . 10.0 110.886 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.35 87.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.338 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 70.1 mt -65.53 -45.88 91.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.952 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 50.2 mm -58.31 -40.48 78.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.893 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -63.96 -50.42 68.66 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.389 -0.368 . . . . 10.0 110.707 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . 0.405 ' HB2' ' HH ' ' A' ' 587' ' ' TYR . 20.2 t70 -58.36 -42.06 86.1 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.127 0.489 . . . . 10.0 110.557 179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 79.2 mt -67.26 -50.7 60.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.637 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -50.01 -49.31 51.21 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.372 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.413 ' O ' ' HD3' ' A' ' 448' ' ' LYS . 0.0 OUTLIER -56.74 -47.22 80.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.528 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 47.8 mtt-85 -74.34 -22.24 59.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.016 -0.538 . . . . 10.0 112.19 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 27.4 m -69.4 -39.46 77.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.175 0.512 . . . . 10.0 109.917 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -74.06 -34.17 63.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.943 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' LYS . . . . . 0.413 ' HD3' ' O ' ' A' ' 444' ' ' GLU . 14.0 mptt -70.13 -58.57 3.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.143 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 127.88 35.9 0.5 Allowed Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.667 -0.778 . . . . 10.0 112.267 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -113.43 126.53 28.02 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 110.158 -0.312 . . . . 10.0 110.158 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.44 140.6 58.31 Favored 'Trans proline' 0 C--O 1.237 0.455 0 C-N-CA 122.524 2.149 . . . . 10.0 111.503 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 85.4 t -125.28 126.62 71.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.246 -178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 37.6 tp -112.99 107.75 16.41 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.781 -0.645 . . . . 10.0 109.352 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 20.8 t -93.72 126.0 46.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.266 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -106.56 109.48 3.11 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.7 -0.762 . . . . 10.0 111.996 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 2.7 p -97.66 142.15 29.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.733 0.302 . . . . 10.0 110.72 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 30.3 pt -84.39 -20.76 8.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.789 0.328 . . . . 10.0 111.229 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' SER . . . . . 0.477 ' HB3' ' OE2' ' A' ' 460' ' ' GLU . 57.7 m -134.38 145.43 48.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.962 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 16.8 mt -62.93 -33.86 62.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.249 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.477 ' OE2' ' HB3' ' A' ' 458' ' ' SER . 2.7 mp0 -59.03 -35.73 73.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.343 -0.844 . . . . 10.0 111.143 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.61 -29.11 51.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.751 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 9.8 m -63.45 -41.21 98.63 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.342 0.591 . . . . 10.0 110.067 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -68.46 -30.58 69.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.488 -0.778 . . . . 10.0 110.656 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 57.0 tp -70.64 -53.81 14.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.828 -0.624 . . . . 10.0 111.144 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 14.6 p -63.51 -31.4 52.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 120.884 0.374 . . . . 10.0 110.836 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.9 t -66.3 -38.35 87.53 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.881 0.372 . . . . 10.0 110.021 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -61.67 -49.19 77.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.764 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -65.12 -40.49 94.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.329 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 27.0 mt -61.69 -34.94 76.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.939 0.399 . . . . 10.0 110.329 179.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 23.4 m -72.26 -33.55 67.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.162 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -67.39 -37.37 83.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.455 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -77.62 -23.73 49.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.141 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 87.41 33.78 11.26 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.948 -0.644 . . . . 10.0 111.844 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 78.3 mt -100.68 131.19 48.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.669 0.271 . . . . 10.0 110.828 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -63.05 124.64 21.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.116 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 50.2 p-80 -154.85 159.42 40.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.802 0.334 . . . . 10.0 111.216 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -141.37 132.77 26.73 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.166 178.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 40.0 t -97.81 123.69 50.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.751 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 55.5 mt -81.36 146.48 30.31 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.419 -0.585 . . . . 10.0 109.419 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -157.78 135.78 10.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.124 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -60.04 -25.87 65.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.352 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -62.32 -33.44 74.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.231 0.539 . . . . 10.0 110.305 179.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -116.64 35.27 4.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.629 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -58.0 -24.86 59.94 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.289 -178.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -62.92 -42.97 99.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.928 0.395 . . . . 10.0 110.84 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -86.03 -28.24 24.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.956 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -55.42 -40.32 71.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.22 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -57.92 -29.11 64.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.942 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -84.03 -36.54 23.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.128 0.49 . . . . 10.0 110.418 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 53.9 mt -69.17 -45.93 78.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.095 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 71.9 t -61.09 -34.21 59.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.085 0.469 . . . . 10.0 110.946 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -65.91 -24.28 66.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.48 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' GLN . . . . . 0.43 ' NE2' ' H ' ' A' ' 518' ' ' SER . 53.7 mm-40 -115.44 16.84 16.63 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.826 0.346 . . . . 10.0 110.753 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.87 -12.97 61.85 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.402 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -89.19 7.69 81.53 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.781 -0.723 . . . . 10.0 112.211 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -69.84 141.53 89.91 Favored Pre-proline 0 C--N 1.328 -0.364 0 C-N-CA 122.319 0.248 . . . . 10.0 110.515 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -52.54 126.22 20.21 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.718 2.279 . . . . 10.0 113.04 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 67.92 24.92 7.88 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.487 -0.778 . . . . 10.0 112.57 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -94.88 110.28 22.18 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 10.0 110.261 178.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 38.6 t -92.16 109.71 21.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.106 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 1.2 m -116.4 130.16 56.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.799 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 28.9 mt -105.6 115.26 47.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.042 -0.526 . . . . 10.0 109.734 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -103.67 111.3 23.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.907 0.384 . . . . 10.0 111.191 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 13.1 m -82.32 110.94 17.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.411 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 13.3 t30 62.79 91.61 0.07 Allowed 'General case' 0 N--CA 1.465 0.275 0 O-C-N 123.686 0.616 . . . . 10.0 111.0 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 1.3 mmt -75.05 113.8 12.8 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.762 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -64.95 168.71 6.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.98 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -58.98 142.11 46.63 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 121.165 -0.541 . . . . 10.0 113.026 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 69.26 -80.1 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.354 0.662 . . . . 10.0 111.502 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.17 143.42 11.4 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.732 -0.747 . . . . 10.0 112.165 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.81 147.02 35.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.905 0.383 . . . . 10.0 111.349 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -76.23 93.92 3.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.528 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 55.0 mt -69.55 121.85 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.482 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 7.4 t -90.27 133.52 31.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.671 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 61.2 mt -70.45 135.54 48.76 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.412 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 85.85 0.34 87.57 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.085 -0.579 . . . . 10.0 111.773 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 106.6 -170.0 15.83 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 110.784 -0.927 . . . . 10.0 110.784 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' SER . . . . . 0.43 ' H ' ' NE2' ' A' ' 493' ' ' GLN . 2.8 p -128.07 98.99 5.3 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 117.235 0.517 . . . . 10.0 110.918 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 33.2 p-90 -59.55 -28.47 67.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.076 0.465 . . . . 10.0 110.206 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -62.57 -32.26 73.22 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.646 -0.707 . . . . 10.0 110.681 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -85.12 -35.91 21.46 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.225 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -63.6 -45.56 89.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.899 -0.591 . . . . 10.0 111.013 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 33.8 m -70.74 -22.35 23.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.99 0.424 . . . . 10.0 110.806 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -81.13 -23.26 38.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.64 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -73.32 -21.83 60.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.532 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 91.7 mt -79.44 127.02 31.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.176 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -63.55 -33.76 76.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.299 0.571 . . . . 10.0 109.462 179.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -120.46 93.92 48.54 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 115.307 -0.861 . . . . 10.0 109.258 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -80.72 75.09 5.22 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.114 2.542 . . . . 10.0 111.956 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.97 144.6 55.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.598 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.97 -43.49 60.48 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.328 0.492 . . . . 10.0 112.328 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -59.8 -44.4 94.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.989 0.423 . . . . 10.0 110.949 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.08 -40.77 91.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.717 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 91.4 mt -60.92 -43.55 96.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . 0.478 ' CD ' ' HZ3' ' A' ' 538' ' ' LYS . 7.8 tp10 -66.6 -41.86 87.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.319 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -62.04 -47.37 85.02 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.275 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 85.2 mt -66.29 -33.8 65.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.787 0.327 . . . . 10.0 110.544 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . 0.478 ' HZ3' ' CD ' ' A' ' 535' ' ' GLU . 31.4 ttmt -63.66 -49.81 71.73 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -66.37 -36.14 82.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.317 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . 0.588 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 19.7 t70 -62.9 -52.06 64.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.718 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 47.8 t90 -61.87 -37.96 86.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.866 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -50.98 -49.86 59.36 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.297 -0.41 . . . . 10.0 111.107 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 47.4 t -64.58 -45.1 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.994 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 544' ' ' ARG . . . . . 0.588 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 5.8 mtm180 -64.23 -35.79 81.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.936 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -68.94 -48.4 63.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.741 -0.663 . . . . 10.0 111.178 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -69.11 -26.01 64.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.626 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -65.46 -36.79 84.94 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.266 0.555 . . . . 10.0 109.576 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.2 -32.75 55.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.709 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 85.4 mt -61.84 -47.19 86.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.904 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -76.49 -18.9 58.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.737 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -75.4 -33.68 61.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.641 179.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 134.55 10.36 1.65 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.444 -0.884 . . . . 10.0 113.21 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 73.07 -168.28 53.74 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.859 -0.686 . . . . 10.0 112.672 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 40.9 tp -72.78 117.11 14.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.958 0.408 . . . . 10.0 110.078 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -92.7 113.79 26.16 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.011 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 10.9 mm -94.87 137.63 22.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.31 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 557' ' ' ILE . . . . . 0.489 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 23.7 mt -127.74 128.87 69.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.64 0.257 . . . . 10.0 110.343 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -106.8 120.25 6.18 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 111.404 -0.678 . . . . 10.0 111.404 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 17.3 p -74.71 -37.38 62.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.126 0.489 . . . . 10.0 110.907 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -138.61 140.76 39.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.081 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 23.4 mmt180 -82.81 141.39 32.34 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.74 151.15 23.64 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.9 -0.32 . . . . 10.0 110.377 -179.461 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -41.99 68.21 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 179.461 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 36.3 t -81.18 115.65 20.7 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.398 -0.819 . . . . 10.0 109.064 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -66.33 -27.87 68.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.657 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 566' ' ' ARG . . . . . 0.424 ' HA ' ' HB3' ' A' ' 394' ' ' ALA . 8.3 ttm180 -62.03 -37.09 83.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.064 0.459 . . . . 10.0 110.37 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 44.1 mt -88.71 -31.23 5.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.324 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -66.02 -44.77 83.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.185 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 569' ' ' ASN . . . . . 0.531 HD21 ' HA ' ' A' ' 394' ' ' ALA . 46.3 t30 -71.25 -23.64 62.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.885 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -63.2 -29.15 70.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.84 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 29.2 tp -72.1 -35.98 69.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.072 0.463 . . . . 10.0 110.167 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 -75.36 -31.09 60.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.256 0.55 . . . . 10.0 110.031 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -76.26 0.68 62.84 Favored Glycine 0 CA--C 1.519 0.303 0 CA-C-N 115.659 -0.701 . . . . 10.0 113.188 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.52 -33.35 72.68 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.794 0.33 . . . . 10.0 110.397 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 2.6 t -98.68 169.93 9.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.165 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 63.96 50.87 57.87 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.693 -0.765 . . . . 10.0 111.47 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 577' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' A' ' 580' ' ' ASP . 27.6 mtt180 -79.6 126.24 30.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.751 0.31 . . . . 10.0 110.996 -179.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 578' ' ' GLN . . . . . 0.595 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 7.4 tt0 56.76 32.6 21.51 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.626 -0.715 . . . . 10.0 110.746 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 78.18 43.08 14.06 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.797 -0.638 . . . . 10.0 112.651 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 580' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 577' ' ' ARG . 0.9 OUTLIER -100.11 -170.3 1.86 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.714 0.292 . . . . 10.0 110.841 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -83.89 172.37 12.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.114 -179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 146.94 174.13 18.76 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.783 -0.723 . . . . 10.0 112.107 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 2.0 p -157.69 155.48 30.05 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.872 -0.418 . . . . 10.0 109.872 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 79.9 p -131.15 135.85 47.82 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.052 0.453 . . . . 10.0 110.578 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 585' ' ' ARG . . . . . 0.489 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 1.6 tpm_? -139.29 116.97 11.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -108.47 148.02 30.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.99 0.424 . . . . 10.0 111.147 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 587' ' ' TYR . . . . . 0.489 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 84.4 m-85 -129.16 158.98 37.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.486 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 13.2 mt -157.62 169.29 24.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.857 0.361 . . . . 10.0 110.922 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.85 155.92 37.14 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.328 178.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 60.9 mmm -72.59 -15.22 61.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.292 0.568 . . . . 10.0 110.73 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -118.79 29.86 7.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.243 -0.89 . . . . 10.0 109.017 178.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.25 176.96 9.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.188 -0.914 . . . . 10.0 111.798 -178.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.03 77.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.525 -0.761 . . . . 10.0 111.606 -179.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 5.2 tp -68.69 -21.74 64.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.859 0.361 . . . . 10.0 110.945 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 13.1 mmt -77.27 9.58 3.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.416 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -106.16 -12.69 15.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.642 0.258 . . . . 10.0 110.542 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 18.8 pt -88.33 -1.71 8.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.855 0.36 . . . . 10.0 111.375 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -82.29 -9.15 59.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.964 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 69.84 -59.63 0.5 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.99 0.806 . . . . 10.0 111.908 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.5 m -88.79 115.03 26.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.713 0.292 . . . . 10.0 110.864 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -64.06 -23.3 67.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.197 0.522 . . . . 10.0 110.538 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 3.0 mmt180 -59.01 -24.48 62.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.481 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 76.4 t -68.17 -49.68 65.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 1.4 m -65.27 -36.94 85.66 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.551 -0.75 . . . . 10.0 110.0 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -63.47 -39.11 97.34 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.01 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 61.1 tpp -74.52 -27.92 60.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.121 0.486 . . . . 10.0 110.619 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 39.7 mtt -74.29 -18.94 60.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.347 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 608' ' ' ARG . . . . . 0.533 ' O ' ' HE2' ' A' ' 429' ' ' MET . 74.5 mtt-85 -77.5 6.11 7.68 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.053 0.454 . . . . 10.0 110.704 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -94.76 2.58 55.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.859 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 77.1 mt -80.93 -9.79 59.79 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.343 -0.389 . . . . 10.0 111.037 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 611' ' ' GLY . . . . . 0.436 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 83.85 -50.84 4.47 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.914 -0.66 . . . . 10.0 111.934 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 612' ' ' MET . . . . . 0.436 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.7 OUTLIER 73.66 -61.07 0.51 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.834 0.853 . . . . 10.0 111.847 179.145 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 613' ' ' LYS . . . . . 0.408 ' HZ1' ' CD ' ' A' ' 616' ' ' GLU . 2.6 tmtp? 62.85 93.17 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.301 0 O-C-N 123.536 0.523 . . . . 10.0 110.603 -179.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 614' ' ' PRO . . . . . 0.41 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 38.2 Cg_exo -57.09 94.94 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.136 2.558 . . . . 10.0 112.269 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 142.85 -29.47 2.1 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.831 -0.699 . . . . 10.0 111.916 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 616' ' ' GLU . . . . . 0.408 ' CD ' ' HZ1' ' A' ' 613' ' ' LYS . 0.4 OUTLIER -104.59 140.66 37.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.943 0.402 . . . . 10.0 110.981 -179.853 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -95.72 114.15 25.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.071 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.08 -37.62 78.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.795 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 51.78 74.67 0.25 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.763 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.97 105.23 20.39 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 120.86 0.362 . . . . 10.0 110.726 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.91 -21.27 25.67 Favored 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.659 2.906 . . . . 10.0 114.585 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 9.5 p-90 -60.43 -29.3 68.91 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 120.662 -0.415 . . . . 10.0 110.493 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 60.3 t -65.54 -48.85 81.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 85.1 m -61.36 -37.97 85.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.408 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -64.67 -42.47 95.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.122 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.09 94.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.641 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.1 -50.44 76.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.447 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -62.76 -35.73 80.76 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.116 0.484 . . . . 10.0 110.797 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 629' ' ' ASN . . . . . 0.56 ' O ' ' HG2' ' A' ' 633' ' ' LYS . 63.2 t30 -65.85 -44.56 85.12 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.849 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -67.15 -42.11 84.91 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.08 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -58.64 -40.54 83.68 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.379 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -61.57 -38.45 87.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.377 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 633' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 629' ' ' ASN . 26.1 mmtp -65.37 -37.79 88.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.166 -179.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 53.7 t -62.34 -47.1 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.081 0.467 . . . . 10.0 110.36 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -69.24 -35.78 76.48 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.67 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 49.1 m -64.63 -36.51 84.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.019 0.438 . . . . 10.0 110.04 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -67.89 -31.92 72.05 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -66.95 -38.14 85.58 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -65.02 -37.14 86.67 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.006 -0.543 . . . . 10.0 109.735 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 640' ' ' ASP . . . . . 0.62 ' O ' ' HG2' ' A' ' 644' ' ' GLN . 25.6 t0 -60.54 -35.84 76.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.636 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 59.1 mt -80.02 -38.57 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.325 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 642' ' ' ARG . . . . . 0.462 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 14.0 mtm-85 -61.71 -43.14 99.42 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.648 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 12.1 pttm -66.0 -26.88 67.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.868 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 644' ' ' GLN . . . . . 0.62 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 16.2 mm100 -65.03 -45.75 84.18 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 48.5 mt -65.63 -41.7 92.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.039 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 646' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 90.7 mt -63.5 -29.63 70.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.372 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.69 -28.32 69.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.078 0.465 . . . . 10.0 110.738 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -96.84 -28.28 14.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.621 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -75.38 -34.64 61.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.184 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 650' ' ' ASP . . . . . 0.494 ' O ' ' HB3' ' A' ' 653' ' ' ASN . 2.6 t0 -66.36 -23.51 66.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.13 0.49 . . . . 10.0 110.512 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 36.2 t -67.2 -42.01 87.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.319 0.58 . . . . 10.0 109.466 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -73.71 -22.5 59.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.473 -0.785 . . . . 10.0 109.912 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 653' ' ' ASN . . . . . 0.494 ' HB3' ' O ' ' A' ' 650' ' ' ASP . 18.1 t30 -61.39 -48.95 78.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.441 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -62.09 -46.85 87.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.62 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -62.67 -45.48 92.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.781 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 656' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 656' ' ' ARG . 11.2 ttp-105 -63.57 -40.76 97.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.332 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 30.9 ttp85 -61.74 -50.49 72.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.64 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -62.02 -49.08 77.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.732 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 659' ' ' ILE . . . . . 0.434 ' O ' ' HB2' ' A' ' 663' ' ' ARG . 8.7 tp -66.1 -34.52 70.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 116.628 -0.26 . . . . 10.0 111.6 -178.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -69.84 -34.21 73.33 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.731 0.301 . . . . 10.0 110.266 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.3 m -63.0 -54.26 41.05 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.112 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 662' ' ' GLN . . . . . 0.41 HE21 ' HB2' ' A' ' 662' ' ' GLN . 5.8 tt0 -62.12 -39.2 91.74 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.688 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 659' ' ' ILE . 2.2 tmt_? -60.44 -34.07 73.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.621 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -83.36 -37.75 22.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.714 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -57.86 -48.44 79.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.418 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 45.7 mt -72.21 -14.72 61.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.21 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 34.9 tp -86.16 -44.38 12.25 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.492 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -68.1 -53.94 21.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.898 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 29.4 m -59.99 150.9 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 112.26 0.467 . . . . 10.0 112.26 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.57 -50.6 5.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.482 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -83.48 150.37 26.05 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.238 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 6.6 p -141.07 8.74 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.051 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 15.4 m -49.84 -49.28 49.62 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.681 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.94 -51.85 67.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.767 -178.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 2.0 m -60.48 -50.49 73.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.158 -0.474 . . . . 10.0 112.084 -179.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 14.1 mm -62.13 -38.59 81.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 121.152 -0.219 . . . . 10.0 111.518 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -68.36 -42.77 78.72 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.167 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 45.0 m -58.09 -44.03 87.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.911 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 24.3 pt -79.6 -24.71 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.953 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 18.8 mtm-85 -61.32 -50.45 72.91 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.147 0.499 . . . . 10.0 110.059 178.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.98 -35.4 74.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.377 -0.829 . . . . 10.0 110.692 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -66.03 -47.21 75.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.639 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 44.5 t -61.9 -45.75 98.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.189 -0.459 . . . . 10.0 111.444 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -59.78 -42.68 93.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.585 -0.28 . . . . 10.0 110.618 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -62.47 -46.01 90.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.09 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.59 99.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.472 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 21.0 m -65.22 -45.92 82.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.695 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.98 -39.32 85.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 10.0 110.253 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.31 -28.1 62.76 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.788 -0.642 . . . . 10.0 112.111 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -70.26 -22.9 62.83 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.479 0.548 . . . . 10.0 112.479 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -119.86 -19.33 7.97 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.704 0.288 . . . . 10.0 111.544 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 42.8 mt -128.82 103.67 19.0 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.908 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -67.45 139.39 49.16 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.675 2.25 . . . . 10.0 111.745 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -50.23 106.27 0.12 Allowed 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.05 2.5 . . . . 10.0 113.215 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 61.7 86.99 0.1 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.478 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 2.3 p -142.9 -165.86 2.16 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.193 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 62.4 mt -99.17 161.79 13.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.465 0.174 . . . . 10.0 110.945 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . 0.541 ' HA ' ' CE3' ' A' ' 701' ' ' TRP . 15.0 tt0 -58.07 -31.27 66.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.314 -179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -66.13 -24.14 66.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.179 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 54.9 mtp -95.57 4.57 53.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.389 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 701' ' ' TRP . . . . . 0.541 ' CE3' ' HA ' ' A' ' 698' ' ' GLU . 50.2 m0 -103.2 111.88 24.48 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.733 0.301 . . . . 10.0 111.297 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -81.91 78.59 8.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.75 -0.833 . . . . 10.0 108.75 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 703' ' ' ILE . . . . . 0.538 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 44.5 mm -56.39 -51.9 77.35 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.243 -0.889 . . . . 10.0 111.951 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 704' ' ' PRO . . . . . 0.538 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 35.9 Cg_exo -60.65 -44.33 27.14 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.679 1.586 . . . . 10.0 111.836 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -61.1 -39.2 96.79 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.947 -0.644 . . . . 10.0 112.744 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 64.1 tp -78.1 -45.17 24.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.655 0.264 . . . . 10.0 111.392 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -59.67 -49.68 76.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.277 -0.42 . . . . 10.0 111.017 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -65.98 -30.3 70.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.88 0.372 . . . . 10.0 110.291 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 709' ' ' ARG . 5.2 tpt180 -62.74 -49.69 74.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.164 179.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 65.3 mt -67.23 -29.25 68.84 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.007 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.1 mtpp -78.13 -18.15 56.0 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.402 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -108.09 -53.3 2.65 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.1 -35.96 69.34 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.665 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -105.87 -12.57 15.8 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 121.061 -0.256 . . . . 10.0 111.348 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.43 24.08 13.98 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.887 -0.597 . . . . 10.0 112.261 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 23.7 tp -113.7 126.95 55.81 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.689 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -81.03 100.71 9.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.792 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 95.3 mt -113.57 114.15 47.58 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.432 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.69 66.57 8.05 Favored 'Trans proline' 0 CA--C 1.536 0.575 0 C-N-CA 122.93 2.42 . . . . 10.0 112.665 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 68.0 mt -60.5 -46.83 94.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.65 -179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -64.0 -31.19 72.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.918 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -69.87 -40.88 75.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.566 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 45.0 m0 -66.86 -54.14 25.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.672 -0.694 . . . . 10.0 111.477 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 16.9 tp -63.01 -18.57 63.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 10.0 112.144 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -77.88 -37.39 48.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.48 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -102.21 -25.97 13.5 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.131 0.419 . . . . 10.0 112.131 -178.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -122.11 78.58 42.73 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 121.01 0.433 . . . . 10.0 110.222 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -72.49 -9.05 23.61 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.845 2.363 . . . . 10.0 112.564 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -78.55 -10.84 59.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.836 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 93.4 mt -69.64 -29.37 66.83 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.222 0.534 . . . . 10.0 109.829 178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 51.53 -95.64 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.624 -1.171 . . . . 10.0 112.147 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -56.01 0.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.611 0.243 . . . . 10.0 111.526 -178.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -56.38 -54.34 46.78 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.797 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.46 -27.22 68.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.027 0.441 . . . . 10.0 110.756 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 25.3 tp -67.39 -43.49 81.19 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 33.7 mtt180 -61.65 -40.23 94.16 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.996 -0.547 . . . . 10.0 109.642 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -60.28 -45.51 93.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.379 -0.828 . . . . 10.0 110.687 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 23.1 mmm-85 -61.08 -45.43 94.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.807 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 97.0 mt -60.99 -52.78 57.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.707 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 21.1 tp -58.25 -46.33 86.16 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.789 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.61 99.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.376 -0.374 . . . . 10.0 111.181 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -62.98 -42.2 99.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.314 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.14 -41.71 98.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.701 0.286 . . . . 10.0 110.797 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 82.3 mt -67.05 -43.18 89.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.84 0.352 . . . . 10.0 110.232 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.97 -44.9 83.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.868 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 85.0 t -70.4 -40.22 77.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.716 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -59.19 -41.45 88.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.795 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -60.48 -31.54 70.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.439 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.23 -45.8 79.41 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 179.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -64.77 -37.79 88.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.719 -0.673 . . . . 10.0 109.516 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.478 ' HA ' ' HG3' ' A' ' 759' ' ' MET . 27.1 tt0 -62.57 -41.78 99.15 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.17 -0.923 . . . . 10.0 110.963 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -63.22 -41.08 99.08 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.511 -0.313 . . . . 10.0 111.4 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 39.6 t -67.22 -47.17 82.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.272 -0.422 . . . . 10.0 112.021 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 39.7 t -77.26 -42.06 30.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.207 0.527 . . . . 10.0 111.106 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 120.51 122.55 2.96 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 110.527 -1.029 . . . . 10.0 110.527 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 756' ' ' ALA . . . . . 0.458 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -51.01 -46.03 61.39 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.163 0.431 . . . . 10.0 112.163 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.61 -46.15 91.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.984 0.421 . . . . 10.0 110.949 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 15.6 tpt -66.62 -39.66 88.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.283 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 759' ' ' MET . . . . . 0.478 ' HG3' ' HA ' ' A' ' 751' ' ' GLU . 80.9 mmm -61.79 -41.24 97.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.211 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . 0.458 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.9 mmp_? -60.29 -39.0 85.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.236 0.541 . . . . 10.0 110.119 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -73.2 -34.83 66.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.802 -0.635 . . . . 10.0 109.644 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -66.86 -48.21 69.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.318 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -57.19 -46.06 83.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.082 0.467 . . . . 10.0 110.294 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -60.73 -42.57 97.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.082 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -64.72 -43.3 96.5 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 111.408 -0.677 . . . . 10.0 111.408 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 63.8 t -60.74 -43.23 94.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 11.9 mtp -60.96 -48.2 82.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.085 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 80.9 mt -60.55 -46.64 89.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.704 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -60.88 -52.68 64.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.361 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 9.4 m -60.2 -44.26 95.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.847 0.356 . . . . 10.0 111.358 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -64.32 -42.62 96.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.238 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 772' ' ' ASP . . . . . 0.615 ' O ' ' HG2' ' A' ' 776' ' ' LYS . 15.7 t70 -61.97 -51.27 68.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.806 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 773' ' ' SER . . . . . 0.533 ' HA ' ' HB3' ' B' ' 22' ' ' MET . 68.5 m -59.12 -44.48 92.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.079 -0.51 . . . . 10.0 112.371 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 23.5 mt -66.53 -35.02 79.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.712 0.291 . . . . 10.0 111.113 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -64.38 -37.6 88.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.991 0.424 . . . . 10.0 110.009 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.69 ' HD2' ' O ' ' A' ' 372' ' ' LEU . 26.6 mmtp -66.63 -41.32 88.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.398 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -63.02 -48.25 79.59 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 778' ' ' HIS . . . . . 0.596 ' O ' ' HG2' ' A' ' 782' ' ' MET . 72.0 t60 -58.78 -35.97 73.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.034 -0.984 . . . . 10.0 111.199 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 21.3 mt -59.55 -47.92 83.66 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.872 0.368 . . . . 10.0 110.306 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -69.51 -38.61 77.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.165 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.32 -36.03 74.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.412 -0.813 . . . . 10.0 111.192 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 782' ' ' MET . . . . . 0.596 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 98.6 mmm -60.56 -41.16 94.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.048 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.93 -41.67 70.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 10.0 110.096 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -62.15 -42.01 98.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.286 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 11.6 tp -67.94 -39.34 83.46 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.154 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -55.12 -36.53 65.83 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.721 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -76.19 -36.86 58.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.535 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -70.65 -16.27 73.96 Favored Glycine 0 N--CA 1.452 -0.24 0 CA-C-N 115.748 -0.66 . . . . 10.0 112.956 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 38.6 mm -58.97 -22.78 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 CA-C-O 121.128 0.489 . . . . 10.0 110.97 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 16.6 m80 -65.23 -21.24 66.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.695 179.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 73.7 mt -110.42 -35.54 6.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.495 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 3.7 mmt85 -65.4 -37.86 88.22 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.458 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -86.93 72.31 2.62 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.854 -0.688 . . . . 10.0 111.4 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 23.8 p90 -69.6 177.5 2.94 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.958 0.408 . . . . 10.0 111.175 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 795' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 796' ' ' GLN . . . -60.11 149.71 31.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.7 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 796' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 795' ' ' ALA . 11.8 mm100 72.24 16.72 5.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.299 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -139.01 147.09 41.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.064 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 798' ' ' ASP . . . . . 0.404 ' OD2' ' HB2' ' A' ' 800' ' ' LYS . 27.2 t70 -91.73 114.21 61.2 Favored Pre-proline 0 C--N 1.324 -0.531 0 C-N-CA 121.087 -0.245 . . . . 10.0 110.574 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -53.17 -31.25 54.35 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.15 2.567 . . . . 10.0 113.131 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 800' ' ' LYS . . . . . 0.404 ' HB2' ' OD2' ' A' ' 798' ' ' ASP . 28.1 mtmm -66.26 -55.23 17.15 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -63.64 -38.6 91.74 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.677 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.7 -48.39 82.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.04 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -59.91 -40.64 89.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.406 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -62.83 -47.81 81.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.792 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 37.0 ttp85 -62.44 -44.55 96.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.68 0.276 . . . . 10.0 111.002 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -58.5 -52.78 64.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.261 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 11.5 p -65.28 -39.56 92.74 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.297 0.481 . . . . 10.0 112.297 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -65.99 -44.68 84.14 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 121.032 -0.267 . . . . 10.0 110.89 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 17.5 m -65.71 -38.26 88.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.167 0.508 . . . . 10.0 110.102 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 35.0 ttm -63.85 -35.32 80.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.197 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -65.97 -38.9 89.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.271 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.88 92.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.353 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.46 73.86 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.468 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 17.7 ttp -64.53 -42.87 95.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.823 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 81.0 mt -66.07 -36.27 82.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.414 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -64.57 -38.05 89.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.227 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 13.0 m -73.51 -30.14 62.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.105 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 14.1 tp -58.77 -61.64 2.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.134 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -60.01 -36.24 76.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.011 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -60.08 -57.41 12.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.196 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -63.74 -37.67 88.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.836 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 41.1 t -57.91 -51.85 65.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.891 0.377 . . . . 10.0 110.71 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 30.4 mm -68.22 -37.92 78.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.647 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 46.4 t -60.01 -48.42 81.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.169 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 24.6 m -60.43 -40.61 91.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.494 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 96.0 mt -69.65 -23.03 63.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.275 -0.421 . . . . 10.0 111.812 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 7.5 m -93.4 -36.42 12.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.801 0.334 . . . . 10.0 110.481 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 51.2 mttm -67.5 -28.3 67.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.783 -0.644 . . . . 10.0 112.133 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 6.6 p -65.51 112.13 1.68 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 121.573 0.701 . . . . 10.0 109.842 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -94.97 117.59 30.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.188 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 12.1 t -110.28 141.5 25.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.559 -0.746 . . . . 10.0 109.214 179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.85 114.62 1.48 Allowed 'General case' 0 C--N 1.33 -0.249 0 O-C-N 123.636 0.585 . . . . 10.0 110.639 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 77.8 mtp -102.36 113.99 65.62 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.633 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.36 161.69 44.82 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 122.591 2.194 . . . . 10.0 112.074 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -69.07 113.73 6.71 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.07 179.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 . . . . . 0 C--O 1.245 0.858 0 CA-C-O 118.666 -0.683 . . . . 10.0 110.774 -179.437 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 110.32 -0.252 . . . . 10.0 110.32 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -65.55 127.24 31.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.209 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 pt -72.94 94.79 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.503 0.668 . . . . 10.0 110.987 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.65 27.48 0.97 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.086 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 88.5 mt -77.37 71.45 3.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.638 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -154.67 123.28 6.12 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.461 -0.79 . . . . 10.0 109.739 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 ttpt -58.82 112.64 1.71 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.962 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -103.52 70.54 1.04 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.961 0.41 . . . . 10.0 111.599 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . 0.416 ' HA ' ' HE ' ' B' ' 9' ' ' ARG . 0.0 OUTLIER -156.49 129.01 7.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.832 -0.622 . . . . 10.0 109.533 178.782 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -60.47 134.49 57.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.741 -0.663 . . . . 10.0 112.575 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 61.0 tp -96.27 109.94 49.93 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.422 178.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -61.14 -25.59 81.26 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.008 2.472 . . . . 10.0 112.626 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 62.7 tp -60.08 -27.15 66.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.973 -0.558 . . . . 10.0 111.628 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.59 -46.33 76.33 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -74.14 -27.48 22.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.758 0.313 . . . . 10.0 110.847 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.34 -26.85 68.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.098 0.475 . . . . 10.0 110.429 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 95.3 t -81.24 -39.77 17.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.073 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.13 -48.66 80.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.557 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.59 -1.28 45.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.812 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -86.44 4.86 85.72 Favored Glycine 0 N--CA 1.45 -0.407 0 CA-C-N 116.063 -0.517 . . . . 10.0 112.977 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 87.5 t -63.33 -29.71 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.476 0.655 . . . . 10.0 110.277 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.533 ' HB3' ' HA ' ' A' ' 773' ' ' SER . 17.0 tpt -114.5 92.53 3.99 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.511 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 1.1 m -71.36 143.83 50.08 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.345 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.62 -8.55 59.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.068 0.461 . . . . 10.0 110.626 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -85.41 90.93 8.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.355 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.17 131.01 55.47 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.401 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -98.6 12.22 35.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.548 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.364 -0.827 . . . . 10.0 111.014 -179.75 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.48 1.032 0 CA-C-O 120.878 0.371 . . . . 10.0 110.441 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -90.39 140.33 29.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.569 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.41 176.0 14.22 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.899 -0.667 . . . . 10.0 112.541 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.5 127.72 32.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.946 0.403 . . . . 10.0 110.506 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.56 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 8.7 mmt180 -70.22 144.52 51.86 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.62 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.6 m120 73.35 -63.13 0.44 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.097 -0.956 . . . . 10.0 112.059 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.94 -54.47 21.67 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -178.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -86.31 -25.86 25.22 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.966 0.728 . . . . 10.0 112.966 -178.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.0 p -60.61 -46.68 89.37 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.72 -0.392 . . . . 10.0 110.685 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.2 mt -64.46 -31.79 73.15 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.784 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -67.62 -45.78 74.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.072 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -67.4 -44.17 79.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.51 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 39.6 mtt -63.55 -34.04 76.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.88 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.5 tpp180 -61.32 -35.7 78.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.944 0.402 . . . . 10.0 110.304 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -65.52 -39.8 92.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.808 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -69.04 -39.45 79.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.915 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 52.7 t -58.33 -37.51 63.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 121.277 0.56 . . . . 10.0 109.935 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -65.45 -38.74 90.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.334 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 72.1 mt -66.64 -45.02 89.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.075 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.5 mt -59.33 -41.76 85.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.642 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -67.55 -27.69 67.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.074 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.25 -26.66 30.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.064 0.459 . . . . 10.0 110.597 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 8.6 tpt -83.95 -18.72 36.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.629 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.472 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 37.2 tt0 -56.98 -52.01 77.32 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.304 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.472 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 71.5 Cg_exo -53.47 -33.41 67.37 Favored 'Trans proline' 0 C--N 1.36 1.159 0 C-N-CA 121.927 1.751 . . . . 10.0 112.178 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.433 ' CD ' ' HZ2' ' A' ' 37' ' ' LYS . 38.8 tp10 -70.52 -40.31 73.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.168 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.3 mmt -66.59 -29.83 69.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.579 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -66.14 -23.09 66.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.562 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.433 ' HZ2' ' CD ' ' A' ' 34' ' ' GLU . 43.0 mtpt -83.32 -24.2 32.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.046 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp -76.92 142.19 40.2 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.542 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.7 p -82.48 171.12 14.48 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.041 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -57.03 -38.78 73.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.312 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -68.43 -36.33 78.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.904 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.9 -32.11 70.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.285 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.98 -45.4 94.93 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -67.44 -31.45 71.63 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.951 -1.022 . . . . 10.0 109.725 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.81 -37.59 95.11 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.56 -0.746 . . . . 10.0 111.736 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -67.28 -36.26 81.18 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.724 -0.472 . . . . 10.0 109.724 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 19.1 m -58.18 -48.16 81.16 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.162 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.54 -35.25 80.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.342 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.18 -43.2 99.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.553 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -58.79 -43.06 90.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.738 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.7 mtp180 -61.81 -44.23 97.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.656 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 56' ' ' LYS . . . -66.67 -39.41 88.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.267 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 -62.83 -39.29 93.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.555 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 mt -58.09 -37.36 74.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.317 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.15 -37.14 72.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.321 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.432 ' HG3' ' O ' ' A' ' 52' ' ' ALA . 28.4 mtpp -72.72 -9.19 58.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.958 -0.565 . . . . 10.0 111.204 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.67 61.67 0.66 Allowed Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.757 -0.735 . . . . 10.0 111.983 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -116.91 146.1 43.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.718 -0.475 . . . . 10.0 109.718 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 38.2 t -85.84 133.18 30.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.182 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.405 HD12 ' O ' ' A' ' 118' ' ' LEU . 17.8 tp -61.09 -43.89 98.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.918 0.389 . . . . 10.0 110.464 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -65.83 -21.54 66.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.17 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -81.23 -17.36 49.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.243 0.544 . . . . 10.0 110.151 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.1 mt -84.65 -13.29 51.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.079 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.487 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 73.9 mt -50.23 -52.55 52.91 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 113.054 0.761 . . . . 10.0 113.054 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.487 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.0 Cg_exo -53.46 -34.77 73.35 Favored 'Trans proline' 0 C--N 1.36 1.151 0 C-N-CA 122.362 2.041 . . . . 10.0 113.444 -179.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -89.58 -46.59 8.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.46 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.8 -47.92 83.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.996 -178.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -63.33 -32.34 73.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.675 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.91 -43.63 78.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.257 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.08 -47.72 92.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.107 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 46.7 t -59.5 -45.21 94.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.34 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.414 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 19.0 ttm180 -61.0 -44.86 96.8 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.604 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 29.1 tp10 -61.05 -48.4 81.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.376 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.99 -33.27 74.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.079 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 29.8 m -61.04 -35.89 78.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.746 0.307 . . . . 10.0 111.059 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -75.06 -16.89 60.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.296 -0.411 . . . . 10.0 112.028 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -104.24 -35.83 7.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.762 0.315 . . . . 10.0 111.518 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 92.8 t -81.41 -52.52 13.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.614 -0.266 . . . . 10.0 111.64 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -104.22 -14.05 15.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.656 0.265 . . . . 10.0 111.562 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.22 29.09 66.96 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.714 -0.755 . . . . 10.0 111.552 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.5 mtt -126.49 141.23 51.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.799 0.333 . . . . 10.0 110.791 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 37.0 ttt85 -85.59 122.67 30.03 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.95 111.06 1.52 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -47.23 141.12 4.76 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 124.139 0.9 . . . . 10.0 112.307 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -64.17 -34.42 78.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.338 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 m -69.58 -25.19 28.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.847 0.355 . . . . 10.0 110.839 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -71.67 -28.4 63.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.826 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.415 ' O ' ' HG3' ' A' ' 92' ' ' MET . 85.2 mt -62.03 -36.78 82.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.055 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 36.0 mt -66.15 -47.88 72.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.826 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -63.14 -36.45 93.46 Favored Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.712 -0.677 . . . . 10.0 112.164 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.76 -34.57 89.12 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.195 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.415 ' HG3' ' O ' ' A' ' 88' ' ' LEU . 38.4 mtt -74.21 -35.87 63.93 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.2 t -65.47 -43.05 94.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 10.0 110.02 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 84.3 mt -72.92 -5.35 37.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.268 -0.878 . . . . 10.0 111.966 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -83.29 -24.67 32.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.892 0.377 . . . . 10.0 110.383 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -103.37 -146.33 0.37 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.585 -179.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 97' ' ' ARG . 28.7 ttt85 -108.07 58.98 0.61 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.168 0.509 . . . . 10.0 110.189 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 408' ' ' ASP . 0.0 OUTLIER -137.57 150.19 47.28 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.335 0.588 . . . . 10.0 111.981 -178.862 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 50.7 mm -93.46 132.55 37.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.373 -0.831 . . . . 10.0 108.881 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -107.6 120.11 41.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.735 0.302 . . . . 10.0 111.703 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -85.47 125.68 33.22 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.4 mtm -122.48 140.6 52.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.076 0.465 . . . . 10.0 110.886 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.482 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 11.5 mmm180 -77.1 152.19 35.08 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.563 -0.744 . . . . 10.0 111.082 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.65 94.68 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.9 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.2 -33.48 1.23 Allowed Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.824 -0.703 . . . . 10.0 112.353 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.62 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 2.2 mm-40 -65.56 -49.42 68.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.013 0.435 . . . . 10.0 110.292 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 143.79 168.03 12.08 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.753 -0.737 . . . . 10.0 112.085 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.97 -82.63 0.65 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.93 0.395 . . . . 10.0 110.461 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.03 -20.86 66.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.166 0.508 . . . . 10.0 111.117 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 27.7 tp -70.02 -19.96 63.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.252 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 3.2 m -95.72 -36.6 11.13 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.194 0.521 . . . . 10.0 110.654 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.417 ' HB1' ' SD ' ' A' ' 390' ' ' MET . . . -75.98 -4.66 42.35 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.863 0.69 . . . . 10.0 112.863 -178.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.06 -24.28 61.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.947 0.403 . . . . 10.0 111.27 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 17.7 mt -71.15 -57.13 4.95 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-N 116.11 -0.495 . . . . 10.0 111.795 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -61.92 -30.62 83.98 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 122.17 1.914 . . . . 10.0 112.222 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.55 -47.16 73.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.635 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.428 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 65.4 t80 -61.25 -46.15 91.59 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.068 0.461 . . . . 10.0 110.477 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.405 ' O ' HD12 ' A' ' 60' ' ' LEU . 20.5 tp -61.86 -50.39 72.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.629 -0.714 . . . . 10.0 112.007 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -68.2 -28.42 67.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.24 -28.51 67.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.396 0.141 . . . . 10.0 111.34 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 85.9 mt -55.38 -29.24 58.08 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 76.7 p -66.29 -26.82 67.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.632 -0.258 . . . . 10.0 111.363 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.36 -1.33 87.41 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.389 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -76.53 -21.41 55.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.717 0.294 . . . . 10.0 110.953 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 101.12 138.04 10.05 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.708 -0.758 . . . . 10.0 113.778 178.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 68.4 t -107.04 121.39 59.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -98.41 102.7 14.52 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.67 0.271 . . . . 10.0 110.782 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 26.2 t -95.59 125.06 48.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.905 0.384 . . . . 10.0 110.447 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 79.3 t -110.48 117.59 55.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.453 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.87 160.76 14.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.955 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 13.2 m -67.24 -35.25 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -145.63 161.35 40.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.518 -0.31 . . . . 10.0 110.187 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -67.37 -28.83 68.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.697 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -55.3 -53.7 52.83 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.132 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.3 mt -74.23 -32.92 63.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.877 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -53.83 -49.98 67.19 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.833 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -72.1 -36.41 69.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.856 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 17.6 ttp180 -62.61 -59.64 4.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.966 -0.561 . . . . 10.0 112.13 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.63 -29.31 69.32 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.667 -178.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.45 88.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 10.0 110.55 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -75.8 -26.0 56.88 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.154 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . 0.418 ' O ' ' HD2' ' A' ' 145' ' ' PRO . 11.3 t30 -73.43 -40.82 63.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.021 0.439 . . . . 10.0 110.634 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -86.92 -6.81 58.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.367 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.503 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 61.7 ttm-85 -60.01 -49.46 91.06 Favored Pre-proline 0 CA--C 1.537 0.467 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' PRO . . . . . 0.503 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 34.1 Cg_exo -63.81 -10.37 22.25 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 122.155 1.903 . . . . 10.0 112.886 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 20.3 tp -96.07 -48.92 5.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.935 0.398 . . . . 10.0 110.424 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -71.54 -51.11 25.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.012 -0.54 . . . . 10.0 112.18 -178.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -65.27 -23.48 67.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.677 0.275 . . . . 10.0 111.438 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -67.17 -28.92 68.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.105 0.479 . . . . 10.0 110.037 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 43.9 mt -96.9 -2.41 43.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.006 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 98.82 22.8 12.81 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.598 -0.811 . . . . 10.0 113.502 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 43.2 mt -109.76 121.8 46.05 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.7 p -78.4 130.32 35.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.016 0.436 . . . . 10.0 112.024 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 48.3 t -104.74 127.88 58.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.933 -0.576 . . . . 10.0 109.971 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -123.02 142.72 14.73 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.613 -0.803 . . . . 10.0 112.264 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 6.6 tp -112.85 134.55 55.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -121.34 110.29 15.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.856 0.36 . . . . 10.0 110.247 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.486 ' O ' ' HB2' ' A' ' 161' ' ' MET . 94.1 mt -102.4 147.75 34.44 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.617 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' PRO . . . . . 0.514 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 16.7 Cg_endo -58.49 114.26 1.91 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.7 2.267 . . . . 10.0 112.232 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 99.63 6.96 54.36 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.771 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' MET . . . . . 0.486 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.1 OUTLIER -67.27 144.8 98.36 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 110.529 -0.174 . . . . 10.0 110.529 179.57 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -57.3 149.56 64.0 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.635 2.223 . . . . 10.0 112.301 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -52.09 -49.86 82.03 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 112.769 0.655 . . . . 10.0 112.769 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.504 ' O ' ' HG3' ' A' ' 168' ' ' GLU . 53.0 Cg_exo -57.15 -41.39 74.66 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 121.774 1.65 . . . . 10.0 112.029 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -63.08 -44.42 95.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.661 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.449 ' HE2' ' O ' ' A' ' 161' ' ' MET . 59.6 mttm -60.86 -45.44 94.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.432 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -57.83 -42.69 84.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.821 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.504 ' HG3' ' O ' ' A' ' 164' ' ' PRO . 58.2 mt-10 -66.28 -39.12 89.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.784 0.326 . . . . 10.0 111.024 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -69.44 -42.56 74.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.584 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -74.7 -31.2 61.8 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.449 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.12 3.26 18.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.882 0.372 . . . . 10.0 110.832 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -84.59 -179.17 7.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.148 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -79.22 -42.59 25.62 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.1 mp -128.78 121.51 54.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.281 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.7 m -108.74 123.34 48.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.84 0.352 . . . . 10.0 111.353 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -102.71 131.26 49.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.747 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.62 176.74 44.05 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.568 -0.825 . . . . 10.0 112.202 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.79 155.79 16.63 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.77 0.319 . . . . 10.0 111.158 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -59.99 -35.4 74.95 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.237 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -55.63 -57.87 10.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.037 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . 0.514 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.6 tp10 -69.53 -36.61 76.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.381 -178.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -58.1 -38.87 77.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.904 0.383 . . . . 10.0 111.308 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -78.23 -42.4 15.29 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.715 -0.755 . . . . 10.0 111.921 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -64.56 -38.17 90.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.767 0.318 . . . . 10.0 111.077 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . 0.401 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 10.9 m-20 -60.6 -41.55 94.98 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.47 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -64.51 -38.33 90.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.411 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 18.6 mt -63.85 -44.78 92.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.777 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 39.0 mtm-85 -72.03 -36.05 69.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.868 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -64.14 -47.29 80.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.287 0.565 . . . . 10.0 110.917 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.69 -8.91 57.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.804 -0.634 . . . . 10.0 112.258 -178.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 17.8 ttp -101.08 14.71 31.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.169 0.509 . . . . 10.0 110.75 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -76.42 160.13 29.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.843 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -102.69 -24.16 13.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.176 0.513 . . . . 10.0 110.029 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 67.7 m -129.0 140.84 39.8 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.716 -0.674 . . . . 10.0 109.625 178.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.0 -24.96 75.83 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.847 2.364 . . . . 10.0 112.846 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.83 -9.35 58.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.585 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -91.66 -6.93 51.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.854 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 19.4 mtt85 -58.97 155.94 12.52 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.148 0.499 . . . . 10.0 111.875 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 16.1 m -137.43 -16.29 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.514 -0.766 . . . . 10.0 111.047 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -84.87 -178.5 6.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.324 0.583 . . . . 10.0 111.799 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -143.02 177.22 8.51 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.218 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 32.9 tttm -60.88 133.74 56.39 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.203 0.525 . . . . 10.0 111.201 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 17.4 mt -84.94 69.93 10.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.612 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . 0.412 ' HA ' ' OE2' ' A' ' 385' ' ' GLU . 18.3 t-80 -81.09 -64.66 1.14 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.905 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -124.69 133.76 53.1 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.935 0.397 . . . . 10.0 111.288 -178.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.56 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . . . -119.99 123.3 43.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.626 179.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 53.6 tp -117.09 100.36 7.68 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.073 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -94.04 128.59 45.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.052 0.454 . . . . 10.0 110.579 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -55.99 -72.15 0.08 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.324 -0.853 . . . . 10.0 111.905 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.39 105.45 13.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.638 0.256 . . . . 10.0 110.681 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 27.4 m -68.38 -22.32 27.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.537 -0.302 . . . . 10.0 111.178 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . 0.556 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.2 m-20 -45.04 -64.08 0.79 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.026 0.828 . . . . 10.0 111.878 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' SER . . . . . 0.444 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 68.7 m -96.62 -37.08 10.5 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.801 0.667 . . . . 10.0 112.801 -178.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 73.4 mt -64.21 -38.62 82.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -178.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 12.7 mt -102.25 -50.82 3.52 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 216' ' ' ILE . . . . . 0.556 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 50.5 mm -73.62 -56.31 9.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.979 0.733 . . . . 10.0 112.979 -177.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 217' ' ' ASP . . . . . 0.444 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 79.0 m-20 -63.45 -45.74 89.47 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.133 0.42 . . . . 10.0 112.133 -178.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -93.26 28.91 2.05 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -66.97 -48.38 68.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.972 0.415 . . . . 10.0 111.644 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 220' ' ' ARG . . . . . 0.416 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -98.59 18.8 15.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.063 -179.007 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 85.0 m -84.57 113.0 46.41 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.319 -0.401 . . . . 10.0 110.465 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -92.82 135.1 1.25 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.806 2.337 . . . . 10.0 113.17 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 223' ' ' LEU . . . . . 0.637 ' O ' ' HA ' ' A' ' 374' ' ' SER . 96.9 mt -94.48 120.17 34.3 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 21.6 mt -113.99 132.76 62.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.241 0.46 . . . . 10.0 112.241 -178.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 27.9 mt -113.51 107.4 22.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 108.767 -0.827 . . . . 10.0 108.767 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 4.3 m -114.01 109.84 19.1 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.98 0.419 . . . . 10.0 111.453 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -125.42 80.09 0.36 Allowed Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 111.277 -0.729 . . . . 10.0 111.277 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -62.34 130.32 29.88 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.718 2.279 . . . . 10.0 112.525 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -98.3 93.05 6.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.839 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 74.22 116.93 0.05 Allowed 'General case' 0 N--CA 1.467 0.378 0 O-C-N 124.185 0.928 . . . . 10.0 111.786 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 231' ' ' ASP . . . . . 0.41 ' HA ' ' HB2' ' A' ' 367' ' ' ASN . 2.0 m-20 -74.67 72.64 1.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.351 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 38.1 m -156.79 104.74 2.15 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.341 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 49.1 m -140.35 83.82 1.93 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.94 0.4 . . . . 10.0 110.888 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . 0.408 ' HA ' HD13 ' A' ' 365' ' ' ILE . 1.4 tp10 -70.08 -2.8 13.93 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.125 -0.488 . . . . 10.0 111.63 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -57.98 -41.87 83.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.914 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -65.81 -26.87 67.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.012 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 237' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 241' ' ' LYS . 4.2 ttmt -69.34 -37.29 77.61 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 52.0 mmm-85 -67.57 -47.75 68.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.61 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 4.2 p -69.37 -21.33 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 116.286 -0.415 . . . . 10.0 111.5 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -89.39 -14.33 35.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.444 0.64 . . . . 10.0 109.572 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 241' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 237' ' ' LYS . 0.1 OUTLIER -97.98 9.89 41.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.21 -179.132 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 26.5 pt -75.23 -16.4 15.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.063 0.458 . . . . 10.0 109.966 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 243' ' ' ILE . . . . . . . . . . . . . 5.5 pt -124.36 74.98 61.29 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.996 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 244' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -81.54 -19.72 7.37 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.209 1.939 . . . . 10.0 112.144 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -110.84 105.25 14.01 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.712 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 23.6 mt -83.93 167.42 16.98 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.161 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 66.3 mt -125.05 -32.82 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.66 -0.245 . . . . 10.0 110.853 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? 57.33 33.92 23.99 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.706 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 -153.77 -57.33 0.12 Allowed 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.936 -0.306 . . . . 10.0 111.268 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -136.53 132.15 34.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.566 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . 0.482 ' HG3' ' HG2' ' A' ' 252' ' ' GLU . 55.7 pttt 51.08 -178.55 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.982 1.313 . . . . 10.0 113.953 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 252' ' ' GLU . . . . . 0.482 ' HG2' ' HG3' ' A' ' 251' ' ' LYS . 5.3 mm-40 64.11 -74.36 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 114.813 -1.085 . . . . 10.0 113.267 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -113.76 29.59 7.89 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.285 0.846 . . . . 10.0 113.285 -177.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 9.7 m -73.57 144.1 46.18 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 122.093 -0.379 . . . . 10.0 110.498 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . 0.401 ' C ' ' HG1' ' A' ' 256' ' ' THR . 0.0 OUTLIER -85.78 -43.88 12.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.486 0.66 . . . . 10.0 109.944 179.722 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 256' ' ' THR . . . . . 0.401 ' HG1' ' C ' ' A' ' 255' ' ' GLU . 55.0 m -156.24 -50.4 0.08 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.383 -0.826 . . . . 10.0 109.124 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 9.6 t80 60.02 -81.51 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.268 -0.878 . . . . 10.0 112.115 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 10.7 tp60 63.1 15.07 8.19 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.023 0.529 . . . . 10.0 110.766 -179.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 86.92 -16.42 47.15 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.834 -0.621 . . . . 10.0 113.078 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -101.75 -47.59 4.56 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.719 0.295 . . . . 10.0 111.682 -178.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 87.13 -132.32 11.1 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.555 -0.831 . . . . 10.0 111.632 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -145.51 172.05 13.78 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.357 -0.238 . . . . 10.0 110.357 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -74.79 171.69 13.52 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 18.3 m -77.17 67.56 3.16 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.107 0.479 . . . . 10.0 110.819 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 5.3 m -133.22 -32.72 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.293 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -168.31 -173.42 1.98 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.493 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -131.13 5.87 4.52 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.757 0.313 . . . . 10.0 111.133 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 268' ' ' LYS . . . . . . . . . . . . . 19.9 mttp -114.57 105.99 13.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.295 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 58.0 m -81.51 89.94 6.21 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 47.3 mtp85 -85.18 60.49 6.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.924 -178.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.28 -18.07 20.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.01 179.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 15.3 t 51.65 76.51 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.33 -0.85 . . . . 10.0 110.78 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -153.94 -51.56 0.1 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.077 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 74.5 mt 71.1 153.04 0.12 Allowed 'General case' 0 N--CA 1.472 0.675 0 O-C-N 123.697 0.623 . . . . 10.0 110.446 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -149.88 -84.95 0.09 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.76 0.652 . . . . 10.0 112.76 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 57.69 52.37 8.3 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.76 0.79 . . . . 10.0 109.838 -177.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -85.64 13.21 7.34 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.203 -0.908 . . . . 10.0 110.182 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . -102.87 -21.33 10.35 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.514 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 59.05 40.79 21.71 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.215 0.531 . . . . 10.0 109.856 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 13.6 p -124.15 -18.67 3.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.805 -0.634 . . . . 10.0 111.14 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 281' ' ' LEU . . . . . 0.421 HD21 ' H ' ' A' ' 251' ' ' LYS . 47.1 mt -92.98 -42.27 9.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.826 0.346 . . . . 10.0 110.277 -179.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 32.8 pt -82.03 9.07 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.21 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -66.6 -59.54 3.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.57 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -87.58 11.82 14.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.189 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 1.7 tt -72.75 -27.66 62.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.047 0.451 . . . . 10.0 110.074 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 48.8 mt -86.79 -169.97 2.87 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.854 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 287' ' ' VAL . . . . . . . . . . . . . 3.3 t 60.37 34.81 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 CA-C-O 121.802 0.811 . . . . 10.0 110.372 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm -138.16 128.29 25.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.675 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 67.78 -165.81 0.2 Allowed 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.827 0.704 . . . . 10.0 111.379 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -88.01 141.25 16.88 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.893 -0.67 . . . . 10.0 111.942 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 291' ' ' ILE . . . . . . . . . . . . . 1.4 tt 90.85 143.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 124.389 1.076 . . . . 10.0 109.394 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 60.4 mtm 68.7 16.99 8.95 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.864 0.84 . . . . 10.0 108.851 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -102.83 -4.33 25.03 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.5 -1.227 . . . . 10.0 110.434 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -85.95 -34.97 20.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.487 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 133.21 28.92 0.52 Allowed Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.609 -0.805 . . . . 10.0 113.165 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -86.23 172.05 10.8 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.864 0.332 . . . . 10.0 110.379 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 297' ' ' SER . . . . . 0.419 ' HB3' ' CE1' ' A' ' 299' ' ' TYR . 44.8 m -113.24 131.2 56.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.882 0.372 . . . . 10.0 110.717 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 20.4 tp -75.37 -29.13 59.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.873 -0.603 . . . . 10.0 112.027 -178.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 299' ' ' TYR . . . . . 0.419 ' CE1' ' HB3' ' A' ' 297' ' ' SER . 55.2 p90 -79.74 -7.73 58.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.446 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 44.7 m -89.39 146.95 37.01 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.969 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -59.8 -14.83 28.91 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 123.441 2.761 . . . . 10.0 113.13 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -68.71 -41.28 79.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.04 0.448 . . . . 10.0 110.744 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -110.81 26.85 10.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.558 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 9.3 tp -60.82 -26.39 38.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.512 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -44.07 95.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.091 0.472 . . . . 10.0 109.745 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -67.88 -36.15 79.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.757 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 13.5 tpt -60.68 -36.94 80.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.828 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -78.01 -15.14 59.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.603 -0.272 . . . . 10.0 110.813 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -84.14 -42.98 15.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.897 0.38 . . . . 10.0 110.121 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 18.0 m -71.05 -33.5 51.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.108 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.83 -26.35 66.01 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.319 0.58 . . . . 10.0 109.868 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 312' ' ' ALA . . . . . 0.603 ' O ' ' HG2' ' A' ' 315' ' ' ARG . . . -72.46 -43.16 64.13 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 178.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -62.8 -38.05 89.12 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.392 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 3.7 mp -70.07 -43.48 71.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.335 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 315' ' ' ARG . . . . . 0.603 ' HG2' ' O ' ' A' ' 312' ' ' ALA . 12.1 ptp180 -64.33 -28.31 69.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.824 0.345 . . . . 10.0 110.49 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -85.92 9.18 17.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.929 0.395 . . . . 10.0 110.898 179.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -110.55 -42.66 4.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.392 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -113.65 -31.62 6.43 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.019 0.748 . . . . 10.0 113.019 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 319' ' ' LEU . . . . . 0.556 ' HB2' ' O ' ' A' ' 315' ' ' ARG . 3.7 mm? -79.64 -58.09 3.36 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.858 -0.337 . . . . 10.0 110.383 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -86.45 108.06 18.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.87 0.367 . . . . 10.0 110.088 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 321' ' ' THR . . . . . 0.527 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 0.2 OUTLIER -94.97 140.77 29.48 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.176 -179.383 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 322' ' ' ARG . . . . . 0.433 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 6.8 tpt180 -64.49 141.83 58.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.688 -0.687 . . . . 10.0 111.48 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 323' ' ' ASP . . . . . 0.433 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 94.1 m-20 77.71 -53.19 0.53 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.228 1.011 . . . . 10.0 113.189 177.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 324' ' ' VAL . . . . . 0.527 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 3.0 p -74.66 -46.78 41.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.543 0 N-CA-C 112.742 0.645 . . . . 10.0 112.742 -178.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -87.06 -26.27 23.78 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.822 0.344 . . . . 10.0 111.515 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -158.56 152.49 23.65 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.31 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 6.9 tp -124.49 119.52 56.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.232 0.539 . . . . 10.0 110.105 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 55.3 t -95.26 108.62 21.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.023 -0.535 . . . . 10.0 109.989 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.13 140.39 34.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.554 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 63.43 16.6 9.68 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.044 0.45 . . . . 10.0 110.452 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 85.84 2.26 86.57 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 111.557 -0.617 . . . . 10.0 111.557 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -100.07 137.89 37.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.666 0.269 . . . . 10.0 110.497 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 42.8 t -100.0 91.93 2.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.134 0.493 . . . . 10.0 109.698 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 87.2 mt -86.88 128.47 39.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.432 -179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 4.2 mp -80.74 133.85 28.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.411 -0.358 . . . . 10.0 110.478 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 60.2 t -111.72 127.15 69.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.39 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 337' ' ' ASP . . . . . 0.482 ' HB3' ' H ' ' A' ' 342' ' ' ARG . 0.9 OUTLIER -72.83 122.4 21.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.916 178.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -75.65 -16.09 60.24 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.844 -0.616 . . . . 10.0 112.184 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -75.67 -58.57 3.2 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.383 0.512 . . . . 10.0 112.383 -178.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -122.69 13.19 9.99 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.67 0.619 . . . . 10.0 112.67 -178.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 61.78 59.29 9.95 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.552 -0.832 . . . . 10.0 111.911 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . 0.482 ' H ' ' HB3' ' A' ' 337' ' ' ASP . 0.0 OUTLIER -103.25 141.92 35.07 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.702 0.287 . . . . 10.0 110.606 -179.756 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 6.9 m -88.75 116.81 27.29 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.228 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 43.7 mtm -118.52 82.04 1.78 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.023 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -90.28 -20.71 22.62 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.769 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -105.04 53.59 0.66 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.595 -0.812 . . . . 10.0 112.13 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -146.41 145.15 30.15 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -117.04 156.81 26.89 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.023 0.439 . . . . 10.0 110.725 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 349' ' ' TRP . . . . . 0.461 ' O ' ' HD2' ' A' ' 354' ' ' HIS . 68.5 m95 -128.25 105.39 8.32 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.427 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 24.2 m -72.47 -171.61 0.82 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.619 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 35.4 t70 70.04 6.71 5.89 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.586 0.708 . . . . 10.0 110.834 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 84.39 16.07 67.43 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.717 -0.674 . . . . 10.0 112.836 179.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 4.5 mp -55.98 -60.82 2.93 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.782 0.325 . . . . 10.0 111.726 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 354' ' ' HIS . . . . . 0.461 ' HD2' ' O ' ' A' ' 349' ' ' TRP . 13.6 p80 -75.47 -19.81 59.19 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.923 -0.311 . . . . 10.0 111.379 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 355' ' ' GLN . . . . . 0.554 ' HA ' ' NE2' ' A' ' 355' ' ' GLN . 0.0 OUTLIER -66.35 -32.23 73.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.896 0.379 . . . . 10.0 110.829 -179.177 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -73.12 -28.15 62.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.82 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 93.6 t -69.52 -49.11 62.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.068 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.502 ' OE1' ' HG2' ' A' ' 366' ' ' GLN . 15.7 mt-10 -66.8 -15.74 63.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.967 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -91.68 -25.47 19.1 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.135 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -78.04 -54.46 6.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.745 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -94.87 178.28 5.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.811 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -79.11 69.69 2.9 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.202 -0.523 . . . . 10.0 112.543 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 2.1 t -126.55 156.54 37.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.972 -0.381 . . . . 10.0 109.972 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 6.5 tm0? -76.15 125.11 28.54 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.264 -0.643 . . . . 10.0 109.264 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 365' ' ' ILE . . . . . 0.408 HD13 ' HA ' ' A' ' 234' ' ' GLU . 25.9 mt -86.63 132.68 31.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.866 0.365 . . . . 10.0 111.849 -178.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 366' ' ' GLN . . . . . 0.502 ' HG2' ' OE1' ' A' ' 358' ' ' GLU . 32.0 mm-40 -79.21 -172.59 3.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.583 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 367' ' ' ASN . . . . . 0.41 ' HB2' ' HA ' ' A' ' 231' ' ' ASP . 2.2 t-20 -103.2 -2.61 26.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.796 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 66.6 -171.45 0.19 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.556 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -90.92 -59.17 2.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.967 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 67.58 151.85 0.08 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.425 0.898 . . . . 10.0 113.425 178.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 1.7 m -101.77 69.61 1.21 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.048 -0.978 . . . . 10.0 108.934 178.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 372' ' ' LEU . . . . . 0.43 HD23 ' HB ' ' B' ' 21' ' ' VAL . 33.1 mt -66.52 -27.1 67.5 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.9 -1.045 . . . . 10.0 112.791 -177.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -161.21 131.16 4.92 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 374' ' ' SER . . . . . 0.637 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 1.4 t -156.41 142.55 18.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.115 0.483 . . . . 10.0 111.516 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 14.3 tt -146.9 147.39 17.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.794 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.96 142.37 30.54 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -56.74 -49.18 76.0 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 123.036 0.21 . . . . 10.0 111.215 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 378' ' ' GLN . . . . . 0.43 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.5 tm0? -57.07 -43.89 82.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.028 0.442 . . . . 10.0 110.715 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -73.54 -11.36 60.42 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.72 -0.673 . . . . 10.0 111.768 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -93.69 -44.88 7.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.911 0.386 . . . . 10.0 110.329 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -69.36 -21.7 63.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.136 -0.483 . . . . 10.0 111.313 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -72.88 -4.18 30.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.134 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 56.9 mt -97.42 8.57 44.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.937 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.56 ' CD2' ' HB3' ' A' ' 206' ' ' ALA . 27.6 m-85 -99.17 146.44 26.15 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.818 0.342 . . . . 10.0 110.793 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 385' ' ' GLU . . . . . 0.412 ' OE2' ' HA ' ' A' ' 204' ' ' HIS . 34.4 mt-10 -70.37 -65.8 0.68 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.091 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -102.63 104.09 14.43 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 61.5 tp -110.72 110.61 21.33 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.641 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -131.92 165.66 23.41 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.783 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -163.84 162.7 35.31 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.403 -0.903 . . . . 10.0 112.409 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 390' ' ' MET . . . . . 0.417 ' SD ' ' HB1' ' A' ' 112' ' ' ALA . 63.3 mtm -107.82 156.85 18.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.989 0.424 . . . . 10.0 110.399 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 15.3 t -153.59 165.68 35.15 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.21 179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -101.9 -171.25 27.58 Favored Glycine 0 N--CA 1.441 -1.006 0 N-CA-C 110.613 -0.995 . . . . 10.0 110.613 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 393' ' ' THR . . . . . 0.482 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 3.1 m -74.67 66.26 1.43 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.536 0.684 . . . . 10.0 110.589 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -102.76 -45.72 4.92 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.125 -0.943 . . . . 10.0 110.274 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 395' ' ' ASP . . . . . 0.465 ' CG ' ' H ' ' A' ' 396' ' ' THR . 10.0 t70 56.78 -144.35 0.66 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.615 -0.721 . . . . 10.0 110.214 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 396' ' ' THR . . . . . 0.465 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 3.0 m 70.02 -79.88 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.851 0.686 . . . . 10.0 112.851 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -79.31 26.98 0.26 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 10.0 111.683 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 398' ' ' ALA . . . . . 0.449 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -66.21 -35.89 81.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.138 0.494 . . . . 10.0 110.992 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -72.76 -15.58 61.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.598 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -83.88 -21.32 31.99 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.651 -0.25 . . . . 10.0 111.047 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 401' ' ' PHE . . . . . 0.449 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 24.7 m-85 -59.61 -46.67 88.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.056 0.455 . . . . 10.0 110.546 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.55 -0.15 36.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.733 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.3 m -108.26 -43.71 4.3 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.772 0.286 . . . . 10.0 111.772 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 44.6 mt -86.41 -55.18 6.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 405' ' ' TYR . . . . . 0.43 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 60.8 m-85 -100.04 -4.81 29.14 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 31.4 mmtt 60.98 51.09 4.69 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.365 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 26.4 mt -117.65 149.77 40.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.896 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . 0.56 ' OD2' ' HD2' ' A' ' 13' ' ' ARG . 21.0 t70 -85.2 170.25 13.04 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 18.2 m -138.71 120.73 15.59 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.835 -0.541 . . . . 10.0 111.605 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 14.0 t -127.35 137.11 58.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.326 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 87.4 t -93.45 133.33 34.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.648 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 59.2 t -91.3 127.07 52.52 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.795 -0.446 . . . . 10.0 109.795 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.66 142.1 69.18 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.522 2.148 . . . . 10.0 112.634 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.41 ' HB ' ' O ' ' A' ' 416' ' ' ARG . 0.2 OUTLIER -64.1 151.55 42.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.584 -0.735 . . . . 10.0 111.604 -179.868 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -70.0 -26.85 64.27 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.178 0.514 . . . . 10.0 110.492 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 416' ' ' ARG . . . . . 0.509 ' HB2' ' O ' ' A' ' 578' ' ' GLN . 58.3 mtm180 -134.14 157.9 76.55 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.84 122.49 11.06 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.28 1.987 . . . . 10.0 111.445 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 3.8 mtm -76.53 100.42 5.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.034 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.6 pt -95.24 51.39 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.303 0.573 . . . . 10.0 110.602 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 30.4 ttp-105 -94.2 116.02 28.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.494 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -84.43 105.04 14.95 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.148 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -88.54 112.47 23.05 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 26.5 mt -93.06 150.62 39.53 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.547 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -62.68 163.69 20.75 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.52 2.147 . . . . 10.0 112.381 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -83.7 133.97 34.78 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.937 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 31.3 mt -105.88 94.72 5.33 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.148 0.499 . . . . 10.0 110.389 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 21.8 t -90.24 119.43 37.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.345 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 428' ' ' TYR . . . . . 0.514 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 3.3 m-85 -105.22 177.86 4.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.043 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 8.8 mmm -77.21 -77.62 0.14 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.862 -0.335 . . . . 10.0 111.409 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 41.4 p -86.09 165.65 16.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.972 0.415 . . . . 10.0 111.431 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.44 -40.17 95.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.691 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.97 82.01 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.129 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -60.96 -42.03 97.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.272 0.558 . . . . 10.0 109.972 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 434' ' ' LYS . . . . . 0.504 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 28.4 ttpt -65.79 -52.42 50.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.369 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 32.3 mm -61.04 -44.1 97.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.342 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.56 -36.99 74.77 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.72 0.295 . . . . 10.0 110.985 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.91 -37.36 70.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.312 179.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 81.1 mt -62.65 -45.59 98.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.155 179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 37.8 mm -59.89 -39.95 81.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.6 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -65.66 -43.78 88.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.601 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -60.35 -40.75 91.86 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.167 0.508 . . . . 10.0 110.136 179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 71.9 mt -70.74 -42.48 77.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.724 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -60.07 -42.52 94.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.035 -0.529 . . . . 10.0 111.147 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -73.38 0.79 11.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.159 -0.473 . . . . 10.0 112.202 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 70.3 mtt-85 -117.41 -31.25 5.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.855 0.359 . . . . 10.0 110.917 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.19 -28.31 65.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.229 0.538 . . . . 10.0 109.859 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -80.82 -3.47 51.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.38 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -108.89 -38.85 5.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.876 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 121.05 18.6 3.8 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.722 -0.752 . . . . 10.0 113.004 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -98.5 125.51 42.68 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 122.541 -0.388 . . . . 10.0 111.081 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.12 144.96 48.18 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.767 2.311 . . . . 10.0 111.226 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 84.0 t -125.62 128.04 72.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.978 0.418 . . . . 10.0 111.464 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 58.2 tp -108.46 111.2 22.96 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.182 -0.673 . . . . 10.0 109.182 178.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 47.5 t -94.72 124.42 47.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.523 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -111.3 114.52 3.68 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.839 -0.696 . . . . 10.0 111.898 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 22.8 p -106.17 145.21 31.81 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.712 0.291 . . . . 10.0 110.882 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 23.1 pt -92.71 -2.63 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.781 0.324 . . . . 10.0 111.142 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 59.5 m -149.66 141.48 23.69 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.433 -0.348 . . . . 10.0 110.234 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 17.1 mt -61.69 -34.38 61.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-O 121.111 0.482 . . . . 10.0 110.603 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -56.89 -40.31 75.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.539 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.36 -33.53 69.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.475 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.5 m -62.44 -48.08 81.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.352 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -62.55 -37.78 87.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.203 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 55.8 tp -62.94 -54.85 32.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.341 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.5 p -65.7 -32.65 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.621 -0.263 . . . . 10.0 111.632 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 60.0 m -65.68 -37.56 86.82 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.777 0.322 . . . . 10.0 110.644 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -64.41 -48.47 75.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.523 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . 0.413 ' CD ' ' HZ1' ' A' ' 471' ' ' LYS . 20.9 mm-40 -61.91 -41.24 97.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.122 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 26.4 mt -60.91 -36.05 78.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.675 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.3 m -70.45 -34.89 72.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.11 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.413 ' HZ1' ' CD ' ' A' ' 468' ' ' GLU . 42.5 mtpt -63.98 -37.21 86.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.336 179.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.48 -16.68 51.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.129 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 81.47 29.02 41.43 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.307 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 60.9 mt -94.64 121.31 45.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 110.263 -0.273 . . . . 10.0 110.263 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -59.16 125.67 24.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.658 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 53.0 p-80 -148.6 151.59 35.29 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.762 -178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -134.8 141.06 46.32 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.4 t -105.81 131.29 55.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.818 0.342 . . . . 10.0 110.836 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 67.8 mt -73.08 105.53 4.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.107 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.89 123.84 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.48 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -82.58 -8.82 59.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.043 -0.526 . . . . 10.0 112.209 -178.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -92.85 -53.09 4.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.174 0.512 . . . . 10.0 110.014 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -102.49 96.61 7.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.37 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' HIS . . . . . 0.401 ' HA ' ' HB3' ' A' ' 487' ' ' GLU . 9.9 m170 -66.6 -15.48 63.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.685 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -57.98 -49.26 77.44 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.032 0.444 . . . . 10.0 110.6 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -72.56 -41.52 65.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.73 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.401 ' HB3' ' HA ' ' A' ' 484' ' ' HIS . 1.7 tt0 -55.36 -57.14 13.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.575 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -57.94 -34.2 69.64 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.571 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -67.88 -41.84 82.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.776 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 45.7 mt -69.5 -45.81 77.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.809 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 89.8 t -56.22 -38.38 54.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.402 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -60.82 -26.47 67.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.743 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -124.3 27.61 6.98 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.818 0.342 . . . . 10.0 110.721 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -73.72 -19.81 60.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.124 0.487 . . . . 10.0 110.943 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -90.58 10.39 74.74 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.669 -0.777 . . . . 10.0 112.023 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -67.26 140.29 95.33 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 110.269 -0.271 . . . . 10.0 110.269 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -51.9 123.91 13.47 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.616 2.211 . . . . 10.0 112.918 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 63.62 39.96 8.37 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.388 -0.824 . . . . 10.0 112.483 178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -109.03 118.86 37.89 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 37.1 t -97.07 112.81 29.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.029 0.442 . . . . 10.0 110.426 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.8 m -111.91 128.37 56.12 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.41 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 43.4 mt -109.34 124.76 66.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.896 0.379 . . . . 10.0 110.328 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -120.45 128.98 53.67 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.865 -179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 14.4 m -103.86 120.75 41.65 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.578 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 58.49 77.19 0.31 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.368 0.604 . . . . 10.0 110.453 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.56 133.3 34.45 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.449 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.67 -178.37 4.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.806 -0.633 . . . . 10.0 110.945 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -73.07 164.15 54.93 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.166 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 68.89 -75.44 0.07 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.116 0.567 . . . . 10.0 111.34 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 84.24 143.86 6.05 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.976 -0.631 . . . . 10.0 112.095 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.93 150.73 23.55 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.853 0.359 . . . . 10.0 111.463 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -75.67 95.93 3.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.014 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 71.4 mt -85.47 115.71 27.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.986 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 19.0 t -90.51 140.15 16.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.94 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 61.0 mt -67.91 128.85 38.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.302 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 87.28 9.11 73.59 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.438 -0.665 . . . . 10.0 111.438 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 91.8 -171.7 34.79 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 111.064 -0.814 . . . . 10.0 111.064 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 25.5 p -128.65 110.59 12.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.121 0.46 . . . . 10.0 110.441 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 61.7 p-90 -59.31 -25.32 64.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.568 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -41.63 91.44 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.451 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -73.23 -32.8 64.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.921 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -70.06 -47.49 61.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.194 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.8 m -68.14 -25.5 32.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.937 0.398 . . . . 10.0 110.232 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -80.52 -8.58 59.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.574 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -97.19 10.08 40.42 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.276 0.56 . . . . 10.0 110.645 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 70.8 mt -105.16 141.18 37.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.941 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 48.8 mp0 -73.99 -33.05 63.68 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.248 0.547 . . . . 10.0 109.769 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -137.96 82.08 26.18 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.547 -0.751 . . . . 10.0 109.692 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -78.18 95.01 1.06 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.835 2.357 . . . . 10.0 111.734 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 1.4 p -77.69 160.15 28.66 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.68 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.08 -44.12 70.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 10.0 111.437 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -63.55 -39.95 95.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.437 -0.347 . . . . 10.0 111.238 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.71 -42.37 95.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.669 0.271 . . . . 10.0 110.65 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 92.3 mt -59.88 -44.77 95.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.192 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.19 -36.97 69.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.149 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -64.26 -47.63 78.85 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.583 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 87.9 mt -64.04 -40.41 88.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.652 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -60.78 -37.63 82.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.826 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -65.32 -39.83 92.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.725 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.43 -40.02 67.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.013 -0.54 . . . . 10.0 109.978 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 56.8 t90 -57.69 -40.34 79.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.68 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 64.6 tp60 -56.43 -42.74 78.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.497 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.5 -44.67 93.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.451 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -69.93 -37.49 75.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.8 -0.637 . . . . 10.0 110.525 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 17.6 t-80 -61.26 -51.18 70.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.855 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -68.19 -31.36 70.84 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.639 -0.71 . . . . 10.0 111.312 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -63.67 -36.24 83.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.161 0.505 . . . . 10.0 110.179 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 71.7 t -78.74 -40.1 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.466 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 19.4 tp -59.3 -48.02 83.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.543 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -78.48 2.32 19.38 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.613 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -101.15 -5.06 26.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.808 0.337 . . . . 10.0 110.979 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 116.71 3.31 18.47 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.639 -0.791 . . . . 10.0 112.861 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 75.04 -162.5 53.81 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.993 -0.622 . . . . 10.0 112.632 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 44.3 tp -73.89 120.5 19.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.875 0.369 . . . . 10.0 110.576 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -94.47 123.28 37.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.999 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 36.7 mm -103.2 129.63 54.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.264 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 557' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 10.7 mt -123.84 118.22 53.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.923 0.392 . . . . 10.0 110.207 178.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.16 118.27 5.81 Favored Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 111.28 -0.728 . . . . 10.0 111.28 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 18.8 p -68.89 -38.83 79.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.144 0.497 . . . . 10.0 110.195 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 28.0 mp0 -144.34 158.86 43.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.124 -0.944 . . . . 10.0 109.638 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -104.89 -160.12 0.74 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.62 -0.881 . . . . 10.0 108.62 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -152.32 150.92 30.26 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.769 -0.372 . . . . 10.0 110.552 178.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -51.14 -47.54 62.04 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 123.882 0.739 . . . . 10.0 110.377 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 564' ' ' SER . . . . . 0.428 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.7 OUTLIER -69.2 104.45 2.2 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.225 178.918 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -69.86 -19.99 63.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.105 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 16.1 ttm180 -59.01 -40.92 86.43 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.3 0.572 . . . . 10.0 109.771 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 48.0 mt -79.09 -36.33 18.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.718 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.59 -54.79 41.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.642 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -61.97 -40.1 94.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.149 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -65.0 -31.55 72.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.816 0.341 . . . . 10.0 110.884 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 37.2 tp -76.06 -31.28 58.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.136 0.493 . . . . 10.0 110.355 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 9.6 ttp180 -76.81 -36.4 56.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.66 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.15 36.61 2.37 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 121.071 -0.585 . . . . 10.0 114.137 -178.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -83.89 -44.02 14.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 117.134 0.467 . . . . 10.0 110.095 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 5.9 m -81.76 175.55 10.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.072 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 67.5 45.93 73.87 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.435 -0.888 . . . . 10.0 111.689 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -70.64 118.28 13.24 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.354 -0.239 . . . . 10.0 110.354 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 578' ' ' GLN . . . . . 0.62 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 9.7 tt0 62.45 30.48 17.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.471 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 82.11 51.93 4.25 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.836 -0.62 . . . . 10.0 112.266 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.41 -167.62 1.21 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.375 -0.231 . . . . 10.0 110.375 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -87.03 175.44 8.11 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.252 0.549 . . . . 10.0 111.87 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 153.65 164.62 12.83 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.546 -0.752 . . . . 10.0 111.924 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.0 p -148.06 125.41 11.59 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 110.368 -0.234 . . . . 10.0 110.368 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.17 128.08 54.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.169 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 585' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 1.2 ttm180 -138.62 120.61 15.54 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -111.14 155.53 22.74 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.022 0.439 . . . . 10.0 110.61 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 587' ' ' TYR . . . . . 0.504 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 56.6 m-85 -129.27 166.17 19.97 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.852 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 15.8 tp -161.69 158.31 25.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.533 -0.303 . . . . 10.0 110.274 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 589' ' ' SER . . . . . 0.451 ' OG ' ' HD3' ' A' ' 434' ' ' LYS . 0.7 OUTLIER -123.34 143.82 49.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.306 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 590' ' ' MET . . . . . 0.513 ' SD ' ' HE1' ' A' ' 595' ' ' MET . 92.0 mmm -71.39 -11.64 61.0 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.361 -0.381 . . . . 10.0 111.252 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -108.76 7.64 26.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.538 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -81.66 158.24 24.35 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.341 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -67.38 -30.05 69.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.816 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 13.4 tp -66.89 -25.14 66.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.698 0.285 . . . . 10.0 111.53 -179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.513 ' HE1' ' SD ' ' A' ' 590' ' ' MET . 4.1 tpt -74.2 0.65 13.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.128 0.489 . . . . 10.0 111.127 -179.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -94.52 1.07 55.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.269 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 41.5 pt -72.99 -7.79 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-O 120.637 0.255 . . . . 10.0 111.664 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -81.07 -7.67 59.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.61 -0.268 . . . . 10.0 110.842 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.4 -64.56 0.38 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.498 0.719 . . . . 10.0 111.196 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 4.0 m -77.64 116.59 18.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.795 0.331 . . . . 10.0 110.473 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -62.71 -26.04 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.125 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 76.0 mmt-85 -60.45 -29.44 69.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.21 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 59.9 t -66.68 -51.66 53.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 604' ' ' SER . . . . . 0.548 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 0.7 OUTLIER -63.25 -38.05 89.65 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.989 179.063 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -61.48 -38.69 96.2 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.922 -0.581 . . . . 10.0 112.507 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 42.5 tpp -74.29 -33.52 63.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.955 0.407 . . . . 10.0 110.679 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 51.2 mtt -68.68 -17.91 64.17 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.047 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 608' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 604' ' ' SER . 63.7 mtt180 -77.6 -5.46 50.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.155 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -91.92 8.46 37.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.986 0.422 . . . . 10.0 110.306 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 25.0 tp -73.15 -16.33 61.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 10.0 111.186 -179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 98.79 -43.78 1.82 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.981 -0.628 . . . . 10.0 111.671 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 70.62 -54.97 0.64 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.687 0.795 . . . . 10.0 112.596 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt 59.64 76.13 0.45 Allowed Pre-proline 0 N--CA 1.463 0.219 0 O-C-N 123.448 0.467 . . . . 10.0 110.485 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 614' ' ' PRO . . . . . 0.514 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 32.3 Cg_exo -58.38 96.95 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.454 2.769 . . . . 10.0 113.064 -178.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 130.17 -13.66 5.72 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.778 -0.725 . . . . 10.0 111.92 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -117.16 142.54 46.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.86 0.362 . . . . 10.0 110.253 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -80.59 107.32 13.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.387 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.63 -30.31 49.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.962 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 41.5 74.25 0.11 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.564 0.746 . . . . 10.0 112.68 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 22.6 m170 -117.61 100.37 52.53 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -57.01 -29.28 82.24 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 123.415 2.744 . . . . 10.0 113.982 -178.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 68.3 p-90 -68.79 -20.4 64.33 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.746 -0.382 . . . . 10.0 111.075 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.88 -48.96 73.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.705 -0.48 . . . . 10.0 109.705 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.28 -39.27 82.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.42 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -69.68 -36.29 75.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.891 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -65.15 -44.7 87.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.402 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 75.7 mt -64.44 -42.99 96.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.024 -0.534 . . . . 10.0 110.254 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.81 -38.63 86.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.482 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -67.47 -39.92 85.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.141 179.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -65.69 -44.11 87.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.652 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -61.45 -42.32 98.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.109 0.481 . . . . 10.0 109.743 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -62.28 -30.38 71.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.632 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -64.7 -39.32 93.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.521 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 13.3 t -64.52 -43.13 96.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.428 ' OE2' ' HA ' ' A' ' 564' ' ' SER . 3.6 mm-40 -65.0 -35.7 82.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.865 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 27.9 m -62.92 -42.95 99.97 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.701 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -63.33 -41.74 98.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.394 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . 0.526 HD22 ' NH2' ' A' ' 642' ' ' ARG . 0.6 OUTLIER -59.01 -43.5 91.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.298 -0.865 . . . . 10.0 110.322 179.189 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -67.76 -39.3 84.18 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.869 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 640' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 27.0 t70 -60.06 -35.56 75.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.202 -0.453 . . . . 10.0 110.394 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 66.6 mt -83.29 -36.16 12.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.795 178.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 642' ' ' ARG . . . . . 0.526 ' NH2' HD22 ' A' ' 638' ' ' ASN . 1.7 ttp180 -57.74 -40.47 79.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.419 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 20.2 pttm -69.15 -28.34 66.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.312 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -66.9 -38.26 85.9 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.908 0.385 . . . . 10.0 110.181 -179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 26.8 mt -66.73 -38.41 86.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.878 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 646' ' ' LEU . . . . . . . . . . . . . 94.9 mt -64.0 -35.02 79.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.698 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 647' ' ' GLU . . . . . 0.444 ' CD ' ' HZ3' ' A' ' 804' ' ' LYS . 3.6 mm-40 -63.73 -19.81 65.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.969 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -100.57 -45.86 5.39 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.323 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -72.1 -28.47 63.32 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.029 0.751 . . . . 10.0 113.029 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -67.16 -22.79 65.75 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.05 0.452 . . . . 10.0 110.554 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 18.7 t -68.88 -48.87 68.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -68.18 -29.52 68.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.437 -0.801 . . . . 10.0 109.579 178.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -60.12 -51.53 69.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.615 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -60.92 -45.83 93.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.769 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -61.32 -42.78 99.24 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.458 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 4.3 ttp-105 -63.39 -42.55 98.82 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.924 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -62.21 -44.35 96.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.592 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.73 -48.68 76.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.592 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.45 -34.64 58.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.599 -0.273 . . . . 10.0 111.547 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -64.98 -44.34 89.64 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.0 m -61.62 -41.75 97.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.014 -0.539 . . . . 10.0 109.921 179.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -65.05 -46.64 80.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.727 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 23.8 ttt-85 -65.08 -43.62 91.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.724 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -66.61 -35.12 79.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.734 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -62.65 -51.2 68.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.081 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 666' ' ' LEU . . . . . 0.485 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 54.4 mt -65.28 -28.81 69.6 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.227 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 27.9 tp -71.21 -40.76 70.95 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.962 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.8 -41.8 74.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.812 -178.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 33.0 m -82.6 158.7 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.38 . . . . 10.0 111.223 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 50.8 m -102.97 -34.04 9.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.752 0.31 . . . . 10.0 111.111 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -90.31 117.07 28.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.848 0.356 . . . . 10.0 110.409 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 8.1 p -123.21 -1.01 6.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.656 0.741 . . . . 10.0 109.947 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 673' ' ' SER . . . . . 0.416 ' OG ' ' HD3' ' A' ' 760' ' ' ARG . 0.3 OUTLIER -54.15 -39.09 66.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.868 -1.06 . . . . 10.0 111.846 -179.209 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -59.44 -48.19 82.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.833 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 1.8 m -64.68 -44.27 90.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.664 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 44.4 mm -57.72 -48.34 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.689 -0.687 . . . . 10.0 111.438 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -66.53 -39.83 88.8 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.605 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 46.3 m -64.42 -46.01 85.09 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.867 0.321 . . . . 10.0 111.867 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 37.9 pt -71.67 -25.29 24.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.472 -0.491 . . . . 10.0 110.642 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 3.4 ttm-85 -58.55 -39.41 80.16 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.848 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -63.23 -43.76 97.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.667 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -70.56 -36.9 73.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.129 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 69.1 t -59.5 -52.21 63.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 120.928 0.394 . . . . 10.0 110.429 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -63.41 -38.75 92.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.919 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 10.2 tttm -58.02 -52.53 65.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.24 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -61.46 -37.69 84.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.033 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 35.8 m -64.14 -41.58 97.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.543 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 94.2 mt -70.53 -42.44 78.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.241 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -56.3 -30.35 62.4 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.042 0.449 . . . . 10.0 111.725 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -66.33 -25.26 66.74 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.77 0.656 . . . . 10.0 112.77 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -120.86 -24.14 5.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.917 0.389 . . . . 10.0 111.445 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 71.3 mt -127.65 103.76 21.77 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.4 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -68.58 128.79 17.69 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.027 1.818 . . . . 10.0 111.338 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -54.79 123.03 12.73 Favored 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 122.695 2.263 . . . . 10.0 112.784 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 61.55 78.76 0.28 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.251 -0.886 . . . . 10.0 111.406 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 17.5 p -145.93 -167.72 2.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.134 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 79.4 mt -85.65 152.54 23.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.64 0.257 . . . . 10.0 110.51 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.73 -31.49 68.35 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.741 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -76.63 -3.42 37.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.591 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.45 3.63 35.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.055 0.455 . . . . 10.0 110.238 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 701' ' ' TRP . . . . . . . . . . . . . 34.2 m0 -100.9 107.78 19.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.939 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -82.34 82.48 7.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.207 0.527 . . . . 10.0 109.582 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 703' ' ' ILE . . . . . 0.539 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 46.8 mm -58.6 -50.82 85.95 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.443 -0.799 . . . . 10.0 111.65 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 704' ' ' PRO . . . . . 0.539 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.2 Cg_exo -57.23 -42.94 57.47 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 121.91 1.74 . . . . 10.0 112.078 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -60.45 -42.96 99.21 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.128 -0.558 . . . . 10.0 111.993 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 47.5 tp -67.73 -39.95 84.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.97 0.414 . . . . 10.0 110.135 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -64.37 -49.29 72.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.482 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -58.29 -35.92 72.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.005 0.431 . . . . 10.0 110.26 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -66.35 -52.36 47.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.673 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 93.8 mt -65.69 -38.66 89.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.751 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -78.33 0.02 27.13 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.847 0.684 . . . . 10.0 112.847 -178.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -127.33 -53.58 1.37 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.846 0.355 . . . . 10.0 111.69 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 713' ' ' ASP . . . . . 0.555 ' O ' ' HE2' ' A' ' 828' ' ' LYS . 0.9 OUTLIER -76.15 -39.08 55.82 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.591 -178.461 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -100.6 -14.67 18.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.607 0.225 . . . . 10.0 111.607 -179.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.48 33.06 18.72 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.337 0.589 . . . . 10.0 110.678 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 49.3 tp -115.45 114.09 24.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.171 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -83.53 115.43 22.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.881 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 50.2 mt -133.14 129.52 20.96 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.121 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -86.04 61.6 5.01 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 123.116 2.544 . . . . 10.0 112.035 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 31.3 mt -60.62 -36.95 73.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.274 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -62.69 -30.86 71.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.972 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.12 -39.31 29.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.157 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 34.0 m0 -61.06 -48.36 82.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.155 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 55.2 tp -69.0 -20.02 64.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.682 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -87.61 -46.01 9.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.762 0.315 . . . . 10.0 111.384 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -81.86 -31.69 31.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.464 -0.334 . . . . 10.0 111.698 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -123.16 76.59 51.68 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 116.622 -0.263 . . . . 10.0 110.959 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.5 -18.87 60.54 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.38 2.053 . . . . 10.0 111.784 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.09 -15.95 63.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.301 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 67.3 mt -66.43 -23.35 66.28 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.766 0.317 . . . . 10.0 110.456 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 57.19 -101.98 0.14 Allowed 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 115.528 -0.76 . . . . 10.0 111.303 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -144.8 -47.02 0.24 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.022 0.439 . . . . 10.0 109.907 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -59.5 -51.07 71.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.118 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 3.1 m -62.69 -31.69 72.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.126 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 8.3 mt -60.74 -42.01 96.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.898 0.38 . . . . 10.0 110.198 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -62.69 -43.44 98.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.707 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -62.07 -39.28 91.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.35 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 27.4 mmm-85 -64.48 -46.41 83.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.317 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 90.2 mt -61.94 -43.47 97.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.278 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 54.1 tp -61.5 -52.67 63.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.912 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -58.8 -41.03 85.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.124 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -62.7 -40.75 98.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.967 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 24.3 p -64.46 -30.13 71.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.903 0.382 . . . . 10.0 110.453 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 744' ' ' ILE . . . . . 0.448 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 78.1 mt -73.28 -47.95 44.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 10.0 109.898 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -49.24 78.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.105 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 76.1 t -60.89 -38.12 78.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.064 0.459 . . . . 10.0 110.401 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -65.5 -42.94 91.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.041 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 748' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 27.0 mt-30 -63.02 -37.36 86.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.367 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 -59.59 -34.97 73.41 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.355 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -76.75 -36.83 56.84 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -61.4 -35.64 78.06 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.016 -0.993 . . . . 10.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -68.88 -14.6 63.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.759 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.47 -37.57 5.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.754 0.312 . . . . 10.0 111.639 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.7 t -84.15 -42.75 17.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.864 0.364 . . . . 10.0 111.364 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 126.07 130.69 3.46 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.905 -0.878 . . . . 10.0 110.905 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 756' ' ' ALA . . . . . 0.584 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -56.35 -54.22 48.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.749 0.309 . . . . 10.0 111.603 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -64.1 -38.1 89.82 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.089 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 14.3 tpt -64.86 -43.85 91.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.318 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 70.0 mmm -60.26 -43.97 95.7 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 116.06 -0.518 . . . . 10.0 111.151 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . 0.584 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 15.6 mmp_? -55.23 -41.78 72.52 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.244 0.545 . . . . 10.0 111.06 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -72.97 -35.2 66.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.265 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -66.84 -45.24 78.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.273 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -58.15 -47.07 84.47 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.641 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 764' ' ' LYS . . . . . 0.485 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 83.0 tttt -61.52 -45.72 92.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.785 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -59.88 -48.31 86.72 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.01 -0.614 . . . . 10.0 111.992 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 55.8 t -63.05 -44.63 99.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.617 0.246 . . . . 10.0 110.879 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 21.4 ttt -60.11 -47.91 83.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.813 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 48.0 mt -63.04 -43.01 99.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.644 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -60.39 -48.27 82.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.926 0.393 . . . . 10.0 110.538 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 11.9 m -62.43 -44.17 97.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.735 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 4.4 tt -61.35 -47.33 86.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.622 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 772' ' ' ASP . . . . . 0.562 ' O ' ' HG3' ' A' ' 776' ' ' LYS . 1.9 t70 -62.03 -47.39 84.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.091 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 29.6 m -59.15 -48.06 82.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.424 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 74.5 mt -65.91 -30.35 70.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.979 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -65.48 -40.88 93.64 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 772' ' ' ASP . 51.5 mttm -63.01 -39.14 93.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.913 -0.585 . . . . 10.0 109.767 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 777' ' ' GLU . . . . . 0.458 ' OE1' ' HB ' ' B' ' 15' ' ' VAL . 1.3 tp10 -64.73 -42.96 94.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.416 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 778' ' ' HIS . . . . . 0.483 ' O ' ' HG2' ' A' ' 782' ' ' MET . 47.1 t60 -63.49 -41.02 98.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.371 -0.831 . . . . 10.0 110.575 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 39.5 mt -56.26 -50.59 70.9 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 123.335 0.397 . . . . 10.0 110.421 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -65.62 -44.04 87.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.78 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.2 73.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.671 -179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 782' ' ' MET . . . . . 0.483 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 91.6 mmm -61.0 -41.98 97.56 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.909 0.385 . . . . 10.0 110.929 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -75.49 -33.35 60.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.583 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -60.86 -39.26 88.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.932 0.396 . . . . 10.0 110.257 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.1 tp -76.23 -32.16 58.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.576 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -65.63 -38.96 90.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.617 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -65.7 -48.5 71.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.529 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -82.93 25.34 4.74 Favored Glycine 0 CA--C 1.518 0.258 0 CA-C-N 115.849 -0.614 . . . . 10.0 113.539 -178.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 10.2 tp -64.0 -18.13 21.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.996 0.427 . . . . 10.0 110.779 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -61.98 -29.86 70.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.855 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 99.3 mt -94.94 -12.39 26.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.413 -179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -94.57 -35.85 12.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.856 0.36 . . . . 10.0 110.859 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -91.87 75.62 1.42 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.579 -0.82 . . . . 10.0 112.781 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -84.54 -172.39 4.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.718 0.294 . . . . 10.0 110.614 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -70.22 150.03 46.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.691 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 65.12 22.58 12.31 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.612 -0.722 . . . . 10.0 111.665 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -148.14 133.09 18.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.432 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 798' ' ' ASP . . . . . 0.405 ' HA ' ' HD3' ' A' ' 799' ' ' PRO . 19.5 t70 -76.46 120.95 83.9 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.964 -0.384 . . . . 10.0 109.964 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 799' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 798' ' ' ASP . 35.9 Cg_exo -58.44 -30.12 90.52 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.049 2.499 . . . . 10.0 113.533 -179.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 800' ' ' LYS . . . . . 0.538 ' NZ ' ' HB2' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -78.64 -47.06 17.8 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.859 -0.336 . . . . 10.0 110.354 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -61.92 -40.89 97.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.545 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -64.09 -43.73 94.49 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 92.0 t80 -60.6 -43.34 97.52 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.219 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 804' ' ' LYS . . . . . 0.444 ' HZ3' ' CD ' ' A' ' 647' ' ' GLU . 94.2 mttt -58.3 -50.85 72.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.847 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -59.29 -45.9 90.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.864 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.2 -41.8 93.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.531 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 26.7 m -65.51 -34.76 79.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.904 -0.589 . . . . 10.0 111.146 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 21.6 m-30 -65.81 -43.2 89.35 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.975 0.417 . . . . 10.0 110.042 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 32.2 m -65.93 -36.34 83.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.428 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 29.2 ttm -65.49 -37.59 87.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.25 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -67.98 -43.04 79.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.21 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 812' ' ' ALA . . . . . 0.425 ' O ' ' HG2' ' A' ' 816' ' ' GLU . . . -59.47 -49.14 78.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.965 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.89 -32.33 73.57 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.941 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 29.5 ttp -65.82 -44.55 85.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.008 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.53 -36.48 83.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.511 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 816' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 812' ' ' ALA . 18.0 mm-40 -63.37 -42.03 98.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.299 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 12.8 m -74.09 -29.82 62.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.523 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 50.6 tp -60.46 -58.47 8.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.757 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 40.4 pttt -60.73 -32.63 71.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.541 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -64.57 -59.01 4.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.645 -0.707 . . . . 10.0 111.322 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -60.87 -39.74 90.36 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.339 0.496 . . . . 10.0 112.339 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 54.7 t -57.66 -50.24 78.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.841 0.353 . . . . 10.0 110.66 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.1 -38.72 72.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.904 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 38.6 m -61.93 -40.1 94.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.626 0.25 . . . . 10.0 110.615 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 74.7 m -63.94 -41.26 97.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.709 0.29 . . . . 10.0 110.769 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 87.7 mt -69.76 -19.63 63.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.235 0.54 . . . . 10.0 110.871 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 16.9 m -92.42 -36.82 12.91 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.753 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 828' ' ' LYS . . . . . 0.555 ' HE2' ' O ' ' A' ' 713' ' ' ASP . 44.1 mttm -69.66 -28.99 66.34 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.966 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 5.7 p -66.82 108.15 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.688 0.756 . . . . 10.0 109.908 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -98.73 99.88 11.03 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.75 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 21.7 t -79.72 133.95 28.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.991 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 7.0 ptt-85 -71.82 98.35 1.97 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.371 0.605 . . . . 10.0 110.356 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 15.2 ptp -91.63 140.12 25.13 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.64 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -64.87 158.68 49.85 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.334 2.023 . . . . 10.0 111.426 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 -51.96 113.7 1.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.778 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.601 -0.714 . . . . 10.0 110.224 -179.587 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 22.0 ttt . . . . . 0 N--CA 1.479 0.976 0 N-CA-C 110.108 -0.33 . . . . 10.0 110.108 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 26.0 ttp -62.34 140.9 58.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.478 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.0 mt -82.23 86.56 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.906 0.384 . . . . 10.0 110.281 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.41 135.02 55.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.893 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 35.0 tp -76.17 131.95 39.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.704 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 18.3 ptt-85 -79.35 62.91 3.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.319 0.58 . . . . 10.0 111.291 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 40.7 tttp -80.68 78.26 7.45 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.843 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' B' ' 8' ' ' ARG . 3.0 mmp_? -122.03 5.45 9.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.31 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -120.45 125.53 48.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.204 179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -147.11 106.67 3.93 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.032 0.444 . . . . 10.0 110.347 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.0 tp -130.21 86.01 55.29 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.497 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -75.16 -2.67 12.85 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.961 2.441 . . . . 10.0 112.17 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 77.4 mt -83.2 6.34 19.73 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.501 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.26 -41.26 96.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.028 0.442 . . . . 10.0 110.269 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.458 ' HB ' ' OE1' ' A' ' 777' ' ' GLU . 4.0 m -82.71 -26.74 8.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.622 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.05 -32.29 69.62 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.326 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 48.2 t -75.61 -27.2 18.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.067 0.46 . . . . 10.0 110.297 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.08 -41.4 25.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.332 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.46 -41.15 48.35 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.928 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -82.33 40.58 2.72 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.783 -0.644 . . . . 10.0 113.349 -178.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.43 ' HB ' HD23 ' A' ' 372' ' ' LEU . 3.1 t -76.04 -20.47 15.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.357 0.599 . . . . 10.0 109.823 179.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 9.2 ttt -106.76 23.49 14.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.855 -0.612 . . . . 10.0 111.105 -179.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -71.83 137.24 47.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.844 0.354 . . . . 10.0 110.685 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.44 85.63 1.51 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.194 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -158.99 138.48 11.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.687 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -137.14 155.26 49.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.841 0.353 . . . . 10.0 111.357 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.27 -10.55 1.26 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.388 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.533 -0.746 . . . . 10.0 110.547 179.856 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -99.39 139.45 35.02 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.96 0.409 . . . . 10.0 110.635 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 130.38 178.84 15.64 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.903 -0.665 . . . . 10.0 111.972 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.2 m -68.64 116.58 9.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.801 0.334 . . . . 10.0 110.181 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.515 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 17.3 mmt180 -67.54 155.16 39.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.042 -0.527 . . . . 10.0 111.345 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.3 m120 73.65 -49.56 0.69 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.264 -0.88 . . . . 10.0 112.318 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -90.53 -71.26 0.63 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.824 0.675 . . . . 10.0 112.824 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -65.2 -18.25 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 -177.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.51 -52.74 64.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.684 0.278 . . . . 10.0 111.159 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 mt -67.06 -33.4 75.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.946 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 12.4 ttp-105 -66.78 -45.05 79.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.384 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.54 -28.41 64.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.129 0.49 . . . . 10.0 109.996 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.55 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 45.3 mtt -76.22 -36.23 58.66 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.842 179.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -60.97 -35.64 77.31 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -60.37 -38.0 82.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.432 -0.803 . . . . 10.0 109.532 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -77.1 -35.36 22.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.848 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.9 t -58.13 -36.16 55.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.95 178.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.5 -37.44 87.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.729 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.3 mt -68.3 -44.0 84.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.716 -0.674 . . . . 10.0 109.704 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 77.6 mt -59.78 -40.57 82.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.774 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -63.64 -38.42 91.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.377 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.56 -28.32 65.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.006 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 53.4 mtt -84.11 -17.53 39.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.138 -0.483 . . . . 10.0 111.61 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.491 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 17.9 tt0 -57.46 -54.62 53.11 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-O 119.271 -0.395 . . . . 10.0 111.646 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 38.2 Cg_exo -61.05 -28.25 85.74 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.755 1.637 . . . . 10.0 111.516 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -69.51 -43.99 71.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.613 -0.722 . . . . 10.0 109.924 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 25.9 mmt -69.37 -29.03 66.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.355 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -62.68 -27.24 69.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.768 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -79.97 -16.45 55.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.709 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp -84.01 147.8 27.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.301 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 p -76.6 165.56 24.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.103 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.54 -43.17 84.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.865 0.364 . . . . 10.0 111.449 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -68.59 -28.08 66.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.922 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -69.79 -33.09 71.9 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.669 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.5 mt -61.94 -40.38 95.32 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -67.23 -32.4 73.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.14 -0.936 . . . . 10.0 109.552 178.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.97 -35.99 92.84 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.474 -0.785 . . . . 10.0 111.687 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -65.6 -37.3 86.23 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 28.1 m -61.38 -47.35 86.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.282 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.82 -30.02 70.1 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.236 0.541 . . . . 10.0 110.144 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -66.26 -45.66 79.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.441 -0.799 . . . . 10.0 110.564 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -59.64 -37.95 80.07 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.048 0.452 . . . . 10.0 110.252 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -57.95 -41.74 83.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.729 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.16 -41.47 61.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.994 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -60.48 -36.37 78.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.35 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.39 -38.13 89.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.771 0.319 . . . . 10.0 111.035 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -70.37 -28.12 64.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.421 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -69.16 -33.57 73.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.368 179.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 132.19 16.77 1.34 Allowed Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.532 -0.842 . . . . 10.0 113.069 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -77.3 149.55 35.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.926 0.393 . . . . 10.0 110.145 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.1 t -86.86 131.82 33.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.19 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.54 HD12 ' O ' ' A' ' 118' ' ' LEU . 18.8 tp -58.8 -39.87 82.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.135 0.493 . . . . 10.0 110.864 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.402 ' HG3' ' ND2' ' A' ' 95' ' ' ASN . 14.6 mp0 -68.0 -10.49 54.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.39 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -97.91 -13.52 21.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.301 0.572 . . . . 10.0 110.112 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.5 mt -91.6 -7.06 51.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.887 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.487 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 75.2 mt -49.99 -51.52 60.84 Favored Pre-proline 0 CA--C 1.541 0.622 0 N-CA-C 113.192 0.812 . . . . 10.0 113.192 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.487 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 62.2 Cg_exo -52.08 -51.17 11.73 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 122.085 1.856 . . . . 10.0 113.209 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -71.25 -42.75 68.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.65 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.05 -49.72 76.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.806 -179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -63.84 -35.2 79.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.321 -0.399 . . . . 10.0 111.025 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.28 -45.58 90.79 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 120.872 0.367 . . . . 10.0 110.494 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 70.1 t -61.74 -47.14 94.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.469 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 63.4 t -61.73 -41.97 92.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.955 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.451 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 7.0 ttm180 -59.43 -49.36 78.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.927 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.432 ' OE1' ' HA ' ' A' ' 73' ' ' GLU . 35.1 tp10 -65.83 -40.21 91.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.917 0.389 . . . . 10.0 110.39 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.71 -32.46 71.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.136 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 17.2 m -68.27 -33.5 74.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.416 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.1 mtmm -72.35 -24.07 61.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.25 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 67.7 mtt180 -97.16 -50.35 4.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 96.8 t -67.5 -61.52 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.713 0.292 . . . . 10.0 111.24 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -82.75 -59.62 2.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.849 0.357 . . . . 10.0 110.937 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 131.08 -27.95 3.74 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.535 -0.626 . . . . 10.0 111.535 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -90.69 138.4 31.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.897 0.379 . . . . 10.0 110.594 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -80.86 139.69 35.8 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.596 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.27 109.0 2.93 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -53.35 147.03 11.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.799 -0.637 . . . . 10.0 111.967 -178.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.07 -35.54 77.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.318 -0.855 . . . . 10.0 111.165 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.2 m -65.62 -28.94 45.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.83 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -75.02 -30.56 61.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.22 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.5 mt -63.31 -36.26 83.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.235 -0.439 . . . . 10.0 109.866 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.9 mt -64.98 -47.94 75.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.83 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -64.75 -39.36 96.59 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.908 -0.663 . . . . 10.0 111.961 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.9 -35.2 91.7 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.021 -0.609 . . . . 10.0 112.301 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.55 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 18.5 ttm -71.03 -34.47 71.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.04 0.447 . . . . 10.0 110.008 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 68.7 t -67.56 -37.04 78.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.505 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.35 6.28 2.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.533 -0.758 . . . . 10.0 112.915 -178.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.402 ' ND2' ' HG3' ' A' ' 61' ' ' GLU . 50.0 t30 -88.82 -20.75 24.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.301 0.572 . . . . 10.0 109.882 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -117.31 -176.95 3.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.405 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 387' ' ' LEU . 6.7 ttt85 -76.36 74.95 3.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.121 0.486 . . . . 10.0 111.037 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -142.81 154.66 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.235 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 36.3 mm -108.61 124.2 64.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.013 -0.736 . . . . 10.0 109.013 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -100.75 111.54 23.79 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.744 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.43 125.39 29.88 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.914 -0.772 . . . . 10.0 108.914 178.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 47.9 ttm -130.56 147.6 52.26 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.006 0.431 . . . . 10.0 110.793 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.512 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 13.0 mmm180 -76.59 153.93 34.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.964 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.32 99.25 1.91 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.022 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 139.42 -23.78 2.82 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.471 -0.871 . . . . 10.0 112.839 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -68.78 -20.48 64.35 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.932 0.396 . . . . 10.0 111.073 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.16 70.48 1.32 Allowed Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 121.039 -0.6 . . . . 10.0 113.065 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.3 ptmm? -68.34 -32.79 73.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.329 . . . . 10.0 110.974 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -36.02 80.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 10.0 111.192 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 24.2 tp -78.07 -18.32 55.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.212 0.529 . . . . 10.0 110.474 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 60.2 m -82.11 -29.43 31.71 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.365 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.44 -23.89 67.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.563 -0.744 . . . . 10.0 112.205 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.18 -23.92 66.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.234 0.457 . . . . 10.0 112.234 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 58.3 mt -70.65 -59.26 3.89 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.156 0.428 . . . . 10.0 112.156 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.36 -28.25 63.15 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.929 1.752 . . . . 10.0 111.883 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.72 -50.19 65.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.459 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.437 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 63.0 t80 -60.87 -45.89 92.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.026 0.441 . . . . 10.0 110.504 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.54 ' O ' HD12 ' A' ' 60' ' ' LEU . 23.9 tp -59.47 -54.61 44.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.865 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -70.5 -20.54 62.83 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.413 0.523 . . . . 10.0 112.413 -178.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.416 ' HB3' ' HB3' ' A' ' 173' ' ' ASP . . . -71.9 -29.79 64.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.729 0.3 . . . . 10.0 110.763 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 65.4 mt -56.8 -25.53 55.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.791 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 73.1 p -69.22 -25.15 64.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.887 0.375 . . . . 10.0 111.35 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 82.15 -1.13 87.81 Favored Glycine 0 CA--C 1.519 0.318 0 C-N-CA 121.019 -0.61 . . . . 10.0 112.624 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -74.13 -33.95 63.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.92 0.39 . . . . 10.0 110.813 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 115.8 131.57 4.91 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.493 -0.86 . . . . 10.0 113.341 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 73.9 t -106.22 112.96 41.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -94.13 105.41 17.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.887 0.375 . . . . 10.0 110.481 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 55.4 t -91.73 116.91 33.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.165 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 82.8 t -98.11 112.54 30.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.323 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.27 158.47 15.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.528 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 16.0 m -66.74 -24.11 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -154.81 170.69 21.04 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.965 -0.383 . . . . 10.0 109.965 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -78.54 -24.24 45.77 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.177 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -62.49 -55.04 31.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.956 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.9 mt -71.11 -29.25 65.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.558 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.67 -53.53 56.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.782 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.21 -30.09 64.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.459 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -63.55 -54.74 31.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.296 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . 0.426 ' HA ' ' HB3' ' A' ' 142' ' ' ASN . 0.5 OUTLIER -75.87 -20.02 58.41 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.711 -0.396 . . . . 10.0 112.034 -178.402 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.65 -35.74 81.54 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -84.47 -27.94 27.13 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.189 -0.914 . . . . 10.0 110.05 178.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . 0.426 ' HB3' ' HA ' ' A' ' 139' ' ' ASP . 38.8 t30 -67.82 -47.57 68.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.093 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -86.48 -4.92 59.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.541 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.494 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 56.1 ttm-85 -58.82 -49.86 91.14 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 27.6 Cg_exo -63.6 -7.3 12.35 Favored 'Trans proline' 0 C--N 1.36 1.171 0 C-N-CA 122.32 2.013 . . . . 10.0 113.031 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 19.8 tp -100.35 -50.14 4.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.948 0.404 . . . . 10.0 110.346 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -65.83 -50.6 64.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.667 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -67.12 -21.15 65.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.885 0.374 . . . . 10.0 111.119 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -69.4 -34.63 74.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.312 0.577 . . . . 10.0 109.613 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . 0.411 HD11 ' CE1' ' A' ' 117' ' ' TYR . 39.5 mt -89.26 -22.65 22.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.262 -0.881 . . . . 10.0 110.72 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.7 4.44 11.74 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.21 -0.995 . . . . 10.0 113.831 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 36.6 mt -88.86 134.15 34.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.949 0.375 . . . . 10.0 110.135 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 7.0 p -83.4 128.1 34.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.388 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 4.8 t -104.52 111.87 35.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.858 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -107.91 145.03 16.18 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 111.647 -0.581 . . . . 10.0 111.647 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.4 tp -122.08 127.36 75.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 120.798 0.332 . . . . 10.0 110.153 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -112.21 115.08 28.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.122 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 92.2 mt -107.97 148.29 37.14 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.31 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' PRO . . . . . 0.496 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 19.2 Cg_endo -58.91 112.46 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 122.71 2.273 . . . . 10.0 112.691 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.75 -1.53 48.74 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.689 -0.767 . . . . 10.0 112.927 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' MET . . . . . 0.5 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 49.9 ttm -59.2 138.31 88.31 Favored Pre-proline 0 C--N 1.326 -0.424 0 C-N-CA 122.195 0.198 . . . . 10.0 110.745 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -53.68 144.42 53.49 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.812 2.341 . . . . 10.0 112.654 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . 0.459 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.18 -49.08 86.7 Favored Pre-proline 0 CA--C 1.54 0.584 0 N-CA-C 113.202 0.816 . . . . 10.0 113.202 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.459 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 31.9 Cg_exo -60.38 -32.78 94.38 Favored 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 121.771 1.647 . . . . 10.0 112.26 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.13 -37.85 63.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.577 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.5 ' HE2' ' O ' ' A' ' 161' ' ' MET . 60.6 mttm -60.49 -40.5 91.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.708 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -64.23 -27.97 69.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.116 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -78.12 -18.92 55.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.971 0.415 . . . . 10.0 110.779 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -96.27 -39.64 9.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.932 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -73.08 -27.02 61.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.327 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . 0.46 ' HA ' ' NE ' ' A' ' 201' ' ' ARG . . . -82.99 -3.23 56.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.959 0.409 . . . . 10.0 110.784 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -80.25 169.64 17.5 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.408 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . 0.416 ' HB3' ' HB3' ' A' ' 120' ' ' ALA . 11.9 m-20 -64.9 -47.25 78.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.199 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.8 mp -124.04 130.33 73.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.142 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.7 m -118.49 112.19 19.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.853 0.359 . . . . 10.0 111.16 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -88.73 137.54 32.23 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.492 -0.558 . . . . 10.0 109.492 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -174.63 174.88 46.8 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.219 -0.991 . . . . 10.0 112.898 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.59 149.06 21.86 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.608 0.242 . . . . 10.0 110.777 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -58.4 -38.02 76.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.729 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -59.19 -52.26 66.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.364 -179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . 0.496 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.5 tp10 -68.18 -38.02 81.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.836 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -57.99 -37.59 74.54 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.99 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -73.54 -43.35 37.23 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.929 -0.653 . . . . 10.0 111.848 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -65.51 -38.84 90.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.695 0.283 . . . . 10.0 110.628 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . 0.432 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 20.2 m-20 -60.54 -44.13 96.44 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.008 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -61.94 -39.97 93.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.568 -0.742 . . . . 10.0 110.449 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 75.8 mt -66.98 -44.1 81.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.509 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 56.9 mtm-85 -63.81 -41.69 97.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.781 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.44 -31.22 72.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.267 0.556 . . . . 10.0 110.88 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -80.1 -14.87 58.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.163 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 35.6 mtp -103.66 17.08 24.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.963 0.411 . . . . 10.0 111.099 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -80.35 162.24 24.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.333 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -104.13 -25.12 13.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.342 0.592 . . . . 10.0 109.927 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -128.6 139.3 35.18 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.56 -0.746 . . . . 10.0 109.357 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.58 -22.7 73.35 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.528 2.152 . . . . 10.0 111.983 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 48.0 mp0 -71.83 -15.88 62.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.14 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -84.61 -17.78 37.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.272 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 24.6 mtt85 -55.36 137.85 47.0 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 123.481 0.488 . . . . 10.0 111.53 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 22.6 m -110.15 -20.38 6.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.998 -0.547 . . . . 10.0 111.287 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -90.74 -175.09 4.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.339 0.59 . . . . 10.0 111.552 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' ARG . . . . . 0.46 ' NE ' ' HA ' ' A' ' 171' ' ' ALA . 11.2 mtm180 -140.29 -174.41 3.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.611 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 26.5 mttm -55.61 137.83 48.24 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.239 0.542 . . . . 10.0 111.804 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 18.5 mt -86.37 66.65 9.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.619 -0.719 . . . . 10.0 109.692 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -74.68 -72.7 0.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.661 -0.7 . . . . 10.0 112.235 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 386' ' ' LYS . 29.1 t80 -122.33 135.91 54.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.008 0.432 . . . . 10.0 111.778 -177.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.51 ' HB3' ' CD1' ' A' ' 384' ' ' TYR . . . -128.07 123.74 35.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.369 -0.832 . . . . 10.0 109.499 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 64.4 tp -119.83 110.52 16.86 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.334 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -100.54 130.62 49.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.355 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -58.47 -65.38 0.66 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.798 -0.637 . . . . 10.0 111.984 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' GLU . . . . . 0.458 ' OE2' ' HA ' ' A' ' 391' ' ' THR . 17.6 tp10 -112.75 110.39 20.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.006 0.432 . . . . 10.0 110.482 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 28.4 m -82.91 -18.83 10.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.237 -0.438 . . . . 10.0 112.083 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . 0.465 ' OD1' ' HD2' ' A' ' 566' ' ' ARG . 7.2 t70 -51.87 -72.22 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.23 19.24 2.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.749 0.648 . . . . 10.0 112.749 -177.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 36.3 mt -125.04 -50.52 2.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.624 -0.431 . . . . 10.0 112.002 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 18.8 mt -82.7 -30.31 29.25 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 35.0 mm -98.43 -50.99 10.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.785 -0.366 . . . . 10.0 111.466 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.56 -46.54 72.42 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.02 0.378 . . . . 10.0 112.02 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -95.89 31.97 1.99 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.687 0.28 . . . . 10.0 111.602 -178.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -72.91 -51.94 16.61 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.826 0.346 . . . . 10.0 111.789 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 220' ' ' ARG . . . . . 0.474 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -93.8 22.06 5.95 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -178.085 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 4.1 m -88.74 108.99 26.46 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.94 -0.392 . . . . 10.0 109.94 178.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 222' ' ' PRO . . . . . 0.474 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 87.0 Cg_endo -93.47 134.16 0.98 Allowed 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.054 2.503 . . . . 10.0 113.789 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 223' ' ' LEU . . . . . 0.571 ' O ' ' HA ' ' A' ' 374' ' ' SER . 86.5 mt -94.04 110.46 22.15 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.875 -0.787 . . . . 10.0 108.875 178.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.72 125.59 61.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 120.809 0.338 . . . . 10.0 111.32 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 54.0 mt -82.17 110.6 17.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.88 101.79 0.88 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.286 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -120.67 93.41 0.53 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.017 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -73.97 81.13 1.99 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.764 2.31 . . . . 10.0 112.218 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -145.02 109.34 4.87 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.397 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . 0.418 ' HG2' ' H ' ' A' ' 231' ' ' ASP . 15.5 tt0 -167.72 165.43 14.22 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 231' ' ' ASP . . . . . 0.418 ' H ' ' HG2' ' A' ' 230' ' ' GLU . 2.7 t0 -123.44 56.81 1.18 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.538 0.685 . . . . 10.0 109.909 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -18.65 57.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.297 -0.865 . . . . 10.0 110.758 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -31.24 64.18 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.255 -0.884 . . . . 10.0 111.881 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -107.83 -41.14 5.07 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 121.119 -0.232 . . . . 10.0 111.017 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 22.9 tpp -54.73 -56.49 18.68 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -179.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -73.36 -31.1 63.74 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.956 0.354 . . . . 10.0 111.956 -178.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -70.1 -39.57 75.43 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.567 -0.288 . . . . 10.0 111.19 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 11.6 tpp180 -69.95 -45.51 67.3 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.856 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 11.1 p -66.84 -33.49 63.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.752 0.31 . . . . 10.0 111.742 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 240' ' ' ASN . . . . . 0.412 ' ND2' ' HA ' ' A' ' 360' ' ' LYS . 66.7 t30 -90.06 15.96 9.22 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.151 0.5 . . . . 10.0 110.893 -179.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.68 -7.87 23.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.018 0.437 . . . . 10.0 110.537 179.306 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 10.5 tp -101.76 -27.33 3.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.938 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 243' ' ' ILE . . . . . 0.439 ' C ' ' H ' ' A' ' 245' ' ' HIS . 42.6 mt -62.56 -47.65 88.0 Favored Pre-proline 0 CA--C 1.539 0.524 0 N-CA-C 112.254 0.464 . . . . 10.0 112.254 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 244' ' ' PRO . . . . . 0.43 ' HD3' ' HB ' ' A' ' 243' ' ' ILE . 9.4 Cg_exo -73.6 32.54 0.32 Allowed 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 122.284 1.99 . . . . 10.0 112.655 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 245' ' ' HIS . . . . . 0.439 ' H ' ' C ' ' A' ' 243' ' ' ILE . 7.4 t-80 -141.27 8.24 2.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.035 0.445 . . . . 10.0 109.922 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 40.7 mt -94.13 -166.0 1.42 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.763 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 247' ' ' ILE . . . . . 0.435 ' O ' ' HB3' ' A' ' 253' ' ' ASP . 73.4 mt -107.1 114.51 46.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 109.017 -0.735 . . . . 10.0 109.017 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 248' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 248' ' ' ARG . 0.2 OUTLIER -66.03 73.2 0.07 Allowed 'General case' 0 N--CA 1.466 0.337 0 O-C-N 123.732 0.645 . . . . 10.0 112.223 -178.447 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -179.21 -44.55 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.346 -0.843 . . . . 10.0 109.576 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -126.43 -167.88 1.78 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.982 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt 42.31 46.77 4.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.875 0.87 . . . . 10.0 112.375 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 252' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 64.88 -1.73 0.79 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.867 1.432 . . . . 10.0 114.867 177.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 253' ' ' ASP . . . . . 0.435 ' HB3' ' O ' ' A' ' 247' ' ' ILE . 46.4 t0 -80.12 70.35 6.71 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.659 0.663 . . . . 10.0 110.466 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 4.8 p 179.48 -105.69 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.117 -0.947 . . . . 10.0 109.641 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -149.0 12.47 0.86 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 4.6 m 53.11 69.77 0.66 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 114.664 -1.153 . . . . 10.0 111.878 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 257' ' ' PHE . . . . . 0.537 ' CD1' ' HA3' ' A' ' 261' ' ' GLY . 56.7 m-85 -87.15 0.63 55.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.058 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 67.3 -75.51 0.06 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.339 -0.846 . . . . 10.0 111.075 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -165.1 41.03 0.29 Allowed Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.87 -0.681 . . . . 10.0 111.983 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 260' ' ' GLU . . . . . 0.437 ' HB3' ' H ' ' A' ' 261' ' ' GLY . 3.4 tp10 -157.37 -82.39 0.06 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.892 0.377 . . . . 10.0 110.939 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 261' ' ' GLY . . . . . 0.537 ' HA3' ' CD1' ' A' ' 257' ' ' PHE . . . 103.03 -112.25 4.2 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.849 -0.691 . . . . 10.0 111.793 -179.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -145.71 -83.33 0.13 Allowed 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.29 -0.263 . . . . 10.0 110.29 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -169.61 172.45 6.91 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.238 -0.653 . . . . 10.0 109.238 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 15.7 m -65.52 99.32 0.42 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.078 0.466 . . . . 10.0 111.23 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 7.1 p -159.76 -42.97 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.103 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -161.19 176.62 11.07 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.53 3.5 27.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.002 0.43 . . . . 10.0 110.378 -179.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 268' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 318' ' ' ALA . 2.2 ptpp? -143.9 171.91 13.58 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.628 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 3.1 m -116.48 -142.76 0.37 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.245 179.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -156.2 -22.86 0.1 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.698 -0.401 . . . . 10.0 111.934 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 13.7 pm0 -78.18 -16.03 58.27 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.491 0.182 . . . . 10.0 111.491 -179.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 23.7 t 70.34 -73.14 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 122.886 0.474 . . . . 10.0 110.486 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.02 44.09 26.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.978 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 274' ' ' LEU . . . . . 0.443 ' HB3' ' H ' ' A' ' 275' ' ' THR . 2.8 mm? 61.04 -158.79 0.33 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.672 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 275' ' ' THR . . . . . 0.443 ' H ' ' HB3' ' A' ' 274' ' ' LEU . 5.5 t -154.5 -179.68 8.2 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.23 -0.285 . . . . 10.0 110.23 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 70.34 135.54 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 O-C-N 124.23 0.956 . . . . 10.0 111.655 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 176.47 22.69 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.655 -1.157 . . . . 10.0 109.074 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.416 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . -122.01 -35.52 0.77 Allowed Glycine 0 N--CA 1.442 -0.9 0 C-N-CA 120.453 -0.88 . . . . 10.0 112.621 -178.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 278' ' ' GLY . 3.5 mm? 70.87 -50.14 0.68 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.275 0.63 . . . . 10.0 111.561 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 10.5 p -75.43 -21.96 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.197 0.522 . . . . 10.0 110.649 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 4.6 mp -72.86 -37.5 67.36 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.038 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 43.3 pt -79.21 -10.02 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 N-CA-C 111.721 0.267 . . . . 10.0 111.721 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -63.79 -39.23 93.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.07 0.462 . . . . 10.0 109.88 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.12 22.58 1.41 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.635 -0.712 . . . . 10.0 111.148 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 15.1 mt -113.23 -20.13 11.53 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.334 0.588 . . . . 10.0 109.516 178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 5.5 mt -111.85 -179.75 3.78 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.527 -0.76 . . . . 10.0 110.171 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 287' ' ' VAL . . . . . 0.41 ' HA ' ' HA ' ' A' ' 293' ' ' ASP . 12.0 t 55.35 67.16 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 O-C-N 123.606 0.566 . . . . 10.0 111.673 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.71 150.1 0.64 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.528 178.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 67.78 -76.99 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 O-C-N 124.052 0.845 . . . . 10.0 111.445 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 290' ' ' GLY . . . . . 0.428 ' O ' ' HB ' ' A' ' 291' ' ' ILE . . . 171.14 154.19 9.52 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.366 -0.921 . . . . 10.0 112.429 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 291' ' ' ILE . . . . . 0.428 ' HB ' ' O ' ' A' ' 290' ' ' GLY . 88.4 mt 77.57 110.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.258 0.623 . . . . 10.0 110.317 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 292' ' ' MET . . . . . 0.453 ' O ' ' HG2' ' A' ' 292' ' ' MET . 25.0 ttp 70.64 5.26 5.34 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.705 0.764 . . . . 10.0 110.206 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 293' ' ' ASP . . . . . 0.41 ' HA ' ' HA ' ' A' ' 287' ' ' VAL . 10.3 p-10 -77.03 -13.63 59.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.777 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -64.26 -34.13 77.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.431 179.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 133.67 106.89 0.97 Allowed Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.779 -0.646 . . . . 10.0 111.908 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -153.57 -172.6 4.28 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 297' ' ' SER . . . . . 0.517 ' HB2' ' OG ' ' A' ' 300' ' ' SER . 4.6 m -115.15 141.26 48.26 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.962 0.411 . . . . 10.0 110.408 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.9 tp -83.28 11.11 7.1 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.995 0.426 . . . . 10.0 111.131 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -131.49 9.73 4.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.086 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 300' ' ' SER . . . . . 0.517 ' OG ' ' HB2' ' A' ' 297' ' ' SER . 11.7 m -64.49 145.47 98.47 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.86 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -51.48 -42.81 53.65 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 123.244 2.629 . . . . 10.0 113.269 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -78.92 -8.25 58.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.836 0.351 . . . . 10.0 111.445 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -106.65 15.08 26.15 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.134 0.492 . . . . 10.0 110.492 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 8.7 tp -63.75 -29.15 46.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.657 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 15.5 tmm? -61.63 -50.86 70.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.775 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 29.7 tp -69.42 -39.23 78.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.136 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 19.3 ttt -57.71 -41.61 82.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.864 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -80.53 -15.37 56.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.747 0.308 . . . . 10.0 111.009 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 28.3 m170 -87.15 -42.43 13.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.662 -0.245 . . . . 10.0 110.583 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 27.0 m -68.02 -33.58 61.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.817 0.341 . . . . 10.0 110.834 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 1.3 p -68.61 -23.45 64.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.912 0.387 . . . . 10.0 111.058 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 312' ' ' ALA . . . . . 0.461 ' HA ' ' NE ' ' A' ' 315' ' ' ARG . . . -69.67 -51.86 30.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.089 0.471 . . . . 10.0 109.936 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -71.14 -24.02 62.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.632 -0.713 . . . . 10.0 111.131 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 12.4 tp -78.13 -46.15 21.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.673 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 315' ' ' ARG . . . . . 0.461 ' NE ' ' HA ' ' A' ' 312' ' ' ALA . 3.7 ptp180 -67.3 -27.85 67.52 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.005 0.431 . . . . 10.0 110.171 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 316' ' ' ALA . . . . . 0.45 ' O ' ' HE2' ' A' ' 360' ' ' LYS . . . -82.39 3.31 28.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.061 0.457 . . . . 10.0 110.319 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -99.53 -10.24 22.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.053 -0.522 . . . . 10.0 111.078 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.431 ' O ' ' HD3' ' A' ' 268' ' ' LYS . . . -144.73 -51.8 0.29 Allowed 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.066 0.395 . . . . 10.0 112.066 -179.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -67.5 -34.66 77.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.552 -0.295 . . . . 10.0 111.622 -178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -107.14 112.46 25.37 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.027 0.442 . . . . 10.0 110.117 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.62 123.14 47.66 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.701 -179.115 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 322' ' ' ARG . . . . . 0.548 ' HB3' ' CZ ' ' A' ' 326' ' ' TYR . 7.9 ptm180 -70.71 160.77 32.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.574 -0.284 . . . . 10.0 110.672 179.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 323' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 78.54 -12.27 1.1 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.007 0.923 . . . . 10.0 111.585 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 15.0 p -134.26 -42.36 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 111.758 0.281 . . . . 10.0 111.758 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -90.88 -24.0 20.35 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.456 0.646 . . . . 10.0 109.713 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 326' ' ' TYR . . . . . 0.548 ' CZ ' ' HB3' ' A' ' 322' ' ' ARG . 31.9 p90 -163.11 150.67 13.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.149 -0.932 . . . . 10.0 109.09 179.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 8.9 tp -127.58 133.68 67.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.89 0.376 . . . . 10.0 110.067 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 42.2 t -104.61 126.38 59.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.817 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 329' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' A' ' 329' ' ' LYS . 3.8 pttp -146.2 132.46 19.49 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.75 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 61.11 21.28 11.69 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.907 0.384 . . . . 10.0 111.436 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 87.0 2.04 84.21 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.924 -0.655 . . . . 10.0 112.311 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -101.76 136.72 41.12 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 39.4 t -99.35 107.24 20.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.557 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 64.8 mt -92.58 126.4 45.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.072 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 20.5 mt -79.95 120.37 31.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.683 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 46.7 t -103.58 125.25 58.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.905 0.383 . . . . 10.0 110.162 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -73.0 119.03 16.67 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.03 15.38 2.34 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.832 0.679 . . . . 10.0 112.832 -177.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 -104.78 -60.95 1.53 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.043 0.449 . . . . 10.0 110.309 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 24.9 p -104.29 -13.0 16.31 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.25 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 83.18 47.49 5.75 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.791 -0.719 . . . . 10.0 111.626 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 2.8 tpp180 -98.18 138.19 35.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.631 0.253 . . . . 10.0 110.911 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.42 110.2 22.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.905 0.383 . . . . 10.0 110.886 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 66.1 mtt -113.39 102.49 10.38 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.865 0.364 . . . . 10.0 110.645 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -93.09 -24.3 18.34 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.437 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -92.29 53.87 2.81 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.18 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -144.53 160.96 40.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.797 0.332 . . . . 10.0 110.22 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -133.21 108.45 8.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.369 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -61.87 139.54 58.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.403 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.1 m -71.45 166.77 21.02 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.311 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 351' ' ' ASP . . . . . 0.422 ' CG ' ' H ' ' A' ' 352' ' ' GLY . 5.4 t70 60.18 -157.32 0.33 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.657 -0.702 . . . . 10.0 110.859 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 352' ' ' GLY . . . . . 0.422 ' H ' ' CG ' ' A' ' 351' ' ' ASP . . . -99.51 26.32 24.82 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.533 -0.842 . . . . 10.0 113.177 -178.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 1.6 mp -59.33 -58.05 10.33 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.963 0.411 . . . . 10.0 110.968 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 354' ' ' HIS . . . . . 0.457 ' HE1' ' OE1' ' A' ' 368' ' ' GLU . 21.7 p80 -68.96 -32.45 72.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.381 -179.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 355' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.09 -38.76 87.4 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.087 0.47 . . . . 10.0 110.633 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -74.58 -28.92 61.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.418 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 23.0 t -66.45 -43.61 90.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.033 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.442 ' CB ' ' HA ' ' A' ' 365' ' ' ILE . 15.7 mt-10 -64.53 -26.27 68.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.569 179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -94.11 -1.74 53.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.748 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 360' ' ' LYS . . . . . 0.45 ' HE2' ' O ' ' A' ' 316' ' ' ALA . 27.3 ttpp -99.18 -44.61 6.2 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.676 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 361' ' ' GLU . . . . . 0.444 ' OE1' ' HD2' ' A' ' 322' ' ' ARG . 23.5 mm-40 -84.46 173.24 11.02 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.147 -0.479 . . . . 10.0 109.811 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -78.59 57.55 4.17 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 121.151 -0.547 . . . . 10.0 112.128 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 16.4 m -134.75 -166.01 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -122.94 136.15 54.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.836 0.35 . . . . 10.0 110.845 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 365' ' ' ILE . . . . . 0.442 ' HA ' ' CB ' ' A' ' 358' ' ' GLU . 4.0 mp -60.94 143.87 14.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.223 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -69.52 -101.82 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.694 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -178.0 -65.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.137 -0.32 . . . . 10.0 110.137 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 368' ' ' GLU . . . . . 0.457 ' OE1' ' HE1' ' A' ' 354' ' ' HIS . 1.9 mp0 55.65 -105.24 0.26 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.456 -0.793 . . . . 10.0 110.692 -179.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 65.9 -67.04 0.15 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.532 0.733 . . . . 10.0 111.332 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 37.48 45.89 0.61 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.643 1.177 . . . . 10.0 113.59 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 14.5 t -140.25 152.12 45.69 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.898 0.38 . . . . 10.0 110.789 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 10.8 mt -158.63 -70.89 0.09 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.68 -0.691 . . . . 10.0 109.484 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -136.76 153.3 50.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.683 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 374' ' ' SER . . . . . 0.571 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 7.5 t -155.55 147.82 23.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.809 0.338 . . . . 10.0 111.031 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.3 tt -157.06 147.08 11.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.021 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 4.0 p -97.31 148.77 22.8 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -57.68 -41.75 82.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.712 0.291 . . . . 10.0 110.889 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -33.06 72.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.375 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 -90.01 -8.44 51.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.775 0.321 . . . . 10.0 111.119 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -87.61 -43.52 11.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.113 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -72.96 -11.25 60.5 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.267 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 44.5 mtp180 -77.86 -9.72 59.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.023 0.439 . . . . 10.0 110.304 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 30.3 mt -94.77 -8.25 38.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.502 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.51 ' CD1' ' HB3' ' A' ' 206' ' ' ALA . 18.5 m-85 -84.96 132.89 34.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.684 0.278 . . . . 10.0 111.208 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -64.15 -56.09 17.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.197 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 386' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 205' ' ' TYR . 69.1 mttt -110.56 113.14 25.53 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . 0.572 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 41.5 tp -122.25 124.68 44.34 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.257 -0.428 . . . . 10.0 110.082 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -140.64 160.04 40.88 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.595 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -166.53 164.21 37.51 Favored Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.381 -0.914 . . . . 10.0 112.368 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 62.4 mtm -119.03 171.65 8.11 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.877 -0.416 . . . . 10.0 109.877 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 391' ' ' THR . . . . . 0.458 ' HA ' ' OE2' ' A' ' 210' ' ' GLU . 1.9 t -162.55 158.31 23.32 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.881 0.372 . . . . 10.0 110.782 179.093 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -81.76 -171.32 45.62 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.916 -0.659 . . . . 10.0 111.843 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 393' ' ' THR . . . . . 0.512 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 1.9 m -73.56 79.59 1.47 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.228 0.537 . . . . 10.0 111.136 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -119.89 -60.86 1.67 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.56 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 395' ' ' ASP . . . . . 0.466 ' CG ' ' H ' ' A' ' 396' ' ' THR . 9.9 t70 58.8 -145.84 0.54 Allowed 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.262 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 396' ' ' THR . . . . . 0.466 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 5.3 m 69.56 -79.53 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.101 0.56 . . . . 10.0 112.169 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -86.26 26.49 1.04 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.129 0.49 . . . . 10.0 110.444 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -69.86 -29.72 67.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 10.0 111.238 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -64.13 -23.87 67.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.063 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 400' ' ' GLU . . . . . 0.464 ' HA ' ' OE1' ' A' ' 400' ' ' GLU . 5.0 mm-40 -68.93 -24.06 64.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.875 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 401' ' ' PHE . . . . . 0.428 ' HB3' ' HB2' ' A' ' 407' ' ' LEU . 39.2 m-85 -64.09 -31.81 73.14 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 178.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.23 -27.41 26.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.262 -0.881 . . . . 10.0 110.539 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 2.6 m -73.01 -39.54 65.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.806 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 17.4 mt -98.96 -53.66 7.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 113.451 0.908 . . . . 10.0 113.451 -177.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -99.64 -2.0 36.62 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.802 0.667 . . . . 10.0 112.802 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt 63.16 29.8 16.05 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.45 0.469 . . . . 10.0 111.659 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 407' ' ' LEU . . . . . 0.428 ' HB2' ' HB3' ' A' ' 401' ' ' PHE . 5.3 mt -84.94 138.58 32.41 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.617 -0.265 . . . . 10.0 111.065 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . 0.515 ' OD2' ' HD2' ' A' ' 13' ' ' ARG . 22.0 t70 -81.41 160.09 24.14 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 6.8 m -114.4 115.5 27.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.986 0.422 . . . . 10.0 111.733 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.61 138.28 54.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.016 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 44.7 t -104.32 125.55 59.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.73 0.3 . . . . 10.0 110.752 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 94.4 t -84.0 127.66 66.03 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.497 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.32 136.6 47.88 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.665 2.244 . . . . 10.0 112.41 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.8 149.87 45.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.651 -0.704 . . . . 10.0 111.016 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -58.4 -50.23 74.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.146 0.498 . . . . 10.0 110.066 179.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -114.34 158.71 39.12 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.94 114.12 2.16 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.239 1.959 . . . . 10.0 111.333 178.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 54.0 ttp -68.55 113.44 6.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.092 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 34.3 mt -98.67 73.12 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.335 0.588 . . . . 10.0 109.827 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -102.04 116.48 32.77 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.024 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -84.96 99.23 10.85 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.71 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.23 110.52 16.78 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.734 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 51.4 mt -100.55 132.28 22.58 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.101 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.86 144.7 54.28 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.936 2.424 . . . . 10.0 113.544 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.83 138.83 48.57 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.506 -0.77 . . . . 10.0 109.825 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 15.4 mt -113.56 118.54 34.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.991 0.424 . . . . 10.0 110.549 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 91.3 t -99.7 122.23 51.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.598 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 428' ' ' TYR . . . . . 0.478 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 5.0 m-85 -109.76 176.36 5.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.252 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -80.25 -79.28 0.15 Allowed 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.972 -0.291 . . . . 10.0 110.99 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 70.1 p -82.24 160.23 23.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.737 0.303 . . . . 10.0 110.993 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -62.5 -33.52 75.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.371 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.79 80.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.595 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.51 -42.77 99.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.247 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.09 -50.08 73.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.566 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 51.4 mm -62.88 -44.3 99.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.598 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.6 -41.88 86.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.615 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.23 -36.97 85.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.339 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 90.6 mt -64.24 -47.92 87.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.769 178.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 46.6 mm -59.78 -40.24 82.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.081 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -62.05 -44.57 96.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.443 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -63.58 -36.62 84.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.609 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 96.4 mt -72.24 -42.75 66.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.445 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -48.52 -53.93 16.28 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.971 0.73 . . . . 10.0 112.971 -179.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -62.49 -41.84 99.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.967 0.413 . . . . 10.0 111.866 -178.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.41 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 76.2 mtt-85 -71.26 -35.79 71.51 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.18 0.437 . . . . 10.0 112.18 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 24.8 m -66.43 -33.89 76.72 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.258 0.551 . . . . 10.0 110.146 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -70.69 -46.14 63.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.37 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.63 -44.89 76.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.357 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 120.9 32.45 1.08 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.43 -0.891 . . . . 10.0 112.97 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' GLN . . . . . 0.41 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 61.9 tt0 -104.04 125.82 33.41 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.871 0.335 . . . . 10.0 110.16 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.38 136.51 47.31 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.553 2.168 . . . . 10.0 111.697 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 59.5 t -124.57 122.61 64.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.04 0.448 . . . . 10.0 111.62 -178.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 52.2 tp -108.33 110.0 21.46 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 19.9 t -89.61 113.83 26.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.464 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -93.66 123.78 7.56 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.79 -0.719 . . . . 10.0 111.664 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 34.2 p -122.9 130.47 52.89 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.591 0.234 . . . . 10.0 110.695 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 30.0 pt -95.73 -8.76 9.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.103 0.478 . . . . 10.0 110.296 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.79 126.13 45.13 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.769 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 47.0 mt -57.73 -37.09 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-O 121.051 0.453 . . . . 10.0 111.517 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -56.19 -42.95 77.94 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.142 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . 0.495 ' HZ1' ' CD ' ' A' ' 560' ' ' GLU . 0.8 OUTLIER -72.91 -28.93 62.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.314 -178.922 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.5 m -62.44 -47.65 83.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.247 0.546 . . . . 10.0 109.685 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -68.45 -35.4 77.54 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.718 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 50.7 tp -63.79 -52.45 60.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.799 -0.637 . . . . 10.0 111.356 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 8.8 p -67.16 -31.62 54.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.847 0.356 . . . . 10.0 110.812 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 5.6 t -65.59 -38.96 90.98 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.72 -0.474 . . . . 10.0 109.72 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -62.35 -51.05 69.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.41 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -60.58 -41.19 94.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.39 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.64 -38.42 87.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.761 0.315 . . . . 10.0 110.755 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.0 m -68.51 -36.88 79.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.326 0.584 . . . . 10.0 110.058 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -67.64 -23.31 65.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.854 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -95.5 -3.09 47.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.009 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 72.65 14.15 77.91 Favored Glycine 0 C--N 1.329 0.169 0 C-N-CA 121.013 -0.613 . . . . 10.0 112.481 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 94.5 mt -78.4 120.86 30.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.837 0.351 . . . . 10.0 110.23 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -65.93 117.34 8.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.019 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -145.56 158.21 43.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.171 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . 0.482 ' ND2' HD12 ' A' ' 490' ' ' ILE . 8.1 t30 -132.1 144.76 50.95 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.255 179.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 17.2 t -104.63 132.12 52.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.967 -0.382 . . . . 10.0 109.967 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 88.4 mt -86.31 93.84 9.19 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.122 0.486 . . . . 10.0 110.425 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -85.37 119.81 26.15 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.413 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -64.62 -25.06 67.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.901 -0.59 . . . . 10.0 112.179 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -69.68 -23.1 63.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.042 0.449 . . . . 10.0 110.701 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -120.06 64.84 0.82 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.644 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -24.36 67.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.593 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.38 -33.22 75.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.085 0.469 . . . . 10.0 110.05 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -89.88 -40.49 12.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.955 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.01 -51.92 62.43 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.659 -0.7 . . . . 10.0 111.515 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -56.46 -32.47 64.97 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 112.4 0.518 . . . . 10.0 112.4 -178.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -73.49 -37.52 65.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.033 0.444 . . . . 10.0 110.754 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' ILE . . . . . 0.482 HD12 ' ND2' ' A' ' 477' ' ' ASN . 28.8 mt -76.55 -41.43 34.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.329 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 66.6 t -57.22 -34.75 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-O 121.073 0.463 . . . . 10.0 110.744 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -63.43 -22.34 66.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.57 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 -120.03 22.44 11.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.64 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -71.6 -16.66 62.3 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.997 0.427 . . . . 10.0 111.144 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -95.39 16.44 61.26 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.854 -0.688 . . . . 10.0 111.862 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -74.39 141.09 76.44 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 110.134 -0.321 . . . . 10.0 110.134 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.38 125.6 19.7 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.452 2.101 . . . . 10.0 112.51 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.24 29.8 4.48 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.697 -0.683 . . . . 10.0 112.35 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -105.66 114.61 28.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.832 0.348 . . . . 10.0 110.341 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 23.4 t -98.7 118.4 45.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.198 -0.455 . . . . 10.0 109.892 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.62 138.18 54.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.061 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 41.2 mt -109.98 129.36 65.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.727 -0.471 . . . . 10.0 109.727 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -121.42 129.45 53.01 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.818 0.342 . . . . 10.0 111.066 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 7.4 m -104.89 119.55 39.28 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.464 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 66.8 t30 59.21 77.3 0.32 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.953 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -78.03 123.61 27.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.482 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -70.51 172.74 7.96 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.172 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -65.64 152.95 51.49 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.044 -0.598 . . . . 10.0 112.578 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 67.78 -81.91 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.162 0.585 . . . . 10.0 111.502 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 87.33 149.15 15.23 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.967 -0.635 . . . . 10.0 112.37 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.96 151.07 31.39 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 122.666 0.387 . . . . 10.0 111.527 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -76.27 103.65 6.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.447 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 66.8 mt -84.97 111.29 20.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.209 -0.45 . . . . 10.0 109.98 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 18.4 t -80.5 132.49 31.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.736 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 65.4 mt -67.42 130.39 42.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.703 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 94.32 -11.42 70.41 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.986 -0.626 . . . . 10.0 111.786 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 117.13 -170.78 13.56 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 110.914 -0.874 . . . . 10.0 110.914 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 5.1 p -129.19 99.49 5.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 117.206 0.503 . . . . 10.0 110.993 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 20.0 p-90 -58.28 -28.48 65.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.88 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -62.88 -31.38 72.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.871 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -86.48 -34.26 20.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.057 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -64.76 -40.76 95.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.716 -0.675 . . . . 10.0 111.169 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.9 m -73.42 -19.9 18.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.979 0.419 . . . . 10.0 110.708 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -87.31 -6.81 58.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.728 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -91.47 3.57 54.65 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.486 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 16.5 mt -97.83 150.33 21.39 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.26 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -74.83 -49.08 21.89 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -126.63 90.59 49.41 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.535 -0.542 . . . . 10.0 109.535 179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.3 113.46 2.26 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.765 2.31 . . . . 10.0 112.504 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -104.18 149.0 25.66 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.525 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.38 -37.17 64.68 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.689 0.281 . . . . 10.0 111.465 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -58.19 -36.28 72.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.87 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -81.95 -40.49 22.18 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.793 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 76.7 mt -58.81 -48.04 87.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.353 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -72.41 -29.07 63.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.81 0.338 . . . . 10.0 110.859 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -69.59 -50.74 41.66 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 94.2 mt -62.81 -36.23 74.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.141 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -59.78 -42.16 92.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.023 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -70.06 -45.29 67.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.566 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.19 -47.08 84.54 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.331 0.586 . . . . 10.0 110.065 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -62.46 -40.66 97.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.334 -0.848 . . . . 10.0 110.427 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -55.21 -42.51 73.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.854 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 61.9 t -65.79 -47.81 84.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.437 179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 10.0 mtp180 -62.67 -37.84 88.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.572 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -60.71 -49.05 79.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.326 -0.852 . . . . 10.0 111.058 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -70.15 -27.34 64.47 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.537 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -65.27 -35.55 81.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.106 0.479 . . . . 10.0 109.991 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 95.6 t -73.46 -33.97 41.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.576 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 88.6 mt -58.88 -50.4 74.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.322 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -69.07 -24.78 64.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.916 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -72.12 -23.42 61.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.24 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 122.46 5.15 8.69 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.362 -0.923 . . . . 10.0 113.477 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 79.24 -169.03 53.61 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.732 -0.747 . . . . 10.0 112.678 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 52.9 tp -69.2 123.06 20.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.865 0.364 . . . . 10.0 110.693 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -101.59 123.23 45.27 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.965 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 21.8 mm -106.89 131.49 56.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.335 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 25.5 mt -119.24 124.41 73.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.054 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . 0.531 ' HA2' ' CD2' ' A' ' 586' ' ' PHE . . . -101.68 125.6 8.61 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.991 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 2.0 p -83.02 -30.41 28.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.24 0.543 . . . . 10.0 110.428 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . 0.495 ' CD ' ' HZ1' ' A' ' 461' ' ' LYS . 0.5 OUTLIER -153.6 152.75 31.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.043 -0.98 . . . . 10.0 109.134 179.477 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 37.4 mtt-85 -101.16 158.76 15.79 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.195 -0.298 . . . . 10.0 110.195 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -87.41 152.58 22.13 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.012 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.25 -45.25 95.31 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 3.9 p -89.22 128.61 35.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.487 -0.779 . . . . 10.0 109.874 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 565' ' ' ARG . . . . . 0.433 ' HB3' ' CG2' ' A' ' 396' ' ' THR . 16.2 tpt180 -70.91 -21.59 62.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.535 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 566' ' ' ARG . . . . . 0.465 ' HD2' ' OD1' ' A' ' 212' ' ' ASP . 3.2 mtm180 -54.65 -52.6 61.79 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.954 0.407 . . . . 10.0 110.796 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 46.5 mt -80.03 -30.75 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.54 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -62.42 -40.34 96.23 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.77 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -69.13 -31.81 70.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.791 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -65.12 -28.22 69.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.998 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 35.7 tp -74.4 -26.96 60.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.109 0.48 . . . . 10.0 110.375 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 20.9 ttp180 -84.82 -27.47 26.76 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.518 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -84.03 29.64 3.79 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.991 -0.623 . . . . 10.0 113.499 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -82.17 -44.33 16.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 117.001 0.401 . . . . 10.0 110.211 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 1.2 m -87.97 172.45 9.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.938 -0.573 . . . . 10.0 110.201 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 69.38 42.3 74.66 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.568 -0.825 . . . . 10.0 112.337 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -82.36 135.88 35.09 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 64.61 18.02 11.18 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.131 0.491 . . . . 10.0 110.018 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 80.84 43.92 8.66 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.696 -0.684 . . . . 10.0 111.825 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -99.29 -163.84 1.07 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.513 -0.18 . . . . 10.0 110.513 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -93.73 173.1 7.85 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.232 0.539 . . . . 10.0 111.791 -179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 159.29 166.69 18.75 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.761 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 p -147.6 138.37 23.37 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.761 0.281 . . . . 10.0 110.326 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 12.6 m -123.06 132.08 53.97 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.605 -0.271 . . . . 10.0 110.681 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -146.21 128.31 15.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.091 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 586' ' ' PHE . . . . . 0.531 ' CD2' ' HA2' ' A' ' 558' ' ' GLY . 18.1 m-85 -114.84 146.96 40.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.039 0.447 . . . . 10.0 110.646 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -126.5 135.38 51.25 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 63.9 mt -133.91 160.0 39.0 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.697 0.284 . . . . 10.0 110.699 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 25.5 p -130.88 164.75 24.56 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.003 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 78.5 mmm -76.22 -2.52 31.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.92 0.391 . . . . 10.0 111.117 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -98.01 1.93 48.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.366 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -88.41 142.69 27.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.78 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -65.26 -13.73 59.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.547 -0.751 . . . . 10.0 112.34 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 15.7 tp -65.38 -23.95 67.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.918 0.39 . . . . 10.0 110.858 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 19.5 mmt -77.52 -3.79 42.35 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.916 0.389 . . . . 10.0 111.159 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -92.4 -15.33 27.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.771 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 29.1 pt -67.3 -14.29 17.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-O 120.999 0.428 . . . . 10.0 111.241 -179.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -76.53 -10.65 59.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.046 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.83 -55.93 0.65 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.458 0.703 . . . . 10.0 110.781 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 7.3 m -93.91 103.64 15.73 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -16.52 39.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.871 -0.604 . . . . 10.0 112.113 -178.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 4.4 mmt180 -63.0 -32.78 74.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.696 0.284 . . . . 10.0 110.552 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 50.7 t -68.0 -48.89 72.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.281 -0.418 . . . . 10.0 109.938 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.1 -38.47 85.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.32 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -64.6 -26.57 71.0 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.946 -0.57 . . . . 10.0 112.489 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 58.2 tpp -68.93 -18.04 64.04 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.113 0.482 . . . . 10.0 110.572 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 59.7 mtt -76.58 -14.98 59.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.257 -0.428 . . . . 10.0 110.522 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 36.5 mtt-85 -72.07 -12.97 61.46 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.23 0.538 . . . . 10.0 110.358 179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 10.6 mmmt -82.93 1.99 36.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.889 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 5.2 mp -75.91 -14.87 60.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.572 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 92.35 -31.73 5.89 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.973 -0.632 . . . . 10.0 111.774 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 612' ' ' MET . . . . . 0.401 ' HG3' ' HA ' ' A' ' 428' ' ' TYR . 0.0 OUTLIER 69.78 -66.8 0.25 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 123.539 0.736 . . . . 10.0 111.69 179.763 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp 57.42 78.32 0.37 Allowed Pre-proline 0 CA--C 1.53 0.198 0 O-C-N 123.524 0.515 . . . . 10.0 111.131 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 614' ' ' PRO . . . . . 0.478 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 52.3 Cg_exo -56.56 119.12 6.13 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.142 2.561 . . . . 10.0 112.506 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 101.74 -9.32 56.88 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.893 -0.67 . . . . 10.0 111.891 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -111.05 120.11 41.26 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.992 0.425 . . . . 10.0 110.347 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -79.28 96.93 6.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.618 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.2 tp -72.24 -23.22 21.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.841 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 46.98 83.65 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.797 0.685 . . . . 10.0 112.524 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -116.79 94.03 42.87 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.273 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -61.44 -29.22 84.87 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.102 2.535 . . . . 10.0 113.447 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 70.1 p-90 -65.36 -25.75 67.71 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.886 -0.326 . . . . 10.0 110.996 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 73.1 t -67.85 -42.36 85.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 1.8 m -62.74 -38.85 92.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.445 -0.798 . . . . 10.0 110.081 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -68.97 -39.18 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.177 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -61.68 -38.4 87.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.231 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.76 -43.64 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.935 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 628' ' ' ALA . . . . . 0.435 ' O ' ' HG3' ' A' ' 632' ' ' ARG . . . -60.33 -42.21 95.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.411 179.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 629' ' ' ASN . . . . . 0.406 ' O ' ' HG3' ' A' ' 633' ' ' LYS . 61.3 t30 -67.65 -35.86 79.69 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.144 179.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -64.75 -41.87 95.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.975 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -62.76 -37.45 86.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.083 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 632' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 628' ' ' ALA . 12.7 mtp180 -61.77 -34.62 76.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.277 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 633' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 629' ' ' ASN . 57.5 mttm -64.91 -38.93 92.61 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 92.1 t -62.22 -49.56 83.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.053 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -62.41 -30.95 71.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.292 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.4 m -69.43 -23.78 63.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.282 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -73.28 -35.68 66.21 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -65.0 -42.29 94.61 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.63 -0.713 . . . . 10.0 109.521 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -55.7 -44.84 77.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.308 -0.86 . . . . 10.0 110.4 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -59.6 -43.37 93.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.821 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 52.3 mt -64.57 -47.6 88.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.224 179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 642' ' ' ARG . . . . . 0.497 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 75.4 mtm-85 -60.28 -43.34 96.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.945 -0.57 . . . . 10.0 110.314 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 18.5 ttpt -55.21 -45.99 75.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.914 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -64.93 -41.5 95.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.944 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 88.9 mt -65.99 -41.39 91.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.926 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 646' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 97.5 mt -59.07 -42.47 90.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.879 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -66.43 -13.59 60.96 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.002 0.371 . . . . 10.0 112.002 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -102.27 -38.72 7.53 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.946 0.403 . . . . 10.0 111.162 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -83.41 -25.5 31.25 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 -178.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -65.27 -31.34 72.44 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.021 0.439 . . . . 10.0 110.319 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 651' ' ' VAL . . . . . 0.417 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 13.2 t -62.98 -47.28 93.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.8 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.12 -26.54 64.95 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.539 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -63.18 -48.23 79.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.598 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.79 -44.61 95.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.555 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 655' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 42.3 mt-30 -61.56 -44.05 97.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.364 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 24.9 ttp-105 -63.02 -42.44 99.8 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.857 -0.61 . . . . 10.0 109.952 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -63.23 -44.91 93.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.956 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.83 -49.64 69.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.769 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.3 tp -65.93 -36.9 78.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 C-N-CA 121.103 -0.239 . . . . 10.0 111.271 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 6.1 m-30 -68.32 -40.08 81.75 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.937 -0.394 . . . . 10.0 109.937 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 5.1 t -60.47 -49.46 77.48 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.066 -0.516 . . . . 10.0 109.698 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -58.88 -47.77 83.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.781 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.487 ' O ' ' HB2' ' A' ' 667' ' ' LEU . 43.8 ttt-85 -60.91 -39.23 88.57 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.042 -0.527 . . . . 10.0 111.571 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -73.45 -43.35 60.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.562 0.22 . . . . 10.0 111.487 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -58.45 -37.62 75.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.095 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 61.2 mt -88.7 -4.43 58.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.834 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 663' ' ' ARG . 20.3 tp -87.15 -46.96 9.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.075 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -68.41 -41.71 80.05 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.066 -0.516 . . . . 10.0 111.623 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 21.7 m -72.67 164.2 3.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.072 0.463 . . . . 10.0 111.423 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 53.9 m -115.96 -38.72 3.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.331 -179.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -80.12 84.63 5.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.136 0.493 . . . . 10.0 110.579 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 9.5 p -95.01 -5.46 10.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.567 0.699 . . . . 10.0 109.716 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -39.16 69.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.074 -0.966 . . . . 10.0 111.93 -179.308 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -58.54 -50.47 73.67 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.097 0.475 . . . . 10.0 110.551 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -44.49 89.41 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.811 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 36.0 mm -56.7 -51.63 64.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.755 -0.657 . . . . 10.0 111.954 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -67.52 -35.75 79.7 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 52.8 m -65.43 -46.6 79.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.618 0.247 . . . . 10.0 111.483 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 48.1 pt -74.76 -20.73 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.92 -0.312 . . . . 10.0 110.732 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 48.5 ttm-85 -60.48 -40.84 92.73 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.957 0.408 . . . . 10.0 110.179 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -62.96 -38.26 90.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.662 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -72.78 -46.79 51.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.223 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 94.2 t -58.62 -46.11 90.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-O 120.831 0.348 . . . . 10.0 111.05 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -62.53 -42.24 99.4 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.465 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -64.07 -43.2 96.17 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.651 -0.249 . . . . 10.0 110.438 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.7 87.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.976 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 8.8 m -68.37 -37.32 80.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.563 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.04 -44.32 50.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.797 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -31.11 62.26 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.037 0.535 . . . . 10.0 111.931 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -66.62 -28.17 68.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.852 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -110.17 -22.09 11.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.739 0.304 . . . . 10.0 111.599 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 28.1 mt -125.85 100.26 31.08 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.515 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.48 130.28 26.22 Favored 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.507 2.138 . . . . 10.0 110.766 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -48.11 109.04 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 123.056 2.504 . . . . 10.0 113.529 -178.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.06 88.91 0.07 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.661 -0.699 . . . . 10.0 111.551 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 11.9 p -154.67 -168.71 2.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.215 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 32.3 mt -72.56 136.64 45.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.206 -0.294 . . . . 10.0 110.206 179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -59.86 -31.71 70.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.873 -178.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -76.33 -4.56 42.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.974 0.416 . . . . 10.0 111.48 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 13.1 mmt -100.95 8.79 42.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.334 0.588 . . . . 10.0 109.784 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 701' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -102.5 125.09 49.1 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.298 -0.865 . . . . 10.0 110.194 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -82.14 77.49 8.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.431 0.634 . . . . 10.0 109.334 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 703' ' ' ILE . . . . . 0.505 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 32.8 mm -63.36 -49.45 79.0 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.175 -0.92 . . . . 10.0 111.16 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 704' ' ' PRO . . . . . 0.505 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 51.7 Cg_exo -56.44 -45.88 34.26 Favored 'Trans proline' 0 C--N 1.359 1.13 0 C-N-CA 121.866 1.711 . . . . 10.0 112.008 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -64.22 -41.76 98.19 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.962 -0.637 . . . . 10.0 111.965 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.46 ' O ' ' HG ' ' A' ' 710' ' ' LEU . 60.0 tp -64.7 -43.44 93.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.487 0.184 . . . . 10.0 110.702 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -61.15 -47.41 86.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.525 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -66.09 -35.04 79.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.393 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.5 -46.85 88.24 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.254 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 710' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 706' ' ' LEU . 63.1 mt -60.58 -36.74 79.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.776 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -73.22 -21.08 60.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.989 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -99.15 -42.28 7.13 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.523 0.564 . . . . 10.0 112.523 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 713' ' ' ASP . . . . . 0.425 ' CG ' ' HZ2' ' B' ' 10' ' ' LYS . 15.9 m-20 -96.02 -23.36 16.85 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.699 1.0 . . . . 10.0 113.699 -177.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -120.34 1.23 10.72 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.504 0.927 . . . . 10.0 113.504 -177.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 22.8 t70 57.76 31.31 20.27 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 121.554 0.692 . . . . 10.0 110.22 179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 14.8 tp -125.96 128.17 47.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.155 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -104.02 105.19 15.28 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.898 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 82.3 mt -121.04 104.05 41.87 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.938 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.56 73.84 3.94 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 122.536 2.157 . . . . 10.0 111.655 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 57.3 mt -55.73 -43.14 72.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.42 -0.809 . . . . 10.0 111.932 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -64.91 -21.99 66.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.679 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -80.51 -17.21 52.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.977 0.418 . . . . 10.0 110.453 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 20.0 m0 -101.75 -43.87 5.71 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.533 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 16.1 tp -57.17 -27.6 62.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.415 -178.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -86.73 -10.5 53.52 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.841 0.311 . . . . 10.0 111.841 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 42.8 mttp -111.02 -45.9 3.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.663 0.268 . . . . 10.0 111.285 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -116.3 95.15 44.52 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 121.178 0.513 . . . . 10.0 110.336 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -72.97 8.91 1.51 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.456 2.104 . . . . 10.0 112.346 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -79.45 -8.47 59.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.132 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 63.7 mt -65.43 -40.24 93.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.242 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 53.93 -97.57 0.07 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.597 -0.728 . . . . 10.0 110.833 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 732' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' A' ' 736' ' ' ARG . 0.2 OUTLIER -144.55 -57.63 0.36 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.21 -48.75 76.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.981 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 2.3 m -60.14 -33.1 71.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.154 0.502 . . . . 10.0 110.376 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.99 -43.57 98.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.733 -0.667 . . . . 10.0 109.483 178.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 736' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 732' ' ' GLU . 71.0 mtt-85 -65.07 -47.77 76.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.199 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -57.94 -39.91 79.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.474 -0.784 . . . . 10.0 111.335 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 27.9 mmm-85 -62.11 -40.27 95.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.854 0.359 . . . . 10.0 110.45 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 92.2 mt -67.61 -44.35 86.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.526 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 29.1 tp -66.35 -43.14 86.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.016 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.96 -42.7 94.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.803 0.335 . . . . 10.0 110.928 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -64.88 -40.61 95.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.317 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 2.3 p -66.38 -44.6 82.67 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.865 -0.334 . . . . 10.0 110.632 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.6 -38.87 83.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.05 -54.76 42.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.392 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.41 ' HA ' ' HD3' ' A' ' 749' ' ' ARG . 97.0 t -63.65 -34.12 65.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.987 0.423 . . . . 10.0 110.576 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -60.39 -49.95 75.54 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.36 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -65.16 -31.75 73.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.556 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 749' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 746' ' ' VAL . 65.9 mtp180 -67.2 -41.34 85.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.87 -0.605 . . . . 10.0 109.695 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -66.08 -39.97 90.48 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -59.09 -39.12 81.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.053 -0.976 . . . . 10.0 111.725 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.43 -21.25 65.26 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.457 0.54 . . . . 10.0 112.457 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.0 t -87.63 -27.93 5.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.883 0.373 . . . . 10.0 111.463 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 6.6 t -96.77 -42.12 11.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.033 0.444 . . . . 10.0 111.259 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 125.46 130.81 3.52 Favored Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 111.158 -0.777 . . . . 10.0 111.158 -179.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 756' ' ' ALA . . . . . 0.491 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -55.12 -47.12 75.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 10.0 111.707 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.13 -38.57 91.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.163 0.506 . . . . 10.0 110.663 -179.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.5 tpt -69.4 -42.31 75.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.839 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 76.8 mmm -61.12 -39.54 90.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.948 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . 0.491 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.8 mmp_? -60.81 -39.95 90.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.266 0.555 . . . . 10.0 110.011 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 10.9 m-70 -71.11 -33.4 70.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.927 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -67.04 -46.85 73.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.687 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 79.5 mt-10 -59.6 -44.88 93.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.335 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -61.46 -41.08 96.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.173 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -66.81 -43.66 91.1 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.15 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 48.7 t -60.69 -41.45 88.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 120.678 0.275 . . . . 10.0 110.906 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 8.9 mtp -57.64 -49.12 77.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.254 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 60.4 mt -66.65 -40.41 88.67 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.235 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -53.21 -57.12 11.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.751 -0.659 . . . . 10.0 111.312 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 3.7 m -68.72 -35.78 77.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.346 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.26 -54.27 43.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.977 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -62.19 -37.58 85.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.298 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 49.6 m -65.75 -42.45 90.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.816 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 62.9 mt -77.41 -23.83 50.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.611 -0.268 . . . . 10.0 110.908 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -66.14 -51.06 61.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.645 -0.252 . . . . 10.0 110.658 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.441 ' HG3' ' N ' ' A' ' 777' ' ' GLU . 13.5 ptpt -62.45 -34.24 76.41 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.805 0.336 . . . . 10.0 110.324 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 777' ' ' GLU . . . . . 0.441 ' N ' ' HG3' ' A' ' 776' ' ' LYS . 0.9 OUTLIER -70.34 -39.92 74.4 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 178.845 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -60.65 -32.42 71.6 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.929 -0.578 . . . . 10.0 109.986 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 85.0 mt -65.69 -45.81 81.4 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -67.96 -42.4 80.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.125 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.77 -42.93 94.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.936 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 85.1 mmm -64.39 -38.27 90.45 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.024 0.44 . . . . 10.0 109.979 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.58 -40.77 93.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.066 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -64.84 -41.92 95.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.216 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.7 tp -71.59 -35.52 70.56 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.706 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -57.25 -39.36 75.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.145 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -89.77 -32.66 16.87 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.754 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 788' ' ' GLY . . . . . 0.509 ' O ' ' HG ' ' A' ' 791' ' ' LEU . . . -74.04 -25.38 71.47 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 121.096 -0.574 . . . . 10.0 113.687 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 7.7 tp -69.29 -14.55 18.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 122.426 -0.455 . . . . 10.0 111.329 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 26.0 m170 -67.89 -30.52 69.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.833 0.349 . . . . 10.0 110.909 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 788' ' ' GLY . 0.7 OUTLIER -96.4 -2.34 45.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.022 0.439 . . . . 10.0 110.438 179.371 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 74.2 mtt180 -99.14 -9.34 23.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.155 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -81.08 79.79 1.77 Allowed Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.804 -0.635 . . . . 10.0 112.523 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -71.29 158.6 36.09 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.821 0.343 . . . . 10.0 110.637 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 795' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 796' ' ' GLN . . . -54.87 151.26 8.82 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.771 -0.65 . . . . 10.0 112.169 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 796' ' ' GLN . . . . . 0.509 ' HB2' ' O ' ' A' ' 795' ' ' ALA . 16.9 mm100 79.82 -31.68 0.13 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.271 -0.877 . . . . 10.0 111.73 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -94.46 143.41 26.43 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.255 -0.276 . . . . 10.0 110.255 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -83.4 120.63 75.9 Favored Pre-proline 0 C--N 1.325 -0.475 0 N-CA-C 109.738 -0.468 . . . . 10.0 109.738 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.17 -26.44 64.95 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.881 2.387 . . . . 10.0 113.479 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 800' ' ' LYS . . . . . 0.416 ' O ' ' HG3' ' A' ' 804' ' ' LYS . 27.4 mtpt -74.28 -46.82 38.79 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.638 -0.504 . . . . 10.0 109.638 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -65.38 -37.94 88.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.538 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -66.33 -41.28 89.85 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -57.54 -44.16 84.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.491 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 804' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 800' ' ' LYS . 95.6 mttt -62.51 -47.24 84.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.857 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 39.3 ttp85 -61.03 -47.6 85.63 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.427 -0.351 . . . . 10.0 111.238 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.26 -47.25 86.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.467 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 8.3 p -65.77 -39.21 90.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.495 -0.321 . . . . 10.0 111.501 -179.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -65.05 -35.65 81.85 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.873 0.368 . . . . 10.0 110.272 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 19.4 m -68.56 -40.79 80.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.206 0.527 . . . . 10.0 109.754 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 13.4 ttm -62.69 -38.42 90.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.609 -0.723 . . . . 10.0 110.241 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -65.28 -44.11 89.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.666 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.78 -49.05 77.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.612 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -61.65 -34.91 76.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.693 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 32.9 ttp -64.59 -43.61 93.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.216 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 97.3 mt -65.97 -40.59 91.38 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.409 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 816' ' ' GLU . . . . . 0.404 ' HA ' ' HE2' ' A' ' 819' ' ' LYS . 37.9 mm-40 -62.94 -39.43 94.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.591 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 19.9 m -76.58 -27.2 55.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.508 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 36.7 tp -62.76 -57.11 12.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.729 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 819' ' ' LYS . . . . . 0.404 ' HE2' ' HA ' ' A' ' 816' ' ' GLU . 53.9 pttt -61.32 -30.06 70.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.478 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -61.73 -56.53 18.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.817 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.55 -31.3 71.29 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.587 -0.278 . . . . 10.0 111.498 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 822' ' ' VAL . . . . . 0.63 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 36.6 t -60.63 -56.95 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 39.5 mm -63.44 -37.28 79.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 121.073 0.463 . . . . 10.0 110.03 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 824' ' ' SER . . . . . 0.495 ' O ' ' HB2' ' A' ' 828' ' ' LYS . 29.4 t -59.78 -53.83 53.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.37 179.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 98.0 m -59.99 -38.69 83.33 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.557 -0.292 . . . . 10.0 111.727 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 826' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 94.4 mt -62.03 -29.06 70.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.92 0.39 . . . . 10.0 111.423 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 1.7 m -97.0 -27.92 14.4 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.237 0.541 . . . . 10.0 110.095 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 828' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 824' ' ' SER . 2.0 ttpt -69.8 -19.63 63.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.127 -0.942 . . . . 10.0 111.415 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.8 p -53.2 130.09 14.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 CA-C-O 121.213 0.53 . . . . 10.0 111.183 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 36.3 mm-40 -86.0 113.66 22.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.728 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 60.6 t -120.39 136.76 56.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.816 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 832' ' ' ARG . . . . . 0.498 ' O ' ' HD3' ' A' ' 834' ' ' PRO . 17.5 ptt180 -74.08 92.08 2.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.575 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 73.0 mtp -84.92 107.48 11.75 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.733 -0.469 . . . . 10.0 109.733 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' A' ' 832' ' ' ARG . 86.8 Cg_endo -80.5 -154.86 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.989 2.459 . . . . 10.0 113.067 -178.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -65.04 112.46 3.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.463 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.798 -0.62 . . . . 10.0 110.314 -179.878 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.95 0.405 . . . . 10.0 110.485 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 11.7 tpt -92.62 124.07 36.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.015 0.435 . . . . 10.0 110.566 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 33.0 mt -90.22 118.28 35.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.445 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.02 91.2 1.55 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.956 0.408 . . . . 10.0 110.875 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 72.6 mt -83.55 73.98 10.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.302 0.572 . . . . 10.0 110.894 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.03 158.06 44.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.605 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -140.11 -179.48 6.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 10.0 110.54 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.519 ' HA ' ' NE ' ' B' ' 8' ' ' ARG . 1.8 mmp_? -117.7 14.83 14.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.535 -0.302 . . . . 10.0 111.254 -179.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -124.74 105.52 9.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.738 0.304 . . . . 10.0 110.566 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . 0.425 ' HZ2' ' CG ' ' A' ' 713' ' ' ASP . 19.3 pttp -88.55 149.4 23.62 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.631 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . 0.427 ' O ' HD12 ' A' ' 291' ' ' ILE . 50.5 mt -85.0 121.42 74.2 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.704 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -82.92 34.9 0.56 Allowed 'Trans proline' 0 N--CA 1.463 -0.292 0 C-N-CA 122.716 2.277 . . . . 10.0 112.182 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 45.0 mt -92.98 -64.03 1.15 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.6 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.27 -37.37 82.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.683 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.2 m -71.24 -24.73 24.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.561 -0.29 . . . . 10.0 111.378 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.24 -33.78 73.79 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.174 0.511 . . . . 10.0 109.787 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 57.7 t -68.47 -28.95 42.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.539 -0.755 . . . . 10.0 109.99 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.7 -13.59 61.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.652 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.27 -34.33 8.83 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.123 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -93.49 58.49 2.27 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.926 -0.654 . . . . 10.0 112.316 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -107.11 6.7 9.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.051 0.453 . . . . 10.0 110.576 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 1.3 ptp -112.96 -168.77 1.37 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.311 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 6.3 m -62.18 127.2 30.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.659 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.94 110.47 0.82 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.43 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -124.05 156.68 36.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.881 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.87 139.42 50.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.917 0.389 . . . . 10.0 111.199 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 22.1 ptp -124.42 177.68 5.78 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.13 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.741 -0.647 . . . . 10.0 110.832 -179.74 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 93.2 t . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 120.772 0.32 . . . . 10.0 110.373 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -84.02 146.8 27.77 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.7 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.66 163.65 10.68 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 111.569 -0.612 . . . . 10.0 111.569 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.72 117.64 5.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.789 0.328 . . . . 10.0 110.207 179.558 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -58.21 142.93 46.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.037 -0.528 . . . . 10.0 111.214 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 77.12 -63.16 0.38 Allowed 'General case' 0 N--CA 1.465 0.277 0 O-C-N 124.158 0.911 . . . . 10.0 111.595 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -69.29 -66.51 0.57 Allowed 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.215 0.82 . . . . 10.0 113.215 -177.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -72.57 -26.27 61.66 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -178.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 m -56.81 -45.09 82.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 10.0 111.366 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.3 mt -69.47 -28.81 66.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.398 -0.365 . . . . 10.0 111.731 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -71.71 -49.07 42.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.765 0.317 . . . . 10.0 110.549 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 20' ' ' ARG . 3.0 ttp85 -66.63 -37.04 84.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.406 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.595 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -64.12 -32.99 74.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.251 179.38 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.0 tpp180 -62.1 -36.17 80.92 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.645 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.9 -41.03 97.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.104 -0.498 . . . . 10.0 109.868 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 22.7 t -67.57 -36.79 77.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.999 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 70.2 t -59.49 -37.3 69.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.08 178.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -62.95 -43.1 99.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.894 -0.594 . . . . 10.0 109.944 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.4 mt -62.07 -47.12 94.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.268 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 60.5 mt -60.39 -35.9 65.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.804 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -69.38 -34.43 74.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.056 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.472 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -77.61 -26.56 50.74 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.062 0.458 . . . . 10.0 110.744 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 45.8 mtt -79.06 -10.5 59.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.136 -0.483 . . . . 10.0 111.263 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.466 ' CD ' ' HD3' ' A' ' 72' ' ' ARG . 5.8 mt-10 -57.79 -56.89 29.88 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 119.147 -0.454 . . . . 10.0 111.632 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.472 ' HD2' ' O ' ' A' ' 30' ' ' ALA . 50.7 Cg_exo -56.0 -32.31 85.56 Favored 'Trans proline' 0 C--N 1.36 1.141 0 C-N-CA 121.803 1.669 . . . . 10.0 112.022 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -67.05 -46.62 73.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.704 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 24.6 mmt -68.51 -35.6 77.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.823 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -63.13 -29.3 70.68 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.207 0.527 . . . . 10.0 110.253 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -74.34 -31.73 62.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.89 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.4 mp -74.83 136.95 41.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.962 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.6 p -78.55 175.93 9.89 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.894 -0.322 . . . . 10.0 110.497 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -55.64 -51.9 65.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.213 0.449 . . . . 10.0 112.213 -178.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -63.87 -29.6 70.77 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.069 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -67.93 -39.41 83.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.677 0.275 . . . . 10.0 110.308 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -66.04 -40.14 90.75 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -60.75 -38.85 86.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.17 -0.923 . . . . 10.0 109.815 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.01 -26.14 74.11 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.466 -0.788 . . . . 10.0 112.038 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -65.48 -38.78 90.78 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.049 -0.352 . . . . 10.0 110.049 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 17.1 m -62.76 -40.23 96.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.198 0.523 . . . . 10.0 109.75 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.77 -35.76 77.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.06 178.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -62.59 -41.91 99.24 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.077 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -62.96 -39.63 95.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.231 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -59.99 -46.62 88.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.052 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.68 -38.94 80.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.782 -0.644 . . . . 10.0 111.077 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -61.39 -47.61 85.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.97 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.2 mt -62.97 -35.0 78.71 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.146 0.498 . . . . 10.0 110.704 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.61 -42.63 95.41 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.485 -0.78 . . . . 10.0 111.138 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.484 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -83.98 -51.08 7.42 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.005 0.372 . . . . 10.0 112.005 -179.156 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 171.28 88.13 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.254 -0.975 . . . . 10.0 113.006 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -149.07 148.72 30.02 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.8 t -95.79 131.44 42.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.6 tp -58.77 -41.82 87.52 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.098 0.475 . . . . 10.0 110.636 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -69.46 -11.42 60.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.377 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -93.45 -20.04 20.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.282 0.563 . . . . 10.0 110.371 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 67.3 mt -82.2 -10.78 59.02 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.756 -0.657 . . . . 10.0 111.557 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 67.4 mt -46.9 -53.33 27.17 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.5 Cg_exo -54.11 -54.06 5.33 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.736 1.624 . . . . 10.0 113.067 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -68.08 -43.67 78.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 10.0 112.108 -178.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.18 -50.28 72.43 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.805 -178.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -63.08 -33.0 74.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.772 -179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.78 -45.4 86.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.484 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.5 t -61.93 -46.68 95.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.134 -0.485 . . . . 10.0 110.211 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 45.3 t -60.82 -45.77 97.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.208 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.466 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 5.3 ttm180 -59.45 -43.74 93.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.593 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 -62.88 -47.43 83.35 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.116 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.5 -30.33 71.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.849 -0.614 . . . . 10.0 111.124 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.9 m -61.78 -35.62 78.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.756 0.313 . . . . 10.0 111.185 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.494 ' O ' ' HA3' ' A' ' 80' ' ' GLY . 51.2 mtmt -76.41 -28.85 56.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.532 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -88.28 -43.81 11.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.352 -0.386 . . . . 10.0 111.931 -178.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 90.4 t -77.11 -62.81 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.828 0.347 . . . . 10.0 111.694 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -83.05 -41.6 18.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.384 -178.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' A' ' 76' ' ' LYS . . . 100.33 29.58 6.65 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.888 -0.672 . . . . 10.0 111.868 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 47.1 ttm -144.27 127.95 17.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.701 0.286 . . . . 10.0 110.39 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 82' ' ' ARG . 29.4 ttp85 -71.48 126.23 29.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.202 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.38 117.46 3.84 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.803 -0.443 . . . . 10.0 109.803 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -57.06 147.16 25.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.315 0.578 . . . . 10.0 111.636 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -63.89 -32.52 74.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.198 -0.91 . . . . 10.0 111.79 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.67 -26.64 31.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.033 0.444 . . . . 10.0 110.728 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.424 HE22 HD21 ' A' ' 110' ' ' LEU . 92.9 mt-30 -74.14 -31.05 62.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.265 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.45 -37.65 88.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.153 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.0 mt -65.04 -49.53 69.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.426 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -64.51 -44.68 94.82 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.733 -0.667 . . . . 10.0 112.554 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.33 -31.23 80.17 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.082 -0.58 . . . . 10.0 112.566 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.595 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 16.3 ttm -70.14 -37.74 75.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.763 0.316 . . . . 10.0 110.69 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 91.8 t -72.87 -29.14 28.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.149 0.5 . . . . 10.0 110.198 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 mt -70.63 -5.57 30.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.715 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -80.41 -25.74 38.86 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.03 -0.729 . . . . 10.0 109.03 178.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -93.96 177.49 5.97 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.319 -0.855 . . . . 10.0 110.179 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.567 ' HG2' ' CD2' ' A' ' 407' ' ' LEU . 13.7 ttt85 -86.57 75.36 9.73 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.097 -0.501 . . . . 10.0 109.708 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 85.6 m -147.94 174.94 11.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.114 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 40.9 mm -112.72 134.39 55.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.619 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -112.36 119.73 39.28 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.869 0.366 . . . . 10.0 111.375 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -89.89 106.05 18.21 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.417 ' O ' ' HA3' ' A' ' 392' ' ' GLY . 35.4 ttm -103.3 151.47 22.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.095 0.474 . . . . 10.0 110.665 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.498 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 0.2 OUTLIER -85.52 149.68 25.21 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.758 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.78 107.28 5.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.982 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 133.66 -25.66 3.56 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.775 -0.726 . . . . 10.0 112.705 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.603 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 1.2 mm-40 -74.31 -21.17 59.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.818 0.342 . . . . 10.0 110.983 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.33 85.39 1.87 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.638 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.494 ' HD2' ' SD ' ' A' ' 390' ' ' MET . 8.4 mtmt -62.97 -65.88 0.62 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.925 0.393 . . . . 10.0 111.852 -179.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -60.09 -30.03 68.98 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.162 0.43 . . . . 10.0 112.162 -178.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.424 HD21 HE22 ' A' ' 87' ' ' GLN . 35.0 tp -68.01 -25.82 65.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.787 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 60.6 m -89.69 -28.95 19.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.008 0.432 . . . . 10.0 111.07 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.12 -11.46 49.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.976 -0.556 . . . . 10.0 112.492 -179.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 14.9 p -74.98 -23.73 58.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.797 0.332 . . . . 10.0 111.622 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 38.1 mt -68.24 -57.87 8.34 Favored Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -65.46 -26.64 54.93 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.888 1.725 . . . . 10.0 112.098 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -67.67 -48.44 66.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.822 -0.627 . . . . 10.0 110.784 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.421 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 55.2 t80 -60.85 -45.4 94.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.644 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 32.0 tp -59.87 -52.34 65.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.02 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -70.49 -20.62 62.84 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 111.971 0.36 . . . . 10.0 111.971 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -73.52 -27.59 61.45 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.497 -0.32 . . . . 10.0 110.743 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 69.3 mt -57.49 -35.5 70.29 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.985 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -20.84 66.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.71 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.41 25.76 75.19 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.926 -0.654 . . . . 10.0 112.677 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -96.41 -10.88 26.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.736 0.303 . . . . 10.0 110.932 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 94.3 112.66 2.41 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.728 -0.749 . . . . 10.0 113.343 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.5 t -88.21 113.57 25.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.428 -0.582 . . . . 10.0 109.428 178.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -89.52 100.4 13.2 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.971 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 29.8 t -91.59 114.44 28.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.975 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 54.8 t -97.69 118.49 44.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.508 -179.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.43 148.54 34.15 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.629 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.66 -31.55 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 112.191 0.441 . . . . 10.0 112.191 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -149.92 166.09 30.65 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.667 0.27 . . . . 10.0 110.801 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -72.64 -23.47 60.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.696 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -55.8 -54.56 43.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.691 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.3 mt -73.72 -35.87 65.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.564 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.64 -52.3 64.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.077 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -69.28 -39.47 78.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.601 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.1 ttp85 -53.83 -55.64 24.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.134 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.93 -28.94 61.76 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.741 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.81 85.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.967 0.413 . . . . 10.0 110.783 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -90.54 -32.17 16.43 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.051 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -68.42 -42.62 78.68 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.933 0.397 . . . . 10.0 111.291 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -89.51 2.91 53.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.222 -0.444 . . . . 10.0 111.105 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.452 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 56.3 ttm-85 -63.62 -48.18 81.08 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.79 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' PRO . . . . . 0.452 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 16.3 Cg_exo -68.73 8.73 0.52 Allowed 'Trans proline' 0 C--N 1.361 1.216 0 C-N-CA 122.21 1.94 . . . . 10.0 112.618 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.425 ' H ' ' C ' ' A' ' 144' ' ' ARG . 11.7 tp -111.59 -57.84 2.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.138 -0.483 . . . . 10.0 109.863 179.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -71.11 -49.43 44.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.65 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.13 -13.51 62.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.23 0.538 . . . . 10.0 110.601 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -78.62 -39.81 36.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.901 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 92.4 mt -81.86 -37.75 26.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.405 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 139.26 29.15 0.22 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.075 -1.06 . . . . 10.0 113.277 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 88.8 mt -119.94 123.2 42.97 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.62 127.43 32.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.19 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 14.7 t -104.68 107.02 21.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.474 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -105.31 143.23 15.64 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.841 -0.695 . . . . 10.0 111.999 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.4 tp -117.02 123.71 72.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.051 0.453 . . . . 10.0 110.544 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -101.69 115.19 29.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.134 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 85.2 mt -103.99 144.86 29.54 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.035 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' PRO . . . . . 0.469 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 23.5 Cg_endo -62.06 112.52 1.55 Allowed 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.623 2.215 . . . . 10.0 111.937 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 96.99 8.7 56.7 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.874 -0.679 . . . . 10.0 112.434 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 43.3 ttm -68.31 135.93 91.18 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.428 -0.212 . . . . 10.0 110.428 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -50.45 144.29 24.97 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.799 2.333 . . . . 10.0 112.573 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . 0.422 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.46 -48.24 90.58 Favored Pre-proline 0 CA--C 1.54 0.573 0 N-CA-C 113.359 0.874 . . . . 10.0 113.359 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.422 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.4 Cg_exo -57.1 -33.36 95.65 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 121.789 1.659 . . . . 10.0 112.584 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.44 -38.99 48.29 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.412 ' HZ1' ' CG ' ' A' ' 185' ' ' ASP . 54.7 mttm -59.61 -42.99 93.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.797 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -58.81 -32.9 69.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.437 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -75.72 -38.33 58.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.893 0.378 . . . . 10.0 110.417 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.27 -38.69 88.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.628 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -79.58 -24.28 42.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.194 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -75.24 -11.82 60.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.139 0.495 . . . . 10.0 110.285 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -72.69 173.33 9.18 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.471 -0.786 . . . . 10.0 110.28 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -77.36 -36.01 54.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.088 0.47 . . . . 10.0 109.826 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 76.1 mt -130.02 128.3 64.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.911 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 9.4 m -119.4 117.54 28.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.915 0.388 . . . . 10.0 111.527 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -94.29 133.06 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.638 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -167.61 164.68 38.12 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.126 -1.035 . . . . 10.0 113.131 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.56 150.11 28.33 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 122.275 0.23 . . . . 10.0 110.972 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -57.98 -41.07 82.2 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -51.81 66.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.506 -0.315 . . . . 10.0 111.261 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . 0.469 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 4.4 tp10 -64.33 -36.96 85.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.954 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.28 -34.84 72.75 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.019 0.438 . . . . 10.0 110.543 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -77.66 -41.16 20.48 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 111.298 -0.721 . . . . 10.0 111.298 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -62.44 -39.47 93.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.339 . . . . 10.0 110.485 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . 0.412 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 34.2 m-20 -61.26 -41.78 97.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.579 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -64.16 -35.96 82.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.178 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 62.5 mt -68.95 -42.88 76.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.666 -0.697 . . . . 10.0 110.29 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 62.3 mtm-85 -67.04 -41.36 86.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.559 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.82 -39.92 90.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.758 -0.656 . . . . 10.0 110.731 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -83.86 7.97 16.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.694 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.98 5.27 13.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.909 0.385 . . . . 10.0 110.736 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -78.34 168.32 20.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.629 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -110.45 -24.29 10.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.208 0.528 . . . . 10.0 110.271 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.89 138.36 30.41 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.46 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -59.05 -23.31 68.2 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.628 2.218 . . . . 10.0 112.377 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -77.49 -7.07 55.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.246 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -94.36 0.2 55.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.8 0.333 . . . . 10.0 110.476 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 43.6 mtt85 -62.88 158.84 18.04 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.151 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 16.7 m -134.8 -19.21 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.908 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -84.93 175.77 8.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.218 0.532 . . . . 10.0 111.654 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.43 -179.19 5.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.6 -0.727 . . . . 10.0 109.67 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -61.73 129.75 42.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.026 0.441 . . . . 10.0 111.05 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 22.3 mt -84.11 63.51 7.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.387 0.613 . . . . 10.0 110.154 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -80.3 -53.42 6.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.738 -0.665 . . . . 10.0 112.03 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -130.97 137.58 49.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.981 0.42 . . . . 10.0 111.416 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.592 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . . . -133.13 121.3 22.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.416 -0.811 . . . . 10.0 109.703 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 57.7 tp -122.91 113.48 19.16 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 9.0 p -97.0 139.34 19.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.594 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.73 -27.61 62.15 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.591 -179.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' GLU . . . . . 0.545 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 4.4 tp10 -145.76 134.09 21.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.113 0.482 . . . . 10.0 110.954 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 3.4 m -102.37 -17.95 6.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.335 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -60.04 -68.41 0.29 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.52 -0.764 . . . . 10.0 111.574 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.58 22.57 1.28 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.561 0.578 . . . . 10.0 112.561 -178.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 45.4 mt -138.05 -66.22 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 112.545 0.572 . . . . 10.0 112.545 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 27.0 mt -70.28 -46.05 65.12 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.495 0.554 . . . . 10.0 112.495 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 50.8 mm -85.51 -47.36 16.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.882 -0.327 . . . . 10.0 111.759 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.98 -59.63 2.79 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -178.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -85.38 46.59 1.31 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.005 0.431 . . . . 10.0 111.78 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -76.51 -53.19 8.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.389 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 220' ' ' ARG . . . . . 0.447 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 0.2 OUTLIER -105.85 46.68 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.227 0.537 . . . . 10.0 110.837 -179.08 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 2.9 m -107.55 102.44 44.52 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.583 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -88.83 132.44 2.41 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.802 2.335 . . . . 10.0 113.578 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 223' ' ' LEU . . . . . . . . . . . . . 96.7 mt -82.62 93.12 7.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.147 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 29.2 mt -92.74 125.8 45.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.051 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 225' ' ' ILE . . . . . 0.423 ' HB ' HD22 ' A' ' 372' ' ' LEU . 2.6 mt -127.88 144.19 38.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.416 -0.587 . . . . 10.0 109.416 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 226' ' ' SER . . . . . 0.446 ' HA ' ' O ' ' A' ' 370' ' ' GLN . 1.2 m -87.63 155.07 20.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.522 0.201 . . . . 10.0 110.699 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -86.41 164.08 36.13 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.018 -0.61 . . . . 10.0 113.201 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -84.95 -19.27 4.0 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.784 2.323 . . . . 10.0 113.3 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 229' ' ' ALA . . . . . 0.537 ' O ' ' HA ' ' B' ' 21' ' ' VAL . . . -118.27 47.23 1.64 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 10.0 111.559 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . 0.433 ' HB3' ' HB2' ' A' ' 368' ' ' GLU . 49.4 mm-40 -70.33 171.47 9.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.901 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -71.43 138.55 49.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 110.021 -0.362 . . . . 10.0 110.021 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 7.0 m -128.1 -34.21 2.13 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.974 179.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 49.2 m -166.12 58.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.024 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -155.68 -58.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.305 -0.558 . . . . 10.0 112.39 179.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -60.23 3.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.543 0.211 . . . . 10.0 111.127 -178.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -64.57 -27.66 69.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.917 0.389 . . . . 10.0 110.57 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 12.4 ttmt -66.2 -41.87 89.57 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.481 -0.563 . . . . 10.0 109.481 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 7.8 tpp180 -68.04 -33.05 73.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.746 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 77.2 t -67.83 -46.4 82.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.813 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -77.71 -5.29 50.06 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.228 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 5.4 tptt -70.46 -21.02 62.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.316 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 15.2 tt -89.06 -14.07 9.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.89 0.376 . . . . 10.0 111.203 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 243' ' ' ILE . . . . . 0.513 ' N ' ' HD2' ' A' ' 244' ' ' PRO . 48.2 mm -61.39 -49.59 86.92 Favored Pre-proline 0 CA--C 1.54 0.582 0 N-CA-C 113.247 0.832 . . . . 10.0 113.247 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 244' ' ' PRO . . . . . 0.513 ' HD2' ' N ' ' A' ' 243' ' ' ILE . 19.0 Cg_endo -59.58 -10.91 12.53 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 122.332 2.021 . . . . 10.0 113.337 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -88.16 -24.39 23.35 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.863 0.363 . . . . 10.0 110.218 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 246' ' ' LEU . . . . . 0.486 HD21 ' OD1' ' A' ' 253' ' ' ASP . 13.7 mt -73.18 139.32 46.23 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.673 -0.694 . . . . 10.0 112.567 -177.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 3.8 mt -127.69 105.18 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 108.368 -0.975 . . . . 10.0 108.368 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 248' ' ' ARG . . . . . 0.6 ' HA ' ' O ' ' A' ' 253' ' ' ASP . 7.1 ttt180 -42.36 106.8 0.07 Allowed 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 112.827 0.677 . . . . 10.0 112.827 -178.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 29.7 tp60 -179.55 -61.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.222 -0.899 . . . . 10.0 110.152 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -162.71 -166.48 1.34 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . 0.4 ' O ' ' HB2' ' A' ' 252' ' ' GLU . 62.4 mttm 60.55 40.25 17.07 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 123.306 0.378 . . . . 10.0 111.283 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 252' ' ' GLU . . . . . 0.485 ' OE2' ' HB3' ' A' ' 281' ' ' LEU . 6.0 mm-40 78.4 -11.15 1.24 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.034 0.934 . . . . 10.0 111.009 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 253' ' ' ASP . . . . . 0.6 ' O ' ' HA ' ' A' ' 248' ' ' ARG . 15.8 m-20 -78.12 53.54 1.22 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.991 0.424 . . . . 10.0 110.045 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.11 143.95 26.34 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.377 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . 0.43 ' HG2' ' HG1' ' A' ' 256' ' ' THR . 0.7 OUTLIER -89.68 -22.07 22.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.213 0.53 . . . . 10.0 109.659 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 256' ' ' THR . . . . . 0.43 ' HG1' ' HG2' ' A' ' 255' ' ' GLU . 1.0 OUTLIER -142.77 -92.97 0.12 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.04 178.696 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 46.35 -113.22 0.43 Allowed 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.918 0.761 . . . . 10.0 111.517 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 57.67 31.29 20.17 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 122.817 0.447 . . . . 10.0 111.98 179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 111.56 -59.83 0.35 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.824 -0.703 . . . . 10.0 112.551 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.25 -71.63 0.46 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.874 0.369 . . . . 10.0 111.191 -179.558 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 75.82 -127.17 8.82 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.651 -0.785 . . . . 10.0 112.267 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -175.66 143.63 0.62 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.935 -0.765 . . . . 10.0 108.935 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -64.0 145.64 55.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.601 -0.518 . . . . 10.0 109.601 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 1.7 p -53.34 108.93 0.38 Allowed 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.515 0.51 . . . . 10.0 112.208 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 9.8 p -160.76 29.5 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.893 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 37.8 t70 69.58 43.03 1.04 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 122.471 1.129 . . . . 10.0 108.17 -178.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 10.9 pm0 -71.36 125.73 27.77 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.337 -1.302 . . . . 10.0 110.768 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 268' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -133.48 146.03 50.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.461 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 3.6 m -76.89 67.6 2.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.007 0.432 . . . . 10.0 110.745 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 270' ' ' ARG . . . . . 0.503 HH21 ' CD ' ' A' ' 338' ' ' GLU . 16.0 tpt180 -67.81 -26.66 66.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.672 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -93.2 3.4 55.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.027 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 58.5 t 67.64 -77.99 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.801 -179.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 4.9 m120 68.22 -64.51 0.29 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.605 0.762 . . . . 10.0 112.402 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 28.3 tp 72.26 -65.87 0.33 Allowed 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.448 0.699 . . . . 10.0 110.325 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 275' ' ' THR . . . . . 0.483 HG21 ' NE ' ' A' ' 277' ' ' ARG . 2.2 m 73.51 -57.24 0.63 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.372 0.669 . . . . 10.0 112.07 179.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 63.33 108.69 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.095 0.776 . . . . 10.0 113.095 178.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 277' ' ' ARG . . . . . 0.483 ' NE ' HG21 ' A' ' 275' ' ' THR . 6.1 ptp180 178.06 167.83 0.75 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.066 177.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.403 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . 124.11 -48.99 0.92 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.791 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 278' ' ' GLY . 15.0 mt 69.97 -63.18 0.4 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.446 0.698 . . . . 10.0 112.226 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.67 -26.69 32.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.165 0.507 . . . . 10.0 111.066 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 281' ' ' LEU . . . . . 0.485 ' HB3' ' OE2' ' A' ' 252' ' ' GLU . 5.5 mp -67.72 -52.32 39.09 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.798 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 13.1 tt -65.94 -18.35 23.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.691 -179.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -63.87 -25.92 68.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.987 0.423 . . . . 10.0 110.68 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -90.19 -24.98 20.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.534 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 19.1 tp -77.35 -36.74 53.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.068 0.461 . . . . 10.0 110.341 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 48.3 mt -71.95 -179.45 2.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.551 -0.749 . . . . 10.0 111.634 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 287' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 293' ' ' ASP . 2.9 t 64.36 169.32 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-N 115.503 -0.771 . . . . 10.0 111.304 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 77.03 152.16 0.13 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.984 0.914 . . . . 10.0 112.738 178.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 289' ' ' GLU . . . . . 0.434 ' CD ' ' HZ3' ' B' ' 7' ' ' LYS . 11.5 mm-40 69.14 -70.63 0.13 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 114.814 -1.085 . . . . 10.0 113.012 179.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . 170.34 161.75 21.43 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.696 -0.764 . . . . 10.0 111.767 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 291' ' ' ILE . . . . . . . . . . . . . 32.1 mt 72.45 -66.19 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 123.04 0.536 . . . . 10.0 110.19 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -73.77 -13.47 60.96 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.489 -0.559 . . . . 10.0 109.489 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 293' ' ' ASP . . . . . 0.497 ' HA ' ' HA ' ' A' ' 287' ' ' VAL . 0.6 OUTLIER -79.19 -9.32 59.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.173 -179.622 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.55 -20.51 62.79 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.131 0.491 . . . . 10.0 110.677 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 91.14 50.77 2.74 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.782 -0.723 . . . . 10.0 111.391 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -127.57 173.39 9.92 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.28 171.38 15.26 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.283 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . 0.614 ' O ' ' HB2' ' A' ' 307' ' ' MET . 18.2 tp -101.93 -35.23 9.06 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.014 0.435 . . . . 10.0 110.198 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -98.46 24.57 7.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.802 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 1.8 p -76.91 160.4 76.57 Favored Pre-proline 0 C--N 1.326 -0.422 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -56.44 -20.2 32.12 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.903 2.402 . . . . 10.0 113.605 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -96.84 -47.53 5.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.759 0.314 . . . . 10.0 111.585 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -86.43 9.11 19.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.022 0.439 . . . . 10.0 111.581 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 8.9 tp -59.42 -26.13 33.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.621 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 13.3 tmm? -63.62 -46.03 87.6 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.08 -41.41 81.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.09 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 307' ' ' MET . . . . . 0.614 ' HB2' ' O ' ' A' ' 298' ' ' LEU . 17.6 tpt -54.3 -49.36 69.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.17 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -69.42 -24.2 63.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.26 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 2.9 m170 -80.69 -38.54 28.74 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.083 -0.247 . . . . 10.0 111.173 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 28.9 m -70.01 -25.1 27.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 109.899 -0.408 . . . . 10.0 109.899 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 32.7 m -62.86 -34.21 76.88 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.273 0.558 . . . . 10.0 109.571 178.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 312' ' ' ALA . . . . . 0.435 ' HA ' ' HG2' ' A' ' 315' ' ' ARG . . . -65.2 -36.77 85.24 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.546 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -70.98 -36.84 72.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.725 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 5.3 mp -67.82 -48.39 66.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.641 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 315' ' ' ARG . . . . . 0.435 ' HG2' ' HA ' ' A' ' 312' ' ' ALA . 4.8 ptp85 -63.43 -28.93 70.31 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.766 0.317 . . . . 10.0 110.547 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -73.82 -3.8 30.89 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.771 0.285 . . . . 10.0 111.771 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -119.71 -2.19 10.45 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.016 0.376 . . . . 10.0 112.016 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -135.97 -37.7 0.72 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.927 -0.309 . . . . 10.0 111.812 -179.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -88.29 -37.92 15.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.18 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -105.57 106.08 16.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.046 0.45 . . . . 10.0 111.502 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.41 130.01 46.45 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.148 179.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 322' ' ' ARG . . . . . 0.443 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 33.2 ttp180 -71.96 153.23 41.95 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 121.023 -0.271 . . . . 10.0 110.892 -179.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 323' ' ' ASP . . . . . 0.443 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 6.3 m-20 75.13 8.37 4.03 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.864 0.727 . . . . 10.0 111.538 178.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 4.8 p -148.85 -47.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.628 -0.26 . . . . 10.0 110.606 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -91.08 -30.12 16.93 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.392 0.615 . . . . 10.0 110.018 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -154.43 150.53 27.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.598 -0.728 . . . . 10.0 109.706 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 18.4 tt -125.2 125.24 68.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-O 121.214 0.53 . . . . 10.0 110.372 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 38.3 t -94.08 101.79 12.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.026 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 329' ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' A' ' 329' ' ' LYS . 3.1 ptmm? -110.04 106.53 16.07 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.843 0.354 . . . . 10.0 110.598 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 39.35 61.96 1.24 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.191 -0.913 . . . . 10.0 113.246 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 93.28 -39.51 2.95 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.889 -0.672 . . . . 10.0 113.991 178.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -81.72 118.63 23.0 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.137 0.494 . . . . 10.0 111.828 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 42.9 t -96.98 99.12 8.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.716 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 68.5 mt -91.45 135.04 28.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.899 -0.592 . . . . 10.0 110.711 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 5.2 mp -84.85 132.86 30.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 13.8 t -111.71 126.84 69.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.031 0.443 . . . . 10.0 110.96 -179.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -72.78 119.49 17.08 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.965 179.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 338' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 338' ' ' GLU . 4.8 tt0 -72.98 -9.66 58.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.922 -0.581 . . . . 10.0 112.507 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -81.6 -49.72 10.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.863 -0.523 . . . . 10.0 111.967 -178.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.38 14.5 6.09 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.775 0.657 . . . . 10.0 112.775 -178.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 61.93 53.49 42.58 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.498 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -100.89 117.46 35.0 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.667 0.27 . . . . 10.0 111.128 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.24 105.19 14.0 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.376 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 62.6 mtm -112.23 104.94 13.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.875 0.369 . . . . 10.0 111.038 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -78.45 -36.92 44.78 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.604 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -87.85 63.75 3.76 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.854 -0.688 . . . . 10.0 112.134 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -137.97 106.28 5.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.802 0.334 . . . . 10.0 110.414 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -100.14 116.49 32.27 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.984 0.421 . . . . 10.0 111.029 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -98.92 131.57 44.9 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.074 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.4 m -79.42 -173.79 3.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.608 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 12.5 t70 58.72 23.06 10.69 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.361 0.664 . . . . 10.0 111.561 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 60.03 31.24 72.05 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.823 -0.626 . . . . 10.0 112.703 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.59 -47.62 66.79 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.127 0.417 . . . . 10.0 112.127 -179.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 354' ' ' HIS . . . . . 0.447 ' O ' ' HB ' ' A' ' 357' ' ' VAL . 20.2 p80 -112.12 5.13 18.39 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.436 -0.506 . . . . 10.0 111.572 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 355' ' ' GLN . . . . . 0.401 ' NE2' ' HA ' ' A' ' 355' ' ' GLN . 0.5 OUTLIER -68.05 -38.93 83.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.02 0.438 . . . . 10.0 110.716 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -74.16 -17.75 60.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.22 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 357' ' ' VAL . . . . . 0.447 ' HB ' ' O ' ' A' ' 354' ' ' HIS . 54.2 t -67.49 -39.05 81.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.685 179.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.414 ' CB ' ' HA ' ' A' ' 365' ' ' ILE . 1.8 mt-10 -62.59 -32.99 74.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.61 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -83.13 -26.44 30.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.305 0.574 . . . . 10.0 110.653 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 70.0 tttt -71.17 -41.9 69.78 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.261 -0.882 . . . . 10.0 110.474 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -91.87 -170.2 2.49 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.058 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -101.19 64.43 0.52 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.827 -0.701 . . . . 10.0 111.797 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 5.9 m -137.73 -166.19 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.698 0.285 . . . . 10.0 110.653 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -108.82 134.03 52.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.689 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 365' ' ' ILE . . . . . 0.414 ' HA ' ' CB ' ' A' ' 358' ' ' GLU . 2.9 mt -69.61 140.38 18.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 179.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -65.6 158.77 26.3 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.745 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -76.24 57.78 1.18 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.947 -179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 368' ' ' GLU . . . . . 0.433 ' HB2' ' HB3' ' A' ' 230' ' ' GLU . 1.4 tm-20 45.64 -152.54 0.05 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.494 0.717 . . . . 10.0 111.472 -179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -157.64 -32.16 0.08 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.633 0.254 . . . . 10.0 111.337 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 370' ' ' GLN . . . . . 0.446 ' O ' ' HA ' ' A' ' 226' ' ' SER . 0.0 OUTLIER -117.92 -110.72 0.35 Allowed 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.678 -0.409 . . . . 10.0 111.738 -179.241 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 57.04 -147.68 0.52 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 122.981 0.512 . . . . 10.0 112.042 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 372' ' ' LEU . . . . . 0.423 HD22 ' HB ' ' A' ' 225' ' ' ILE . 23.4 tp 55.57 -97.2 0.07 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.983 0.913 . . . . 10.0 112.471 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -164.1 172.32 13.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.705 0.288 . . . . 10.0 110.735 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 374' ' ' SER . . . . . . . . . . . . . 8.8 t -164.22 161.84 22.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.239 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.6 tt -157.73 148.46 9.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.38 . . . . 10.0 110.489 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.14 143.06 29.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.619 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -56.06 -50.64 70.4 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 123.126 0.266 . . . . 10.0 111.356 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -53.45 -47.64 69.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.101 -0.499 . . . . 10.0 111.402 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -67.18 -31.11 71.28 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.202 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -70.27 -41.42 73.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.509 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -72.78 -19.26 61.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.047 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 72.1 mtp180 -77.12 -5.85 50.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.735 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 47.1 mt -96.79 7.58 46.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.798 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.592 ' CD2' ' HB3' ' A' ' 206' ' ' ALA . 21.2 m-85 -99.51 151.36 21.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.733 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -78.95 -76.36 0.2 Allowed 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 76.1 mttt -90.41 90.3 7.97 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 57.7 tp -95.73 109.55 21.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.768 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -125.66 154.08 42.88 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.692 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -155.24 143.97 10.5 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.539 -0.839 . . . . 10.0 112.192 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 390' ' ' MET . . . . . 0.494 ' SD ' ' HD2' ' A' ' 108' ' ' LYS . 33.4 ttm -114.0 128.93 56.61 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 5.7 t -122.75 -175.35 3.14 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 121.147 -0.221 . . . . 10.0 110.574 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 392' ' ' GLY . . . . . 0.417 ' HA3' ' O ' ' A' ' 102' ' ' MET . . . -103.4 165.54 15.8 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 110.979 -0.848 . . . . 10.0 110.979 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 393' ' ' THR . . . . . 0.451 ' OG1' ' HA ' ' A' ' 103' ' ' ARG . 1.0 OUTLIER -62.17 103.46 0.38 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.845 0.355 . . . . 10.0 111.074 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -151.61 -27.97 0.18 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.471 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 18.2 t70 54.39 -118.93 1.38 Allowed 'General case' 0 CA--C 1.535 0.377 0 O-C-N 123.374 0.421 . . . . 10.0 110.318 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 4.7 m 64.74 -96.66 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -81.62 36.87 0.45 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.912 0.387 . . . . 10.0 111.452 -178.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -64.5 -20.14 66.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.081 0.467 . . . . 10.0 110.961 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -81.74 -24.73 35.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.128 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -65.44 -38.3 89.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.733 0.302 . . . . 10.0 110.983 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -57.97 -47.26 83.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.171 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 4.9 m -75.83 -9.19 58.4 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.503 0.557 . . . . 10.0 112.503 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.2 m -102.77 -53.24 2.9 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.01 0.374 . . . . 10.0 112.01 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 60.3 mt -82.58 -50.41 15.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 112.809 0.67 . . . . 10.0 112.809 -177.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -94.97 -8.82 35.82 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm 62.09 43.34 8.91 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.834 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 407' ' ' LEU . . . . . 0.567 ' CD2' ' HG2' ' A' ' 97' ' ' ARG . 14.6 mt -117.66 140.92 49.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.36 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -88.98 128.85 35.71 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 110.067 -0.345 . . . . 10.0 110.067 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 2.1 m -87.13 101.2 13.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.984 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 38.2 t -96.57 133.86 36.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.607 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 15.3 t -88.68 122.23 39.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.934 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 48.6 t -87.22 130.15 48.95 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.219 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.83 150.21 86.06 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.719 2.279 . . . . 10.0 112.336 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 17.4 p -79.83 157.73 26.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.881 -0.599 . . . . 10.0 111.426 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -66.75 -40.46 88.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.334 0.588 . . . . 10.0 109.708 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 69.5 mtm180 -125.49 153.47 72.51 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.764 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -63.46 117.93 4.87 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.368 2.045 . . . . 10.0 111.413 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 30.9 mtm -66.33 114.14 5.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.557 -179.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 419' ' ' ILE . . . . . 0.455 ' HB ' ' HA ' ' A' ' 581' ' ' ALA . 0.7 OUTLIER -96.37 41.89 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.317 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -81.37 101.11 9.61 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.441 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -76.98 100.16 5.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.482 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -80.03 131.51 35.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.797 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 40.2 mt -116.04 149.14 42.87 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -62.47 169.21 8.54 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 122.85 2.367 . . . . 10.0 113.712 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -86.54 116.12 24.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.374 -0.83 . . . . 10.0 109.857 179.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 25.2 mt -92.28 88.22 6.37 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.181 0.515 . . . . 10.0 110.273 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 15.8 t -83.38 125.18 40.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.474 -0.785 . . . . 10.0 110.11 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 428' ' ' TYR . . . . . 0.548 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 10.2 m-85 -111.99 179.5 3.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.511 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 4.3 mmt -70.53 -75.86 0.11 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.909 0.385 . . . . 10.0 111.923 -178.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 41.1 p -90.58 165.62 13.65 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.71 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 431' ' ' GLU . . . . . 0.408 ' HG3' ' HE2' ' A' ' 434' ' ' LYS . 8.0 tt0 -67.32 -26.88 66.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.547 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -61.1 -44.5 97.26 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.031 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -63.21 -40.83 98.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.572 -0.74 . . . . 10.0 110.21 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 434' ' ' LYS . . . . . 0.439 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 39.7 ttpt -59.72 -50.54 73.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.468 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 48.5 mm -65.44 -43.7 94.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.859 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -39.69 89.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.746 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.87 -33.92 76.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.026 0.441 . . . . 10.0 110.441 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 89.1 mt -66.23 -45.49 89.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.688 178.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.38 -36.38 74.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.348 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -64.04 -45.54 88.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.378 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -61.76 -40.77 96.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.469 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 78.7 mt -72.13 -38.03 61.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.901 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 14.2 tttm -53.01 -38.68 62.55 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.918 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.49 ' O ' ' HE2' ' A' ' 448' ' ' LYS . 61.8 mm-40 -78.0 -45.05 24.83 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.918 0.39 . . . . 10.0 111.959 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 43.1 mtt-85 -68.14 -29.89 68.89 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 -177.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 1.6 p -68.69 -35.05 76.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.134 0.492 . . . . 10.0 110.268 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.97 -15.01 49.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.49 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' LYS . . . . . 0.49 ' HE2' ' O ' ' A' ' 444' ' ' GLU . 0.2 OUTLIER -90.46 -31.44 16.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.627 179.804 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 105.57 23.55 7.49 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.766 -0.731 . . . . 10.0 112.964 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -104.64 127.76 28.27 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.896 0.348 . . . . 10.0 110.887 -179.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' PRO . . . . . 0.414 ' HB3' ' O ' ' A' ' 496' ' ' TYR . 38.2 Cg_endo -68.25 140.01 47.64 Favored 'Trans proline' 0 C--O 1.237 0.466 0 C-N-CA 122.625 2.217 . . . . 10.0 111.372 178.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 77.4 t -125.28 130.78 72.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.086 0.47 . . . . 10.0 111.695 -178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 55.8 tp -114.66 106.61 14.44 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 40.9 t -92.73 117.82 36.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.508 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -96.89 127.75 9.31 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.597 -0.811 . . . . 10.0 111.738 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 10.1 p -120.61 137.0 54.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.589 0.233 . . . . 10.0 110.556 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 34.5 pt -93.6 -25.61 4.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.053 0.454 . . . . 10.0 110.486 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 4.0 p -115.62 133.54 55.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.102 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 20.5 mt -62.79 -32.84 57.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.256 0.55 . . . . 10.0 110.22 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -59.57 -35.03 73.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.606 -0.724 . . . . 10.0 110.577 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . 0.545 ' HZ3' ' CD ' ' A' ' 560' ' ' GLU . 0.0 OUTLIER -77.91 -32.33 51.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.773 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.4 m -61.25 -42.55 98.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.049 0.452 . . . . 10.0 110.089 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -70.68 -35.45 72.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.179 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.64 -51.6 54.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.79 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 14.2 p -62.51 -35.44 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.71 0.29 . . . . 10.0 110.743 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 60.3 m -65.71 -39.74 91.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.574 -0.284 . . . . 10.0 110.407 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -58.46 -43.26 88.79 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.957 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -71.44 -35.42 70.92 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.64 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 47.5 mt -65.6 -44.22 87.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.553 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 3.1 m -67.8 -30.31 69.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.202 0.525 . . . . 10.0 109.886 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -66.1 -38.78 89.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.395 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -84.96 -3.09 58.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.986 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 72.83 36.24 57.91 Favored Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.88 -0.6 . . . . 10.0 112.483 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 88.5 mt -104.42 123.61 58.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 120.622 0.249 . . . . 10.0 110.67 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -64.21 139.37 58.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.403 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -159.8 145.04 15.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.918 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -117.17 125.47 51.25 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 4.5 t -100.08 140.23 19.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.158 -179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 90.3 mt -94.02 151.61 19.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.101 -0.5 . . . . 10.0 109.752 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -161.71 130.12 4.29 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -58.18 -19.6 34.52 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -80.46 -6.83 58.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.938 0.399 . . . . 10.0 110.723 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' PHE . . . . . 0.43 ' O ' ' HG3' ' A' ' 487' ' ' GLU . 54.6 m-85 -131.07 45.96 2.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.45 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 9.2 m80 -51.32 -41.1 60.31 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.896 -179.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -63.64 -30.91 71.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.846 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -81.81 -38.12 26.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.918 0.39 . . . . 10.0 110.395 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 483' ' ' PHE . 53.8 mt-10 -55.6 -37.41 68.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.27 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -54.66 -41.48 70.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.592 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.26 -29.14 42.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.986 0.422 . . . . 10.0 111.092 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.1 mt -73.22 -53.3 18.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.308 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 68.6 t -60.48 -35.49 63.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.949 0.404 . . . . 10.0 111.239 -179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -64.08 -26.33 68.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.363 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -115.8 19.07 15.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.822 0.344 . . . . 10.0 110.888 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.74 -17.32 62.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.056 0.455 . . . . 10.0 111.045 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -93.89 8.65 73.5 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.851 -0.69 . . . . 10.0 112.086 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' TYR . . . . . 0.414 ' O ' ' HB3' ' A' ' 451' ' ' PRO . 61.7 t80 -68.72 138.55 90.76 Favored Pre-proline 0 C--N 1.325 -0.465 0 N-CA-C 110.271 -0.27 . . . . 10.0 110.271 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.84 128.13 29.16 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.642 2.228 . . . . 10.0 112.682 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.61 14.18 8.23 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.561 -0.745 . . . . 10.0 112.808 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.92 133.76 34.59 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.879 0.371 . . . . 10.0 110.351 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 25.9 t -111.62 113.45 44.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.375 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.9 m -111.79 134.17 53.53 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.502 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 80.1 mt -111.63 117.62 55.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.787 0.327 . . . . 10.0 110.133 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -97.9 121.3 39.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.087 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 2.7 m -98.94 109.72 22.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.868 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 55.81 67.33 1.02 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.391 0.615 . . . . 10.0 111.002 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 38.6 tpp -76.3 128.57 35.15 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.699 -0.682 . . . . 10.0 111.136 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -76.68 179.75 5.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.789 -0.642 . . . . 10.0 111.448 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -68.59 160.82 51.44 Favored Glycine 0 CA--C 1.52 0.402 0 CA-C-N 116.029 -0.532 . . . . 10.0 113.357 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.545 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 99.1 mtt180 65.15 -82.72 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.54 0.736 . . . . 10.0 111.895 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 81.07 155.75 13.26 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.961 -0.638 . . . . 10.0 112.717 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.05 154.28 41.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.77 0.319 . . . . 10.0 111.009 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -75.66 109.9 9.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.367 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 45.9 mt -78.47 118.42 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.157 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 2.7 t -86.65 128.65 39.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.805 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 60.7 mt -74.05 133.31 42.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.33 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 83.78 15.72 69.76 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.274 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 95.43 -170.54 28.53 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.629 -0.796 . . . . 10.0 111.475 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 2.8 p -134.1 94.58 3.27 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.944 0.372 . . . . 10.0 110.896 -179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 21.9 p-90 -56.57 -30.07 62.75 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.826 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -61.25 -40.66 94.9 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.986 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.37 -24.55 39.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.972 0.415 . . . . 10.0 110.873 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -77.43 -46.87 21.27 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.98 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 33.8 m -69.62 -26.41 30.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.861 0.362 . . . . 10.0 110.94 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -84.79 -5.61 59.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.432 . . . . 10.0 110.78 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -89.65 -9.73 48.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.481 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 11.2 mt -82.16 158.33 23.67 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.311 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.99 -28.87 32.39 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 178.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -146.75 92.35 5.07 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.461 -0.791 . . . . 10.0 109.759 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.5 92.48 1.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.449 2.1 . . . . 10.0 112.688 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -75.09 153.96 38.09 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.205 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -57.11 -35.68 69.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.979 0.419 . . . . 10.0 110.915 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -66.81 -43.95 82.46 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.15 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -69.12 -40.63 78.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.925 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.19 -44.08 94.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.32 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.55 -39.78 94.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.355 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -59.95 -53.37 58.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.736 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 94.0 mt -63.66 -39.1 84.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.74 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -61.97 -41.19 97.73 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.263 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.48 86.01 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.372 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . 0.584 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 40.7 m-20 -60.69 -46.21 91.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.777 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' TRP . . . . . 0.415 ' CZ2' ' HD2' ' A' ' 545' ' ' HIS . 70.6 t90 -58.58 -41.03 84.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.318 -0.856 . . . . 10.0 110.558 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -58.37 -43.54 88.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.622 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.84 -45.03 96.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.149 0.499 . . . . 10.0 110.019 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 544' ' ' ARG . . . . . 0.584 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 14.6 mtm180 -63.68 -38.96 93.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.547 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 545' ' ' HIS . . . . . 0.415 ' HD2' ' CZ2' ' A' ' 541' ' ' TRP . 6.3 t-80 -66.25 -39.41 89.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.094 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -66.24 -40.03 89.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.157 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -58.85 -43.44 90.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.876 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 65.1 t -62.57 -35.89 72.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.79 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 99.7 mt -64.33 -43.66 93.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.005 0.431 . . . . 10.0 110.225 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -71.14 -29.49 65.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.673 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -70.02 -35.74 74.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.951 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 129.49 18.08 1.67 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.484 -0.865 . . . . 10.0 113.04 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 75.31 -169.94 54.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.828 -0.701 . . . . 10.0 112.55 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . 0.426 ' HB3' ' OG ' ' A' ' 575' ' ' SER . 54.3 tp -75.5 126.08 30.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.928 0.394 . . . . 10.0 110.115 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -95.36 120.53 35.75 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.936 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 35.1 mm -98.04 128.3 49.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.596 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 557' ' ' ILE . . . . . 0.405 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 17.1 mt -119.34 125.75 74.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.384 . . . . 10.0 110.186 178.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -107.41 117.23 5.17 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.625 -0.798 . . . . 10.0 112.094 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 3.4 p -70.71 -48.12 56.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.539 0.685 . . . . 10.0 109.757 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . 0.545 ' CD ' ' HZ3' ' A' ' 461' ' ' LYS . 0.9 OUTLIER -140.55 140.07 35.13 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.608 -1.178 . . . . 10.0 108.676 178.754 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 77.8 mtt-85 -78.65 164.05 24.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.824 0.345 . . . . 10.0 110.18 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -86.98 153.26 21.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.198 -0.455 . . . . 10.0 109.839 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.89 -44.1 81.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.122 0.487 . . . . 10.0 110.026 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 58.7 m -99.53 142.23 31.28 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.488 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 565' ' ' ARG . . . . . 0.446 ' O ' ' HG3' ' A' ' 565' ' ' ARG . 0.0 OUTLIER -68.84 -27.88 66.23 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.538 -179.555 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -59.98 -51.22 70.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.107 0.479 . . . . 10.0 110.391 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 13.2 mt -72.59 -25.36 22.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.269 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -69.51 -50.62 43.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.069 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 17.1 m-20 -62.7 -37.67 87.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.03 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -58.86 -33.02 69.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.918 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 39.5 tp -78.49 -35.21 46.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.876 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -74.11 -30.43 62.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.898 0.38 . . . . 10.0 111.114 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.61 17.52 14.61 Favored Glycine 0 CA--C 1.521 0.426 0 C-N-CA 121.082 -0.58 . . . . 10.0 114.015 -178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -72.17 -41.59 66.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 117.595 0.697 . . . . 10.0 110.557 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 575' ' ' SER . . . . . 0.426 ' OG ' ' HB3' ' A' ' 554' ' ' LEU . 19.4 t -87.61 161.27 17.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.475 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 73.43 36.32 55.01 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.147 -0.549 . . . . 10.0 112.794 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -61.61 130.44 45.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.442 0.163 . . . . 10.0 111.027 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 578' ' ' GLN . . . . . 0.603 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 17.5 tt0 64.03 19.7 11.87 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.635 0.584 . . . . 10.0 111.23 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 87.41 51.34 3.33 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.634 -0.793 . . . . 10.0 112.821 179.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -105.76 -168.83 1.5 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.847 -0.208 . . . . 10.0 110.484 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . 0.455 ' HA ' ' HB ' ' A' ' 419' ' ' ILE . . . -88.45 155.23 19.79 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.122 0.487 . . . . 10.0 111.72 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 173.72 177.47 42.95 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.734 -0.667 . . . . 10.0 111.612 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.9 p -153.87 134.43 13.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.823 0.312 . . . . 10.0 110.614 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.88 124.05 49.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.596 -0.274 . . . . 10.0 111.078 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 585' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 3.6 tpm_? -131.19 115.92 17.0 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.951 -0.389 . . . . 10.0 109.951 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -114.5 151.14 33.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.015 0.436 . . . . 10.0 111.285 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 587' ' ' TYR . . . . . 0.439 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 86.4 m-85 -132.54 169.25 16.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.378 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 10.8 tp -168.22 162.16 12.65 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.169 0.293 . . . . 10.0 110.24 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -113.59 157.31 22.25 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.019 -0.363 . . . . 10.0 110.019 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 590' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 70.6 mmm -71.87 -14.21 61.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.162 0.506 . . . . 10.0 111.276 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -121.26 24.18 10.13 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.673 -0.694 . . . . 10.0 109.314 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -74.14 169.04 18.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.194 -0.912 . . . . 10.0 111.373 -179.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -69.18 -34.46 74.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 10.8 tp -69.87 -21.64 63.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.236 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 3.5 mmt -75.59 -5.86 47.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.097 0.475 . . . . 10.0 110.832 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -93.27 -11.08 33.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.461 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 19.0 pt -74.53 -8.79 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 121.138 0.495 . . . . 10.0 110.539 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -79.19 -10.15 59.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.522 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 72.88 -53.86 0.7 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.923 0.764 . . . . 10.0 111.512 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 31.1 t -89.58 134.84 33.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.498 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -85.01 -4.3 59.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.151 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.66 -33.93 75.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.327 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 21.4 t -65.39 -50.81 70.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.216 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 604' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 0.2 OUTLIER -63.42 -38.96 93.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.848 179.946 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -68.5 -30.37 73.14 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.822 -0.704 . . . . 10.0 112.639 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 41.0 tpp -81.42 -38.35 26.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.712 0.291 . . . . 10.0 111.27 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 46.9 mtt -66.63 -16.85 64.49 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.545 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 608' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 604' ' ' SER . 33.6 mtt180 -68.45 -15.58 63.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.896 0.379 . . . . 10.0 110.936 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -87.04 23.44 1.77 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.277 -0.42 . . . . 10.0 111.2 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 49.0 tp -93.08 -14.58 27.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.076 0.465 . . . . 10.0 110.589 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 611' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 92.13 -48.88 2.71 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.992 -0.623 . . . . 10.0 111.919 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 612' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.0 OUTLIER 73.55 -55.01 0.68 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.647 0.779 . . . . 10.0 112.01 179.057 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 15.3 mmtp 59.35 80.74 0.26 Allowed Pre-proline 0 N--CA 1.464 0.273 0 O-C-N 123.475 0.484 . . . . 10.0 111.847 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 614' ' ' PRO . . . . . 0.548 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 21.4 Cg_endo -62.9 95.29 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.629 2.22 . . . . 10.0 112.103 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 140.16 -24.2 2.69 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.21 -0.904 . . . . 10.0 111.03 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -114.38 113.56 24.69 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.73 -0.47 . . . . 10.0 109.73 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -66.32 110.4 3.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.827 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 4.5 tp -67.99 -30.4 48.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.734 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 43.55 74.85 0.11 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.615 0.766 . . . . 10.0 112.643 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -120.44 99.53 47.88 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.66 -26.43 72.71 Favored 'Trans proline' 0 N--CA 1.475 0.403 0 C-N-CA 123.494 2.796 . . . . 10.0 114.584 -178.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 43.3 p-90 -63.06 -24.72 68.04 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.837 -0.345 . . . . 10.0 111.523 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 65.9 t -63.2 -45.83 97.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-O 120.996 0.427 . . . . 10.0 110.115 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 51.6 m -62.08 -36.18 80.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.484 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -67.85 -38.27 82.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.289 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -64.68 -45.71 85.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.836 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 98.6 mt -65.46 -37.57 80.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.136 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -57.92 -41.01 81.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.002 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -70.75 -38.94 73.52 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.895 -0.409 . . . . 10.0 109.895 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.41 89.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.343 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -63.12 -42.24 99.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.076 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -61.9 -32.45 72.83 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.159 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 633' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 637' ' ' ARG . 43.1 mttm -63.75 -37.54 87.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.425 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 40.0 t -61.83 -47.81 91.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.99 -40.84 97.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.721 179.254 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 28.3 m -61.56 -35.3 77.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.349 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 637' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 633' ' ' LYS . 72.4 mtt180 -67.22 -48.71 67.03 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -60.46 -42.49 96.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.512 -0.767 . . . . 10.0 110.445 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -56.21 -44.32 79.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.745 -0.662 . . . . 10.0 110.762 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.6 -42.67 99.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.298 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 71.3 mt -58.77 -53.41 47.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.231 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 642' ' ' ARG . . . . . 0.461 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 0.0 OUTLIER -69.02 -27.92 66.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.643 0.259 . . . . 10.0 110.711 -179.792 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -66.78 -38.4 86.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.259 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -68.07 -32.01 72.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.033 0.444 . . . . 10.0 110.141 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 95.5 mt -71.53 -26.29 62.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.384 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 646' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 89.2 mt -62.69 -32.85 74.01 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.383 179.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -64.48 -13.53 52.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.855 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -107.3 -46.22 3.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.115 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -73.3 -29.28 62.6 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 -177.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -64.87 -34.78 79.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.038 0.447 . . . . 10.0 109.835 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 16.7 t -65.02 -43.07 96.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.738 -0.665 . . . . 10.0 109.917 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -64.06 -39.8 94.88 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.025 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -61.15 -43.57 98.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.174 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -61.32 -51.44 68.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.418 -0.81 . . . . 10.0 110.968 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -61.92 -42.89 99.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.797 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 656' ' ' ARG . . . . . 0.406 ' O ' ' HB2' ' A' ' 660' ' ' TYR . 2.6 ttp-105 -62.5 -36.12 81.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.325 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -63.9 -48.3 77.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.632 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.53 -50.22 68.19 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.851 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.48 -35.99 76.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 111.901 0.334 . . . . 10.0 111.901 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 660' ' ' TYR . . . . . 0.406 ' HB2' ' O ' ' A' ' 656' ' ' ARG . 2.9 m-30 -70.6 -35.62 73.09 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 9.9 t -62.23 -50.66 70.87 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -57.3 -43.59 83.34 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.431 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 38.7 ttt-85 -63.05 -41.84 99.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.613 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -65.82 -43.11 89.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.606 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -58.45 -50.1 74.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.245 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 26.8 mt -70.02 -16.12 63.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.171 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 12.1 tp -83.8 -46.04 12.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.662 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -68.73 -41.98 78.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.855 -0.611 . . . . 10.0 112.161 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 27.0 m -74.86 150.93 6.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.038 0.447 . . . . 10.0 111.191 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 1.5 m -94.29 -42.21 9.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.451 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -84.32 126.26 33.03 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.564 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 5.6 p -127.49 -0.68 3.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.004 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 673' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 677' ' ' ASN . 0.8 OUTLIER -52.65 -45.51 66.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.348 -0.842 . . . . 10.0 112.364 -178.66 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -62.34 -46.25 89.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.591 0.234 . . . . 10.0 111.586 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 3.9 m -63.57 -46.84 84.05 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.767 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 36.4 mm -65.27 -37.96 81.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.99 0.424 . . . . 10.0 110.856 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . 0.442 ' HB2' ' O ' ' A' ' 673' ' ' SER . 5.5 t30 -68.53 -40.23 80.83 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.58 -0.282 . . . . 10.0 111.316 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 29.0 m -62.77 -42.27 99.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.748 0.308 . . . . 10.0 111.142 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 27.1 pt -77.44 -21.04 14.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.677 -0.409 . . . . 10.0 110.844 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 10.7 mtm-85 -59.53 -46.37 89.05 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.04 0.448 . . . . 10.0 110.144 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -65.81 -44.59 85.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.565 -0.743 . . . . 10.0 110.931 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -62.62 -47.4 83.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.245 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 41.2 t -61.18 -44.95 99.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.767 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -62.74 -42.36 99.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.655 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 54.8 tttm -63.25 -48.32 78.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.559 -0.292 . . . . 10.0 110.325 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.85 -40.6 84.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.209 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 30.0 m -64.72 -43.33 93.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.195 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.68 -39.92 84.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.353 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -61.85 -18.17 59.1 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.254 -0.43 . . . . 10.0 112.143 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -79.26 -14.2 59.18 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.852 0.358 . . . . 10.0 111.495 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -127.14 -24.54 3.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.958 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 69.4 mt -129.72 101.03 18.81 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.579 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.12 140.39 71.45 Favored 'Trans proline' 0 N--CA 1.464 -0.233 0 C-N-CA 122.518 2.145 . . . . 10.0 111.494 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -52.28 113.8 1.37 Allowed 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.897 2.398 . . . . 10.0 112.823 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 56.71 67.77 0.95 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.391 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 6.0 p -118.9 -172.32 2.27 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.914 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 35.9 mt -83.5 154.89 23.64 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.769 -0.456 . . . . 10.0 109.769 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -57.71 -34.32 69.34 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 120.937 0.399 . . . . 10.0 111.69 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -74.34 -6.3 47.29 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.288 -0.414 . . . . 10.0 111.882 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.22 8.75 40.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.839 0.352 . . . . 10.0 110.234 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 701' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -101.43 108.13 19.64 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.966 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -83.72 82.78 8.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.364 0.602 . . . . 10.0 109.414 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 703' ' ' ILE . . . . . 0.486 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 43.0 mm -60.86 -50.22 85.95 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.201 -0.909 . . . . 10.0 111.956 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 704' ' ' PRO . . . . . 0.486 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 47.7 Cg_exo -56.27 -47.45 24.28 Favored 'Trans proline' 0 C--N 1.36 1.138 0 C-N-CA 122.052 1.834 . . . . 10.0 112.561 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -60.67 -40.67 98.3 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.448 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 61.1 tp -70.47 -45.89 64.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.389 0.138 . . . . 10.0 111.006 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -59.19 -51.23 70.87 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.357 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -59.71 -35.72 75.08 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.826 0.346 . . . . 10.0 110.771 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -65.5 -45.92 81.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.277 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 79.5 mt -64.87 -38.19 90.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.135 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.88 -36.22 72.69 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.695 0.628 . . . . 10.0 112.695 -179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -92.68 -44.48 8.54 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -177.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 713' ' ' ASP . . . . . 0.663 ' O ' ' HE3' ' A' ' 828' ' ' LYS . 0.8 OUTLIER -89.27 -31.51 17.83 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 -177.547 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -106.15 -4.22 20.55 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.057 -0.657 . . . . 10.0 112.079 -178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 25.6 t70 57.67 28.72 16.19 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.326 0.584 . . . . 10.0 110.526 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 43.8 tp -118.96 129.79 55.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.09 -0.505 . . . . 10.0 111.662 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -97.68 128.13 44.14 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.492 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 11.8 mt -140.0 122.11 9.87 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 120.782 0.325 . . . . 10.0 111.695 -179.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -81.81 60.86 7.72 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.859 2.373 . . . . 10.0 111.675 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 52.8 mt -63.48 -42.63 96.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.383 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -67.04 -31.67 72.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.207 0.527 . . . . 10.0 110.474 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -88.7 6.86 36.55 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.905 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -106.11 -54.1 2.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.857 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 77.8 mt -63.68 -23.45 67.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.756 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 725' ' ' ASP . . . . . 0.467 ' OD1' ' HG3' ' A' ' 726' ' ' LYS . 0.0 OUTLIER -78.59 -11.79 59.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.942 -179.76 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 726' ' ' LYS . . . . . 0.467 ' HG3' ' OD1' ' A' ' 725' ' ' ASP . 50.6 mttp -111.71 -48.63 3.05 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.01 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -120.64 94.71 48.93 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.26 0.553 . . . . 10.0 110.817 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.27 -3.62 14.11 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.456 2.104 . . . . 10.0 111.851 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.44 -12.31 61.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.012 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 730' ' ' LEU . . . . . 0.476 HD23 ' NH1' ' A' ' 738' ' ' ARG . 32.2 mt -66.48 -34.69 78.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.154 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 53.42 -104.09 0.19 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.142 -0.936 . . . . 10.0 111.318 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.16 -56.34 0.86 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.05 -179.104 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -58.0 -54.41 47.25 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.513 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.28 -31.27 71.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.114 0.483 . . . . 10.0 110.539 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 39.9 tp -65.69 -46.76 77.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.802 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 22.8 mtt180 -63.49 -36.33 83.4 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.966 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -60.37 -45.2 94.34 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.404 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 738' ' ' ARG . . . . . 0.476 ' NH1' HD23 ' A' ' 730' ' ' LEU . 16.7 mmm-85 -63.35 -41.71 98.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.513 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 90.7 mt -62.53 -51.84 67.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.694 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 36.4 tp -62.08 -44.37 96.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.418 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -61.01 -41.23 96.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.745 0.307 . . . . 10.0 111.407 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 23.8 tp60 -60.59 -42.98 97.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.187 -179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -39.82 95.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.965 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 75.3 mt -62.45 -44.01 98.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.765 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -46.5 87.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.24 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 88.3 t -65.53 -40.2 87.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.126 0.488 . . . . 10.0 110.155 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -59.69 -43.39 94.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.78 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 748' ' ' GLN . . . . . 0.493 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 24.5 mt-30 -59.1 -44.2 91.94 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.02 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.45 -39.94 89.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.475 -0.329 . . . . 10.0 110.77 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -68.36 -34.92 76.93 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.975 0.417 . . . . 10.0 109.879 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -72.42 -39.38 67.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.07 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 752' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 45.9 mt-10 -53.39 -39.83 64.56 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 13.3 t -75.17 -30.93 23.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.315 -0.402 . . . . 10.0 112.003 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 50.5 t -85.42 -46.52 17.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.245 0.545 . . . . 10.0 111.098 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.03 132.11 3.94 Favored Glycine 0 N--CA 1.441 -0.995 0 N-CA-C 110.404 -1.078 . . . . 10.0 110.404 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 756' ' ' ALA . . . . . 0.6 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -56.84 -51.81 67.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 117.001 0.4 . . . . 10.0 111.646 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 757' ' ' GLU . . . . . 0.467 ' H ' ' CD ' ' A' ' 757' ' ' GLU . 11.2 mp0 -59.15 -39.27 81.89 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.076 -0.511 . . . . 10.0 111.132 -179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 16.1 tpt -73.56 -38.68 65.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.725 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 7.8 tpt -60.59 -36.49 78.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.794 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -61.81 -37.54 84.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.33 0.586 . . . . 10.0 109.491 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -71.07 -34.48 71.22 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.527 -0.761 . . . . 10.0 109.414 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -68.1 -51.61 44.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.272 -0.876 . . . . 10.0 110.304 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -56.84 -44.48 82.14 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.933 0.397 . . . . 10.0 110.145 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 43.6 tttp -60.44 -50.41 73.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.343 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.27 -42.23 99.72 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.494 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 44.7 t -62.49 -49.19 84.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.424 0.154 . . . . 10.0 110.588 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 18.7 ttt -59.56 -43.3 93.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.657 0.265 . . . . 10.0 110.877 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 84.4 mt -64.28 -51.78 61.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.604 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 769' ' ' GLN . . . . . 0.407 ' HG3' ' N ' ' A' ' 770' ' ' THR . 13.9 pt20 -63.43 -37.29 86.71 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.796 0.295 . . . . 10.0 111.796 -178.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 770' ' ' THR . . . . . 0.407 ' N ' ' HG3' ' A' ' 769' ' ' GLN . 12.6 m -68.39 -34.84 76.76 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.665 -0.495 . . . . 10.0 109.665 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.8 tt -62.14 -50.05 73.4 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.84 -34.05 75.27 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.034 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 773' ' ' SER . . . . . 0.409 ' HA ' ' NZ ' ' A' ' 776' ' ' LYS . 72.7 m -61.63 -52.87 62.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.467 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 16.9 mt -78.02 -22.74 48.8 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.887 -0.325 . . . . 10.0 111.675 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 31.1 t-105 -63.94 -50.37 68.9 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.952 -0.299 . . . . 10.0 110.821 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.409 ' NZ ' ' HA ' ' A' ' 773' ' ' SER . 10.9 ptpp? -62.25 -35.25 78.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.919 0.39 . . . . 10.0 110.434 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -67.28 -41.66 85.11 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 73.5 t60 -61.74 -38.16 86.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.002 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 63.6 mt -66.0 -49.02 69.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.117 179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -61.52 -45.25 95.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.543 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.32 94.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.997 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 37.9 ttm -64.39 -42.86 95.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.766 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 783' ' ' ASP . . . . . 0.441 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 38.5 t70 -64.88 -41.13 95.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.209 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -62.97 -35.35 79.86 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.681 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 13.7 tp -78.37 -35.45 47.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.809 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -59.07 -38.04 78.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.597 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 787' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 0.9 OUTLIER -78.97 -1.15 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.998 -0.281 . . . . 10.0 111.157 179.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -127.14 21.39 5.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.761 -0.733 . . . . 10.0 112.066 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 9.0 tp -64.2 -27.99 43.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 111.739 0.274 . . . . 10.0 111.739 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 22.2 m80 -68.72 -11.18 59.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.716 0.293 . . . . 10.0 111.335 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 3.3 tp -101.78 -1.06 33.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.483 . . . . 10.0 110.156 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 792' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 792' ' ' ARG . 3.3 mmt85 -113.99 -47.98 2.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.762 -0.653 . . . . 10.0 109.97 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -90.28 67.04 2.62 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.96 -0.638 . . . . 10.0 111.552 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 794' ' ' TYR . . . . . 0.472 ' HB2' ' H ' ' A' ' 795' ' ' ALA . 0.4 OUTLIER -81.44 -157.09 0.16 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.683 0.278 . . . . 10.0 110.792 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 795' ' ' ALA . . . . . 0.472 ' H ' ' HB2' ' A' ' 794' ' ' TYR . . . -62.0 150.4 38.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.7 0.286 . . . . 10.0 111.219 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 67.81 18.38 9.69 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.688 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 797' ' ' LYS . . . . . 0.483 ' HZ1' ' CD ' ' A' ' 802' ' ' GLU . 50.6 mttm -142.68 164.31 30.46 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.824 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -111.11 126.75 28.07 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 109.59 -0.522 . . . . 10.0 109.59 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.77 -24.37 71.17 Favored 'Trans proline' 0 CA--C 1.529 0.231 0 C-N-CA 122.902 2.401 . . . . 10.0 113.535 -178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 800' ' ' LYS . . . . . 0.451 ' NZ ' ' HB2' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -91.0 -48.42 6.99 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.89 -0.324 . . . . 10.0 110.65 -179.674 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 -63.55 -38.88 92.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.219 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . 0.483 ' CD ' ' HZ1' ' A' ' 797' ' ' LYS . 23.0 tp10 -65.11 -40.23 94.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.065 0.46 . . . . 10.0 109.922 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -60.56 -42.52 96.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.06 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -65.98 -39.72 90.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.571 -0.74 . . . . 10.0 110.601 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 41.3 ttp85 -61.34 -45.31 94.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.015 0.436 . . . . 10.0 110.431 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -65.66 -46.97 77.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.279 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 3.5 p -64.59 -37.54 87.92 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.608 -0.269 . . . . 10.0 111.652 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -64.74 -45.79 84.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.757 0.313 . . . . 10.0 110.2 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 13.2 m -64.82 -42.29 95.09 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.01 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 38.5 ttm -60.84 -37.29 81.56 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.866 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -70.23 -41.45 73.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.442 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.21 -50.05 74.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.669 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.41 -33.83 75.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.387 179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 11.6 ttt -63.82 -47.83 79.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.515 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 91.2 mt -62.46 -41.45 98.76 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.929 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -63.09 -44.25 96.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.848 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 12.1 m -73.46 -29.82 62.78 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.896 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 55.0 tp -62.56 -56.79 14.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.976 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 43.5 pttt -62.24 -28.87 70.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.674 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -62.35 -67.05 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.32 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . 0.516 ' HA ' ' OG ' ' A' ' 824' ' ' SER . 1.3 mm-40 -61.43 -28.61 69.39 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 -178.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 5.6 t -60.23 -41.05 85.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 178.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 22.4 mm -76.56 -46.49 31.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.251 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 824' ' ' SER . . . . . 0.516 ' OG ' ' HA ' ' A' ' 821' ' ' GLU . 0.1 OUTLIER -63.47 -42.25 98.59 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 121.029 -0.268 . . . . 10.0 111.372 -179.42 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 97.5 m -59.42 -39.56 83.9 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.7 0.286 . . . . 10.0 111.194 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 76.3 mt -67.73 -17.97 64.74 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.099 0.476 . . . . 10.0 110.612 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 3.9 m -100.77 -29.52 12.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.157 179.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 828' ' ' LYS . . . . . 0.663 ' HE3' ' O ' ' A' ' 713' ' ' ASP . 77.7 mttt -70.1 -16.22 63.09 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.276 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.2 p -59.75 131.45 24.35 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.334 0.587 . . . . 10.0 111.055 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -97.88 96.9 8.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.823 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 40.4 t -105.31 143.47 16.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.636 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -52.09 120.12 5.08 Favored 'General case' 0 C--N 1.332 -0.177 0 O-C-N 123.677 0.611 . . . . 10.0 110.472 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 833' ' ' MET . . . . . 0.414 ' HE1' ' HA ' ' A' ' 833' ' ' MET . 33.7 mmt -94.18 126.53 48.24 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.404 -179.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -85.45 -178.94 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.143 2.562 . . . . 10.0 111.563 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -86.52 148.57 25.46 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.781 0.324 . . . . 10.0 110.616 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.911 -0.566 . . . . 10.0 109.727 179.268 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.5 tpt . . . . . 0 N--CA 1.481 1.085 0 CA-C-O 121.076 0.465 . . . . 10.0 110.91 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 16.5 tpt -124.41 136.13 53.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.761 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 19.6 pt -93.2 147.55 5.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.202 -0.453 . . . . 10.0 111.297 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.19 -7.79 57.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.613 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 87.3 mt -83.45 72.03 10.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.082 0.468 . . . . 10.0 110.394 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -130.78 42.63 3.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.766 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . 0.434 ' HZ3' ' CD ' ' A' ' 289' ' ' GLU . 53.7 tttm -76.53 104.41 7.03 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.888 0.375 . . . . 10.0 110.56 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.5 ' HA ' ' NE ' ' B' ' 8' ' ' ARG . 4.5 mmp_? -127.7 15.28 6.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.951 0.405 . . . . 10.0 111.249 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -109.77 130.66 55.5 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 7.4 mtpp -66.09 140.27 58.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.494 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 31.2 mt -117.71 98.9 52.1 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -88.38 30.08 0.44 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.984 2.456 . . . . 10.0 111.296 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 20.8 tp -59.98 -33.42 71.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.388 -178.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.24 -55.48 27.73 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 19.1 m -75.27 -28.8 20.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.774 0.321 . . . . 10.0 111.13 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.25 87.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.493 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 79.9 t -72.81 -41.11 61.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.693 0.282 . . . . 10.0 110.968 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.73 88.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.32 0.581 . . . . 10.0 110.537 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.76 -30.37 40.73 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.08 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -78.06 12.06 19.79 Favored Glycine 0 CA--C 1.52 0.356 0 CA-C-N 115.853 -0.612 . . . . 10.0 113.951 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.537 ' HA ' ' O ' ' A' ' 229' ' ' ALA . 10.5 t -59.3 -26.65 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 121.621 0.724 . . . . 10.0 110.808 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 18.4 tpt -153.83 90.15 1.36 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.032 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -147.78 -166.92 2.66 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.384 -0.825 . . . . 10.0 109.076 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -88.61 134.93 33.74 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.957 -0.386 . . . . 10.0 109.957 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -85.49 2.28 45.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.079 0.466 . . . . 10.0 110.645 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.54 104.47 16.85 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.362 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 52.1 tpp -144.18 147.55 33.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.992 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.575 -0.726 . . . . 10.0 110.164 179.631 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 92.8 t . . . . . 0 N--CA 1.479 0.984 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -78.23 132.48 37.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.173 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.99 173.33 12.95 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.886 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.31 129.28 40.47 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.138 -0.319 . . . . 10.0 110.138 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.428 ' C ' ' H ' ' A' ' 15' ' ' ASP . 6.3 mmt180 -61.85 139.52 58.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.897 -178.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.8 m120 72.35 -19.16 0.3 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.057 0.943 . . . . 10.0 112.046 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.428 ' H ' ' C ' ' A' ' 13' ' ' ARG . 22.2 t70 -102.9 -64.85 1.04 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.825 0.345 . . . . 10.0 111.586 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -70.07 -27.73 64.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.441 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.7 p -55.67 -62.44 1.69 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.765 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.8 mt -62.69 -36.59 83.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.523 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.0 ttp-105 -63.87 -48.84 75.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.576 -0.283 . . . . 10.0 110.914 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.2 mtp180 -65.85 -38.12 88.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.922 0.391 . . . . 10.0 110.042 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 41.8 mtt -62.29 -41.64 98.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.431 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.401 ' HD3' ' O ' ' A' ' 22' ' ' ARG . 15.5 tpp180 -61.75 -36.52 81.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.308 -0.406 . . . . 10.0 109.91 179.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -63.76 -37.64 88.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.205 -0.452 . . . . 10.0 109.899 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.5 t -72.79 -37.35 54.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.849 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 36.3 t -57.84 -36.13 54.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.663 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -59.9 -40.27 88.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.182 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.1 mt -66.04 -41.88 90.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.912 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.97 -37.61 78.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.414 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -66.56 -25.21 66.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.018 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -93.17 -17.58 23.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.983 0.421 . . . . 10.0 111.073 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 18.3 mtt -88.02 -25.51 23.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.022 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.473 ' OE1' ' HD3' ' A' ' 72' ' ' ARG . 20.2 tt0 -56.78 -49.7 92.27 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 116.166 -0.47 . . . . 10.0 112.01 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.47 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 51.2 Cg_exo -55.53 -28.96 67.28 Favored 'Trans proline' 0 C--N 1.363 1.323 0 C-N-CA 122.138 1.892 . . . . 10.0 112.474 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.66 -40.78 66.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.995 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 23.6 mmt -67.59 -29.86 69.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.483 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 23.0 mt-10 -62.89 -32.15 73.35 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.224 0.535 . . . . 10.0 110.251 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -78.13 -24.8 47.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.112 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.9 mp -72.86 142.28 47.95 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.251 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 p -75.56 172.02 13.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.712 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -58.35 -43.71 88.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.101 0.477 . . . . 10.0 110.689 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -67.93 -34.54 76.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.245 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.94 -36.05 82.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.547 -0.297 . . . . 10.0 110.822 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.4 mt -61.55 -46.62 89.15 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.04 -0.726 . . . . 10.0 109.04 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -65.69 -35.7 81.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.289 -0.869 . . . . 10.0 109.643 178.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.76 -36.7 92.32 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.622 -0.717 . . . . 10.0 111.311 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -67.18 -39.29 86.39 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.491 -0.559 . . . . 10.0 109.491 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.7 m -60.73 -45.97 92.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.738 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.48 -35.16 79.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.803 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -62.22 -42.43 99.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.311 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -59.64 -40.21 86.89 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.3 -0.409 . . . . 10.0 109.982 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.7 tpp180 -62.68 -43.31 99.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.767 -0.652 . . . . 10.0 109.955 179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' A' ' 56' ' ' LYS . . . -67.84 -42.09 81.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.633 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 55.8 mtp180 -61.57 -40.0 93.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.74 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 33.2 mt -62.92 -34.17 76.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.168 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.59 -34.87 76.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.158 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 56.0 mmtt -76.9 -43.88 33.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.077 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 145.77 78.3 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.725 -0.75 . . . . 10.0 112.335 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -130.62 144.94 51.77 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.647 -0.501 . . . . 10.0 109.647 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.5 t -85.75 131.52 34.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.5 tp -56.17 -42.38 76.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.036 0.446 . . . . 10.0 111.038 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -66.75 -16.22 64.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.537 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -88.4 -14.88 36.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.042 0.448 . . . . 10.0 110.536 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.4 mt -87.49 -9.93 53.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.4 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.504 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 76.4 mt -47.3 -53.29 29.75 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 113.399 0.888 . . . . 10.0 113.399 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.504 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 52.1 Cg_exo -54.37 -56.82 2.18 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.905 1.737 . . . . 10.0 113.199 -179.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -65.06 -43.41 92.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.89 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.72 80.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.569 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -65.25 -34.0 77.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.851 -179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.04 -44.66 83.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.451 -0.341 . . . . 10.0 110.562 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.7 t -62.54 -48.6 87.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.436 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 71.4 t -61.9 -39.74 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.502 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.473 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 5.4 ttt180 -58.46 -46.13 87.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.454 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -68.9 -42.77 76.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.628 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.34 -36.79 76.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.489 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.9 m -63.19 -34.06 76.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.708 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.403 ' O ' ' HA3' ' A' ' 80' ' ' GLY . 11.2 mtmm -70.47 -30.5 67.33 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.732 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -89.47 -38.8 13.79 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 48.9 t -81.47 -64.54 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.793 0.33 . . . . 10.0 111.632 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -82.07 -33.28 29.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.739 0.304 . . . . 10.0 111.816 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.403 ' HA3' ' O ' ' A' ' 76' ' ' LYS . . . 91.89 13.73 57.45 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.582 -0.818 . . . . 10.0 111.392 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 59.0 ttm -125.02 127.5 47.08 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.697 0.284 . . . . 10.0 110.267 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -78.63 131.73 36.8 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.241 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.91 117.38 4.97 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 179.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -58.82 154.89 14.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.194 0.521 . . . . 10.0 112.005 -178.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -43.05 94.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.285 -0.87 . . . . 10.0 111.275 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 m -65.77 -29.02 45.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.143 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -67.22 -34.16 76.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.076 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 92' ' ' MET . 68.2 mt -64.15 -37.13 86.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.705 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 53.2 mt -65.31 -49.99 67.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.732 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.94 -36.71 93.24 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.49 -0.777 . . . . 10.0 112.325 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.64 -33.46 86.72 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.134 -0.555 . . . . 10.0 112.308 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' ' 88' ' ' LEU . 56.1 mtt -74.07 -36.72 64.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.967 0.413 . . . . 10.0 110.146 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 95.9 t -64.35 -35.57 74.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.34 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 94.2 mt -77.39 -0.8 27.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.643 -0.708 . . . . 10.0 112.195 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -83.84 -32.27 25.35 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.267 0.556 . . . . 10.0 109.924 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -98.22 -178.93 4.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.274 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . 0.43 ' HA ' ' O ' ' A' ' 387' ' ' LEU . 21.9 ttt85 -80.5 71.73 7.36 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.455 ' SG ' ' HB3' ' A' ' 408' ' ' ASP . 14.6 m -141.32 162.93 34.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.432 -178.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 36.3 mm -110.36 127.27 67.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.468 -0.787 . . . . 10.0 108.988 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -101.25 105.66 16.78 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.886 0.374 . . . . 10.0 111.5 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -76.99 107.03 9.04 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.413 -0.588 . . . . 10.0 109.413 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 55.6 mtt -104.11 -177.44 3.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.059 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -116.55 141.37 48.28 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.847 0.356 . . . . 10.0 111.088 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.21 106.74 2.11 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.204 179.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 138.93 -41.82 1.31 Allowed Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.803 -0.713 . . . . 10.0 111.963 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.04 -73.04 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.845 0.355 . . . . 10.0 110.554 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 159.52 126.77 0.87 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.593 -0.813 . . . . 10.0 112.445 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.518 ' HZ2' ' CD ' ' A' ' 210' ' ' GLU . 13.8 mtmt -109.04 -60.68 1.72 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.906 0.384 . . . . 10.0 110.177 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -31.85 72.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.847 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.1 mp -72.75 -14.77 61.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.58 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 20.4 m -100.32 -30.59 11.78 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.266 0.555 . . . . 10.0 110.618 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.03 -9.81 34.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.415 -0.812 . . . . 10.0 112.504 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.92 -22.91 61.41 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.722 0.267 . . . . 10.0 111.722 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.407 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 54.9 mt -72.58 -56.79 3.68 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.214 0.45 . . . . 10.0 112.214 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.407 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 35.5 Cg_endo -63.12 -31.13 75.64 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 122.15 1.9 . . . . 10.0 112.327 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.72 -45.92 77.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.51 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.418 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 62.9 t80 -63.06 -45.74 90.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.598 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 44.7 tp -60.39 -51.79 67.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.944 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -71.38 -14.94 62.33 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.862 0.319 . . . . 10.0 111.862 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -81.77 -22.85 36.97 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.685 0.279 . . . . 10.0 110.411 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.6 mt -61.9 -31.17 71.45 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.866 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.38 -19.36 61.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.239 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 73.33 9.19 76.95 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.193 -0.527 . . . . 10.0 113.117 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -76.33 -18.33 58.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.733 0.301 . . . . 10.0 110.867 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 103.16 127.97 6.24 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.637 -0.792 . . . . 10.0 113.243 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.1 t -105.84 118.74 53.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 178.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 39.5 m170 -101.09 101.74 12.55 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.853 0.359 . . . . 10.0 111.043 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 38.3 t -92.19 116.53 33.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.767 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 84.0 t -105.27 114.78 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.917 -178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -101.71 164.12 11.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.634 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.7 m -69.52 -26.95 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -148.32 175.18 11.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.718 0.294 . . . . 10.0 110.705 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -78.35 -25.44 46.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.68 -179.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.21 -56.13 26.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.724 0.297 . . . . 10.0 110.717 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.8 mt -65.78 -38.22 88.44 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.917 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.64 -51.62 69.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.798 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -70.47 -31.48 68.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.039 0.447 . . . . 10.0 110.693 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 138' ' ' ARG . 1.7 ttp180 -63.08 -57.51 10.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.806 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.23 -32.65 73.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.888 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -59.38 -39.4 83.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.903 0.382 . . . . 10.0 111.042 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -90.4 -28.5 18.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.209 -0.45 . . . . 10.0 111.391 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -73.17 -43.95 60.71 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.537 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -89.2 -1.36 58.05 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.865 0.364 . . . . 10.0 111.15 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.495 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 58.4 ttm-85 -61.62 -49.23 87.63 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' PRO . . . . . 0.458 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 18.3 Cg_exo -66.93 -1.26 5.77 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 122.163 1.909 . . . . 10.0 112.621 -179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.8 tp -101.93 -52.33 3.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.202 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -69.47 -45.49 68.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.165 -0.471 . . . . 10.0 111.586 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -70.1 -15.35 62.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.111 0.481 . . . . 10.0 110.941 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -73.78 -27.39 61.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.344 178.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 66.8 mt -98.93 -11.03 22.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.384 -0.825 . . . . 10.0 110.823 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 115.19 -5.64 21.71 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.293 -0.956 . . . . 10.0 114.149 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 82.7 mt -82.29 131.19 35.23 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.339 0.57 . . . . 10.0 110.639 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 11.0 p -86.3 134.42 33.75 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.217 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 40.4 t -106.83 127.34 62.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.409 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -123.22 134.89 9.67 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.764 -0.731 . . . . 10.0 111.969 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 5.4 tp -108.91 130.57 61.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.898 0.38 . . . . 10.0 110.305 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -111.89 102.3 10.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.111 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.442 ' O ' ' HB2' ' A' ' 161' ' ' MET . 97.0 mt -90.9 141.99 27.16 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.451 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.12 112.0 1.08 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.85 2.366 . . . . 10.0 112.41 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 100.12 18.68 21.32 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.995 -0.621 . . . . 10.0 112.447 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' MET . . . . . 0.507 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 8.2 ttp -82.07 140.13 46.14 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 109.881 -0.415 . . . . 10.0 109.881 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.88 153.17 32.4 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.509 2.139 . . . . 10.0 112.832 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . 0.435 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -54.2 -49.0 92.67 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.939 0.718 . . . . 10.0 112.939 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.435 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 50.5 Cg_exo -55.67 -36.35 94.68 Favored 'Trans proline' 0 C--N 1.36 1.158 0 C-N-CA 121.824 1.683 . . . . 10.0 112.155 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -70.63 -43.1 69.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.41 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' A' ' 161' ' ' MET . 62.5 mttm -61.34 -46.26 90.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.568 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -57.87 -39.34 77.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.059 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -68.91 -37.31 78.87 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.839 0.352 . . . . 10.0 111.204 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -74.09 -39.19 63.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.454 -179.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -75.8 -25.06 56.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.442 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.84 -5.97 54.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.872 0.368 . . . . 10.0 110.591 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -78.78 175.7 10.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.127 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -74.12 -44.42 53.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.821 0.344 . . . . 10.0 110.537 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 70.4 mt -126.69 123.87 63.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.931 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.2 m -112.92 128.12 56.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.998 0.428 . . . . 10.0 111.448 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -104.24 135.24 46.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.752 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.19 173.34 44.19 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.304 -0.951 . . . . 10.0 112.826 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.1 m -92.35 151.81 20.08 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.151 0.18 . . . . 10.0 110.538 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -56.85 -43.44 81.17 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -59.08 -51.94 67.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.687 0.28 . . . . 10.0 111.532 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -66.14 -37.4 85.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.986 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -59.67 -39.78 85.61 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.88 0.372 . . . . 10.0 110.913 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -74.97 -41.8 31.7 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.738 -0.744 . . . . 10.0 111.548 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -62.95 -36.76 84.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.033 0.445 . . . . 10.0 110.389 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . 0.441 ' CG ' ' HZ3' ' A' ' 166' ' ' LYS . 11.3 m-20 -60.35 -44.57 95.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.012 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -62.83 -38.14 89.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.339 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 74.8 mt -63.03 -48.16 79.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.776 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 40.9 mtm-85 -67.55 -37.76 83.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.799 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -61.62 -50.36 72.87 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.514 -0.766 . . . . 10.0 111.498 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.01 1.18 28.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.754 -0.657 . . . . 10.0 112.463 -178.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 22.5 ttp -108.47 11.01 27.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.113 0.482 . . . . 10.0 110.566 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -79.31 170.67 16.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.869 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -106.34 -30.32 9.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.952 0.406 . . . . 10.0 110.451 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.32 139.65 24.11 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.87 -24.31 78.9 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.831 2.354 . . . . 10.0 113.202 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -76.96 -16.02 59.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.68 0.276 . . . . 10.0 111.125 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -76.88 -9.95 59.04 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.345 -0.389 . . . . 10.0 110.646 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -54.87 155.54 4.31 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.787 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 11.4 m -133.26 -15.4 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.784 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -87.32 -175.2 5.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.305 0.574 . . . . 10.0 111.691 -179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -145.12 -171.23 3.61 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.36 -0.837 . . . . 10.0 108.861 179.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 24.5 tttm -65.44 131.54 46.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.008 0.432 . . . . 10.0 110.637 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 19.9 mt -83.85 60.7 5.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.337 0.589 . . . . 10.0 109.629 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -76.59 -60.22 2.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.512 -0.767 . . . . 10.0 112.868 -178.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -127.83 135.0 49.46 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 111.988 0.366 . . . . 10.0 111.988 -178.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.548 ' HB3' ' CD1' ' A' ' 384' ' ' TYR . . . -133.14 126.21 31.21 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.751 178.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 59.1 tp -123.07 116.06 22.86 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.117 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 15.5 m -99.19 141.54 16.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.204 0.526 . . . . 10.0 111.21 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -64.67 -72.6 0.14 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.127 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' GLU . . . . . 0.518 ' CD ' ' HZ2' ' A' ' 108' ' ' LYS . 31.1 mm-40 -109.02 109.51 20.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.768 0.318 . . . . 10.0 110.82 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 34.0 m -69.32 -20.96 24.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.944 0.402 . . . . 10.0 110.653 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.98 -46.05 82.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.58 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.33 -39.4 8.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.745 0.646 . . . . 10.0 112.745 -178.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 58.6 mt -74.34 -30.33 26.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 113.225 0.824 . . . . 10.0 113.225 -177.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 42.5 mt -112.7 -45.58 3.21 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.925 0.713 . . . . 10.0 112.925 -178.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 37.8 mm -79.02 -65.92 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.736 0.643 . . . . 10.0 112.736 -178.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.72 -61.22 2.75 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.734 0.642 . . . . 10.0 112.734 -177.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -90.78 74.85 6.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.983 0.421 . . . . 10.0 110.724 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -109.47 -51.38 2.88 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.251 -0.432 . . . . 10.0 111.575 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.31 3.14 36.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.036 -178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 1.5 m -67.85 112.72 11.35 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.54 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -91.91 126.77 0.93 Allowed 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 122.918 2.412 . . . . 10.0 113.15 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 223' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 374' ' ' SER . 58.1 mt -82.81 88.7 6.76 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.894 -0.593 . . . . 10.0 109.428 178.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 18.3 mt -94.6 113.28 28.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.88 -179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 4.0 mt -79.85 152.87 4.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.426 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 226' ' ' SER . . . . . 0.448 ' HB3' ' OD1' ' A' ' 369' ' ' ASN . 2.2 m -52.59 122.12 8.37 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.331 0.652 . . . . 10.0 112.445 -179.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -72.15 144.77 36.75 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.686 -0.688 . . . . 10.0 112.65 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -78.69 -55.77 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.559 0 C-N-CA 122.512 2.141 . . . . 10.0 112.466 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -158.88 96.47 1.35 Allowed 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.76 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . 0.549 ' OE2' ' HB3' ' A' ' 370' ' ' GLN . 3.1 mt-10 -87.68 -8.77 55.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.655 0.74 . . . . 10.0 109.143 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 231' ' ' ASP . . . . . 0.475 ' HA ' ' CE ' ' A' ' 235' ' ' MET . 2.0 t0 -154.96 177.49 11.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.451 -1.249 . . . . 10.0 108.384 178.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 232' ' ' SER . . . . . 0.558 ' HB3' ' OE2' ' A' ' 234' ' ' GLU . 70.2 m -156.95 159.7 38.35 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.891 0.377 . . . . 10.0 110.711 -179.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 233' ' ' SER . . . . . 0.437 ' HA ' ' HB ' ' A' ' 365' ' ' ILE . 1.0 OUTLIER -63.1 -31.19 72.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.361 -179.757 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . 0.558 ' OE2' ' HB3' ' A' ' 232' ' ' SER . 1.3 pm0 -93.88 -2.18 53.74 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.936 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 235' ' ' MET . . . . . 0.503 ' SD ' ' HA2' ' B' ' 20' ' ' GLY . 29.7 mtp -90.0 -69.18 0.74 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.363 -179.143 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.62 -29.02 68.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.204 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 237' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 241' ' ' LYS . 29.6 tptt -64.24 -29.36 70.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.721 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -72.97 -42.12 63.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.3 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 18.4 t -68.32 -40.63 82.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.333 0.587 . . . . 10.0 109.956 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -83.41 11.33 7.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.566 -0.743 . . . . 10.0 111.284 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 241' ' ' LYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 237' ' ' LYS . 3.6 tptm -92.91 -27.29 17.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.665 0.269 . . . . 10.0 111.305 -179.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 11.2 tp -90.89 -19.59 7.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.0 0.429 . . . . 10.0 111.119 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 243' ' ' ILE . . . . . 0.481 ' N ' ' HD2' ' A' ' 244' ' ' PRO . 68.0 mt -63.14 -47.71 85.08 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 112.701 0.63 . . . . 10.0 112.701 -179.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 244' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 243' ' ' ILE . 56.5 Cg_endo -68.98 18.77 0.16 Allowed 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.272 1.981 . . . . 10.0 113.594 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 245' ' ' HIS . . . . . 0.433 ' H ' ' C ' ' A' ' 243' ' ' ILE . 6.1 t-80 -115.27 1.66 13.84 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 15.0 mt -105.58 -169.29 1.57 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.079 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 7.9 pt -135.62 149.51 28.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.611 0.243 . . . . 10.0 111.44 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -84.86 73.92 10.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.17 0.509 . . . . 10.0 110.445 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 9.2 tp60 -178.95 -22.47 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.016 -0.993 . . . . 10.0 109.598 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 250' ' ' GLU . . . . . 0.495 ' O ' ' HB2' ' A' ' 251' ' ' LYS . 30.1 tt0 -162.85 134.41 5.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.674 179.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 250' ' ' GLU . 5.8 mtmm 80.04 105.9 0.07 Allowed 'General case' 0 N--CA 1.471 0.602 0 O-C-N 124.161 0.913 . . . . 10.0 112.18 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 252' ' ' GLU . . . . . 0.426 ' CG ' ' HG ' ' A' ' 285' ' ' LEU . 1.4 mp0 47.93 39.3 10.71 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.005 -0.998 . . . . 10.0 112.237 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -114.7 -34.71 5.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.898 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 254' ' ' SER . . . . . 0.409 ' HA ' ' CD2' ' A' ' 257' ' ' PHE . 20.0 m -78.22 100.35 6.62 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.303 0.853 . . . . 10.0 113.303 -177.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -68.97 -39.75 79.28 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.168 -1.419 . . . . 10.0 107.168 176.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 62.8 m -147.5 -86.09 0.1 Allowed 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 113.655 -1.611 . . . . 10.0 107.664 177.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 257' ' ' PHE . . . . . 0.409 ' CD2' ' HA ' ' A' ' 254' ' ' SER . 77.1 m-85 62.87 -50.56 0.19 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.532 0.938 . . . . 10.0 113.532 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 69.62 18.56 7.62 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.199 0.6 . . . . 10.0 110.368 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 80.82 -49.44 3.93 Favored Glycine 0 C--N 1.33 0.247 0 CA-C-N 115.751 -0.658 . . . . 10.0 112.75 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -71.69 -41.75 68.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.737 0.303 . . . . 10.0 111.578 -179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 83.4 -140.72 19.99 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.625 -0.99 . . . . 10.0 110.625 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -164.93 -87.39 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.973 0.387 . . . . 10.0 110.921 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -119.6 136.07 54.53 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 1.8 m -80.48 41.75 0.56 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.874 0.369 . . . . 10.0 111.151 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 25.1 m -110.77 -9.88 11.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.863 0.363 . . . . 10.0 110.991 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 266' ' ' ASP . . . . . 0.525 ' OD1' ' HG2' ' A' ' 268' ' ' LYS . 4.0 t70 -156.95 174.0 16.17 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -135.51 1.84 2.9 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.67 0.271 . . . . 10.0 111.409 -178.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 268' ' ' LYS . . . . . 0.525 ' HG2' ' OD1' ' A' ' 266' ' ' ASP . 5.7 ptpp? -122.83 141.19 52.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.167 0.508 . . . . 10.0 111.44 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 4.1 m -83.79 95.66 8.51 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.35 -0.982 . . . . 10.0 108.35 177.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -60.56 -10.49 5.19 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.967 -0.56 . . . . 10.0 112.06 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.47 -13.89 55.97 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.154 -0.313 . . . . 10.0 110.154 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 50.7 t 67.94 98.82 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 O-C-N 123.679 0.612 . . . . 10.0 109.422 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.01 -66.51 1.06 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.334 0.864 . . . . 10.0 113.334 -177.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 4.2 mm? 57.47 75.19 0.38 Allowed 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.59 -0.893 . . . . 10.0 108.59 -177.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 12.6 p -112.65 -85.43 0.58 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 114.145 1.165 . . . . 10.0 114.145 -176.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 71.6 137.6 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.629 0.771 . . . . 10.0 109.814 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.46 17.64 0.13 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.728 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . -90.8 -29.18 13.73 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 111.146 -0.781 . . . . 10.0 111.146 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 278' ' ' GLY . 4.2 mm? 73.54 -6.88 1.67 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.345 0.658 . . . . 10.0 111.437 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 10.9 m -81.82 -26.77 9.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 120.933 0.397 . . . . 10.0 110.295 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 13.8 tp -74.41 -34.54 63.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.419 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 9.0 tp -70.26 -22.56 24.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.65 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -71.2 -34.81 71.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.146 0.498 . . . . 10.0 110.047 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -81.89 -27.26 33.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.915 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 285' ' ' LEU . . . . . 0.426 ' HG ' ' CG ' ' A' ' 252' ' ' GLU . 1.0 OUTLIER -68.7 -40.93 79.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.622 -0.717 . . . . 10.0 109.599 179.068 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 66.9 mt -65.73 153.38 41.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.162 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 287' ' ' VAL . . . . . 0.503 ' O ' ' HG2' ' A' ' 288' ' ' LYS . 23.3 t 71.49 169.6 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 109.174 -0.676 . . . . 10.0 109.174 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 288' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 287' ' ' VAL . 0.0 OUTLIER 78.29 150.93 0.11 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.089 0.955 . . . . 10.0 110.642 -179.695 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 64.88 -161.06 0.28 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.751 -177.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -123.12 53.87 0.73 Allowed Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.34 -0.933 . . . . 10.0 112.283 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 291' ' ' ILE . . . . . 0.428 ' HB ' ' CB ' ' B' ' 14' ' ' ALA . 7.2 tt -125.83 110.85 25.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.803 0.335 . . . . 10.0 110.433 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 56.7 tpp 55.42 65.51 1.46 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.51 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.95 6.08 8.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.179 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -85.07 174.73 9.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.317 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -79.05 68.4 3.1 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.103 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -133.61 174.95 9.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.789 0.328 . . . . 10.0 110.955 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 86.4 p -116.92 178.32 4.39 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.243 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.79 -12.53 30.97 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.565 0.209 . . . . 10.0 111.565 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 2.7 p90 -101.01 13.94 33.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.173 0.511 . . . . 10.0 110.965 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 3.7 m -73.53 148.4 87.9 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.3 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -55.99 -25.6 54.5 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.971 2.448 . . . . 10.0 112.904 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -76.87 -19.24 57.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.825 0.345 . . . . 10.0 111.145 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 303' ' ' ASN . . . . . 0.572 ' OD1' ' HB2' ' A' ' 306' ' ' LEU . 63.4 t30 -101.79 94.29 5.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.965 0.412 . . . . 10.0 110.37 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 2.3 tp -124.73 -55.73 2.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.328 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -64.13 -38.41 90.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.049 0.452 . . . . 10.0 110.751 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 306' ' ' LEU . . . . . 0.572 ' HB2' ' OD1' ' A' ' 303' ' ' ASN . 85.5 mt -75.54 -31.86 60.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.326 179.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 10.3 tpt -63.9 -39.24 93.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.478 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -75.57 -18.3 59.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.104 0.478 . . . . 10.0 110.178 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -74.29 -41.75 60.69 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.737 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 28.8 m -73.78 -34.04 39.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.641 0.258 . . . . 10.0 111.224 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.87 -40.04 79.49 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.12 0.486 . . . . 10.0 110.069 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 312' ' ' ALA . . . . . 0.471 ' O ' ' HG2' ' A' ' 315' ' ' ARG . . . -69.31 -30.39 68.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.087 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -71.08 -29.87 65.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.642 -0.708 . . . . 10.0 110.526 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 1.4 mp -75.16 -44.52 46.27 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.526 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 315' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' A' ' 312' ' ' ALA . 37.2 ptt180 -65.17 -33.71 76.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.877 0.37 . . . . 10.0 110.08 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -89.86 39.58 0.96 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.374 0.607 . . . . 10.0 110.203 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -147.73 -42.01 0.17 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.477 -0.783 . . . . 10.0 109.929 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -107.03 -47.95 3.59 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.165 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.16 -50.88 51.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.519 -179.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -81.4 108.53 15.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.637 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -99.04 137.21 37.89 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.549 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 322' ' ' ARG . . . . . 0.465 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 2.0 ttp180 -63.13 151.47 40.05 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.219 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 323' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 1.1 m-20 76.85 -46.15 0.5 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.909 0.884 . . . . 10.0 112.63 178.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 8.8 p -90.17 -36.03 8.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -103.02 -40.5 6.46 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.959 -0.296 . . . . 10.0 111.18 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -145.86 147.58 31.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.726 0.298 . . . . 10.0 110.651 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 9.1 tp -125.73 132.7 70.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 13.4 t -96.9 113.17 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 110.06 -0.348 . . . . 10.0 110.06 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -158.68 153.15 24.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.295 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 61.12 23.66 13.83 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.454 0.471 . . . . 10.0 110.847 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 71.06 17.45 75.65 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.841 -0.618 . . . . 10.0 111.833 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -132.41 172.14 12.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.884 0.373 . . . . 10.0 110.769 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 62.0 t -116.9 119.87 63.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.56 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 82.3 mt -108.39 135.94 45.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.116 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 3.1 mp -81.79 127.85 39.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.083 0.468 . . . . 10.0 110.647 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.18 125.49 57.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.961 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -81.88 115.38 21.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.23 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -70.38 -25.26 63.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.325 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -62.18 -50.3 72.37 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -178.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.38 -18.26 10.5 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.825 0.676 . . . . 10.0 112.825 -178.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 86.81 39.56 7.52 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.622 -0.799 . . . . 10.0 111.261 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -107.93 129.25 55.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.623 0.249 . . . . 10.0 110.662 -179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -80.96 98.04 7.74 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 63.2 mtt -86.36 99.05 11.34 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.088 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -83.94 -26.2 29.49 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.957 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -91.86 55.89 2.97 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.093 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -140.82 93.42 2.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.054 0.454 . . . . 10.0 110.541 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 7.6 ttp85 -91.03 90.87 8.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.047 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -79.9 114.74 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.021 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 2.5 m -75.29 -161.14 0.14 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.421 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 33.0 t70 66.33 12.48 8.65 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.466 0.65 . . . . 10.0 110.933 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 71.88 23.42 78.02 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.853 -0.612 . . . . 10.0 112.508 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 11.6 tp -58.09 -48.93 78.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.706 0.288 . . . . 10.0 111.217 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 354' ' ' HIS . . . . . 0.428 ' CE1' HE22 ' A' ' 355' ' ' GLN . 15.4 p80 -94.65 -5.76 44.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.696 -0.402 . . . . 10.0 111.117 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 355' ' ' GLN . . . . . 0.428 HE22 ' CE1' ' A' ' 354' ' ' HIS . 1.3 mp0 -65.68 -45.95 80.92 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.195 0.522 . . . . 10.0 110.061 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -66.29 -28.79 68.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.184 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.9 -43.2 82.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.683 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . 0.606 ' OE1' ' HA ' ' A' ' 365' ' ' ILE . 83.4 mt-10 -64.2 -32.45 74.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.17 179.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -78.55 -25.89 45.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.796 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -67.71 -55.97 11.13 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.419 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -91.81 -171.48 2.89 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.398 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -84.96 63.96 4.31 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.868 -0.682 . . . . 10.0 112.047 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 2.2 t -122.71 163.22 21.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.611 -0.515 . . . . 10.0 109.611 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -100.15 107.29 19.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.248 -0.279 . . . . 10.0 110.248 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 365' ' ' ILE . . . . . 0.606 ' HA ' ' OE1' ' A' ' 358' ' ' GLU . 2.7 mp -58.47 132.23 23.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.493 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 13.3 mm-40 -71.51 160.12 33.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.898 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -81.46 -3.31 52.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.914 0.388 . . . . 10.0 110.578 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 64.23 -177.37 0.16 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.168 -0.924 . . . . 10.0 112.224 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.448 ' OD1' ' HB3' ' A' ' 226' ' ' SER . 4.6 t30 -170.08 99.68 0.29 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.331 -0.849 . . . . 10.0 109.444 -179.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 370' ' ' GLN . . . . . 0.549 ' HB3' ' OE2' ' A' ' 230' ' ' GLU . 5.3 tt0 -147.23 -50.75 0.19 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 371' ' ' THR . . . . . 0.429 ' H ' ' CD ' ' A' ' 230' ' ' GLU . 0.2 OUTLIER -125.34 129.14 49.35 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 114.443 1.275 . . . . 10.0 114.443 -176.818 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 372' ' ' LEU . . . . . 0.422 HD11 ' HE3' ' A' ' 776' ' ' LYS . 8.9 tp -130.81 -43.18 1.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.961 -1.018 . . . . 10.0 108.505 177.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -164.67 151.09 10.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.396 -1.275 . . . . 10.0 107.868 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 374' ' ' SER . . . . . 0.441 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 20.1 m -151.23 148.69 28.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.214 0.53 . . . . 10.0 112.228 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 16.6 tt -162.03 141.12 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.135 -0.939 . . . . 10.0 109.274 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 5.7 p -96.7 148.39 22.93 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.845 -0.428 . . . . 10.0 109.845 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -58.06 -42.08 84.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 10.0 111.094 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 378' ' ' GLN . . . . . 0.522 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 0.0 OUTLIER -60.95 -29.72 69.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.263 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -95.78 -8.66 33.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.763 0.316 . . . . 10.0 111.011 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -83.52 -50.0 8.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.191 0.519 . . . . 10.0 109.719 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -73.91 -4.92 37.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.636 0.731 . . . . 10.0 110.007 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 15.9 ttt180 -82.96 -4.24 58.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.102 -0.953 . . . . 10.0 109.829 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.403 HD12 HH21 ' A' ' 656' ' ' ARG . 29.5 mt -106.87 4.3 27.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.597 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.548 ' CD1' ' HB3' ' A' ' 206' ' ' ALA . 17.3 m-85 -97.58 143.46 28.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.053 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -70.74 -74.36 0.15 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.295 0.569 . . . . 10.0 110.721 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -95.0 102.89 14.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.734 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 46.5 tp -109.96 118.49 36.59 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.99 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -132.15 161.6 32.94 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.324 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -162.75 163.05 35.02 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.41 -0.9 . . . . 10.0 112.371 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 390' ' ' MET . . . . . 0.617 ' O ' ' HB ' ' A' ' 391' ' ' THR . 27.8 mtm -124.48 178.85 5.19 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 110.096 -0.335 . . . . 10.0 110.096 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 391' ' ' THR . . . . . 0.617 ' HB ' ' O ' ' A' ' 390' ' ' MET . 1.4 t 167.52 -177.75 0.02 OUTLIER 'General case' 0 C--O 1.234 0.276 0 O-C-N 123.774 0.671 . . . . 10.0 109.914 178.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -92.04 143.5 16.58 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.389 -0.684 . . . . 10.0 111.389 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.4 108.28 0.41 Allowed 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.562 0.345 . . . . 10.0 111.671 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -145.86 -19.75 0.46 Allowed 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.062 0.393 . . . . 10.0 112.062 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 31.6 t70 59.41 -101.27 0.12 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 5.2 m 54.52 -104.28 0.21 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.946 0.498 . . . . 10.0 112.29 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -81.51 32.36 0.35 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.969 0.414 . . . . 10.0 111.518 -179.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 398' ' ' ALA . . . . . 0.549 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -67.1 -18.83 65.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.99 0.424 . . . . 10.0 110.781 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -74.11 -15.29 61.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.883 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -84.74 -24.6 28.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.979 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 401' ' ' PHE . . . . . 0.549 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 22.5 m-85 -56.57 -54.49 45.36 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.741 0.305 . . . . 10.0 111.629 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.7 m -76.47 -8.81 57.94 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 40.7 m -95.47 -47.46 6.26 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -178.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 20.0 mt -86.13 -74.13 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.264 0.468 . . . . 10.0 112.264 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 405' ' ' TYR . . . . . 0.522 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 68.7 m-85 -78.95 -8.04 58.55 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.482 0.549 . . . . 10.0 112.482 -177.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm 62.13 58.82 1.75 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.12 0.486 . . . . 10.0 110.763 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 2.4 mt -114.29 156.56 24.15 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.429 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . 0.455 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . 20.3 t0 -95.46 147.06 23.94 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.61 -0.885 . . . . 10.0 108.61 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 1.8 m -109.13 104.5 13.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.888 0.375 . . . . 10.0 111.324 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 5.9 t -114.71 129.01 71.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.667 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 61.5 t -90.48 123.59 42.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 110.04 -0.355 . . . . 10.0 110.04 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 50.1 t -90.73 126.65 55.17 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.842 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.17 150.39 88.42 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.556 2.171 . . . . 10.0 111.966 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 16.4 p -77.23 164.24 25.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.015 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -68.63 -35.59 77.5 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.764 -0.828 . . . . 10.0 108.764 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 55.7 mmt-85 -134.69 143.21 45.51 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 114.944 -1.025 . . . . 10.0 108.829 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -60.64 136.63 68.17 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.662 2.241 . . . . 10.0 112.896 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 73.8 mtm -84.92 130.35 34.66 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.324 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.1 mt -111.51 36.13 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.364 0.602 . . . . 10.0 109.962 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 420' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 420' ' ' ARG . 35.4 ttp180 -71.38 123.39 22.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.031 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 14.4 mttm -83.11 99.6 10.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.29 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 422' ' ' ASP . . . . . 0.53 ' OD1' ' HD2' ' A' ' 572' ' ' ARG . 9.0 m-20 -86.46 110.57 19.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.496 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 43.9 mt -94.61 157.28 37.35 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.358 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -71.42 176.29 8.21 Favored 'Trans proline' 0 C--O 1.238 0.489 0 C-N-CA 122.739 2.293 . . . . 10.0 112.894 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -86.63 115.76 24.3 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.445 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 9.9 mt -89.7 87.36 6.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.13 0.49 . . . . 10.0 109.792 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 427' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 588' ' ' LEU . 8.9 t -86.3 126.55 40.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.748 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 428' ' ' TYR . . . . . 0.416 ' O ' ' HG2' ' A' ' 590' ' ' MET . 5.3 m-85 -112.14 177.49 4.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.234 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 84.9 mmm -71.76 -77.04 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.633 0.254 . . . . 10.0 111.396 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 67.0 p -88.12 157.51 18.82 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.96 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -61.27 -30.45 70.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.468 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -60.13 -39.96 88.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.221 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -64.84 -41.2 95.92 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.034 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 434' ' ' LYS . . . . . 0.454 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 38.8 ttpt -59.19 -51.47 69.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.061 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 46.5 mm -63.1 -44.25 99.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.593 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 440' ' ' GLU . 24.7 tp60 -57.65 -45.17 85.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.866 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -63.11 -37.65 88.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.805 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 88.8 mt -59.67 -44.25 93.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.097 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 30.3 mm -62.09 -38.87 81.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.013 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 436' ' ' GLN . 5.9 mm-40 -65.05 -42.44 94.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.871 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . 0.592 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 15.2 t70 -67.71 -42.45 81.96 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 179.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 56.1 mt -58.07 -41.38 80.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.694 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -59.97 -40.9 90.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.15 0.5 . . . . 10.0 110.596 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . 0.461 ' CD ' ' HZ2' ' A' ' 448' ' ' LYS . 0.1 OUTLIER -64.95 -28.12 69.3 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.564 -0.744 . . . . 10.0 111.074 -179.889 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.592 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 14.3 mmt180 -86.11 -43.11 13.33 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.908 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.54 -42.49 98.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.619 -0.264 . . . . 10.0 111.362 -179.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -71.83 -9.93 59.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.471 -0.332 . . . . 10.0 111.232 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' LYS . . . . . 0.461 ' HZ2' ' CD ' ' A' ' 444' ' ' GLU . 4.1 ttmm -104.69 -4.48 22.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.642 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 79.3 30.15 46.97 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.837 -0.697 . . . . 10.0 112.418 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 -108.33 131.28 21.86 Favored Pre-proline 0 C--N 1.327 -0.391 0 O-C-N 122.796 -0.238 . . . . 10.0 111.027 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -69.63 143.71 52.36 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.684 2.256 . . . . 10.0 111.442 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 49.0 t -120.42 125.46 74.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.874 0.369 . . . . 10.0 111.676 -178.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 32.5 tp -113.1 105.82 13.92 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 39.6 t -93.4 122.66 45.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.452 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -105.24 91.64 0.78 Allowed Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.14 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.32 140.08 29.9 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.363 -0.236 . . . . 10.0 110.363 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 20.9 pt -77.76 -35.94 21.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 112.506 0.558 . . . . 10.0 112.506 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 7.4 p -122.99 159.45 28.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.95 0.405 . . . . 10.0 112.023 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 74.5 mt -64.72 -36.98 78.96 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -56.52 -46.63 80.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.988 -1.005 . . . . 10.0 110.327 178.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.13 -32.89 72.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.439 179.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 17.2 m -64.39 -44.44 91.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.134 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -68.85 -40.44 79.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.322 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.9 -53.83 54.02 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.417 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.63 -31.59 54.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-O 120.92 0.39 . . . . 10.0 110.877 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 35.4 t -68.63 -41.05 80.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.119 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -59.86 -48.85 80.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.592 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -64.24 -39.51 94.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.866 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 19.8 mt -62.92 -34.43 77.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.986 0.422 . . . . 10.0 110.628 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 7.9 m -71.83 -42.73 66.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.734 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -61.75 -39.5 91.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.372 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -72.76 -18.27 61.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.855 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 79.72 47.93 6.95 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.062 -0.589 . . . . 10.0 112.706 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 65.9 mt -118.77 128.43 75.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 110.396 -0.224 . . . . 10.0 110.396 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 21.5 mmtm -62.24 129.75 42.22 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 54.9 p-80 -161.0 149.49 16.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.759 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -127.53 157.72 39.37 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.209 -0.451 . . . . 10.0 109.842 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.6 t -121.6 130.76 74.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.662 0.268 . . . . 10.0 111.027 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 90.3 mt -83.5 90.08 7.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.599 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -85.16 126.65 33.81 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.433 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -61.23 -22.83 65.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.692 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -85.93 -2.45 58.28 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.066 0.46 . . . . 10.0 110.57 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -130.49 59.41 1.65 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.312 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -61.68 -33.82 74.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.056 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.49 74.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.864 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.54 -33.48 17.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.891 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.5 -57.38 9.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.6 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -54.2 -39.78 66.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.585 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -66.13 -35.75 81.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.246 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 47.9 mt -74.66 -41.99 48.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.493 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 95.6 t -60.41 -34.83 59.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.746 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -59.6 -28.4 67.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.634 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -124.39 26.94 7.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.922 0.391 . . . . 10.0 110.57 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -74.55 -21.9 59.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.17 0.51 . . . . 10.0 110.655 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -94.82 16.23 61.7 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.98 -0.629 . . . . 10.0 111.737 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -74.28 138.01 75.16 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 110.115 -0.328 . . . . 10.0 110.115 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.05 125.84 19.6 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.661 2.24 . . . . 10.0 112.952 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.5 22.33 6.43 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.067 0.766 . . . . 10.0 113.067 178.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -100.95 122.73 44.0 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 121.122 -0.231 . . . . 10.0 110.491 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 35.3 t -97.95 115.64 38.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.912 0.387 . . . . 10.0 110.44 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.9 m -115.33 121.88 44.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.572 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 47.7 mt -101.19 124.36 54.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.271 -0.422 . . . . 10.0 109.94 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -114.44 116.54 29.03 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.817 0.342 . . . . 10.0 111.182 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 21.4 m -81.13 113.94 19.63 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.586 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 63.83 81.46 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.326 -0.852 . . . . 10.0 110.883 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 53.4 tpp -60.95 122.46 14.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.248 -0.887 . . . . 10.0 110.957 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -87.69 166.73 14.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.886 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -65.56 157.7 47.4 Favored Glycine 0 N--CA 1.453 -0.187 0 C-N-CA 121.219 -0.515 . . . . 10.0 112.471 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 68.98 -93.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.977 0.511 . . . . 10.0 110.861 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 88.8 132.78 4.42 Favored Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 121.1 -0.572 . . . . 10.0 111.843 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.62 143.28 25.24 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.499 0.32 . . . . 10.0 110.926 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -64.67 98.6 0.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.646 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 70.4 mt -73.6 101.94 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.129 0.49 . . . . 10.0 109.819 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' VAL . . . . . 0.42 ' HB ' ' O ' ' A' ' 517' ' ' GLY . 6.3 t -71.67 132.02 33.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.865 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.463 HD12 ' OD1' ' A' ' 580' ' ' ASP . 34.0 mt -66.37 125.83 26.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.591 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 93.36 -0.81 68.81 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.101 -0.571 . . . . 10.0 111.847 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' GLY . . . . . 0.42 ' O ' ' HB ' ' A' ' 514' ' ' VAL . . . 106.2 -167.91 14.58 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 110.986 -0.846 . . . . 10.0 110.986 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.9 p -127.06 98.18 5.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 117.278 0.539 . . . . 10.0 110.991 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 52.9 p-90 -58.51 -29.47 66.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.877 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -62.25 -30.01 70.81 Favored 'General case' 0 C--N 1.334 -0.077 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.783 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -86.25 -34.42 20.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.467 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -65.89 -43.95 86.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.612 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.1 m -70.48 -20.07 22.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.94 0.4 . . . . 10.0 110.593 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -91.87 -0.1 57.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -90.29 -10.79 42.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.573 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 44.2 mt -96.04 154.0 17.47 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.834 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -72.62 -57.11 4.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.85 0.357 . . . . 10.0 110.152 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -119.2 88.6 37.76 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.975 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.05 103.3 1.16 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.996 2.464 . . . . 10.0 111.515 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 18.8 p -81.56 173.39 12.43 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.358 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.75 -43.23 80.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.484 0.183 . . . . 10.0 111.446 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -62.28 -41.02 98.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.887 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -68.24 -44.43 75.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.952 0.406 . . . . 10.0 110.408 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 90.3 mt -64.33 -42.48 95.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.254 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -64.89 -42.52 94.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.481 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -58.32 -51.6 69.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.344 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.83 -37.31 79.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.29 -0.413 . . . . 10.0 110.665 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -62.18 -47.68 83.41 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.977 0.418 . . . . 10.0 110.303 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -69.54 -37.82 77.24 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.504 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . 0.561 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 13.2 t70 -61.31 -49.13 78.28 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.238 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -60.43 -39.81 88.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.867 -1.061 . . . . 10.0 110.337 179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 -52.05 -48.61 64.52 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.308 0.38 . . . . 10.0 110.914 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 26.0 t -60.09 -47.44 91.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.91 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 544' ' ' ARG . . . . . 0.561 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 6.2 mtm180 -67.99 -35.73 78.82 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.925 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -64.29 -48.55 75.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.474 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.37 -31.23 71.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.458 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.5 94.76 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.434 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.43 -37.64 80.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.464 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.23 -45.82 89.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.048 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -70.18 -18.41 63.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.022 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -82.92 -28.46 29.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.961 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 129.97 6.34 4.06 Favored Glycine 0 CA--C 1.519 0.324 0 C-N-CA 120.445 -0.883 . . . . 10.0 113.302 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 84.12 -167.6 43.78 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.67 -0.776 . . . . 10.0 112.43 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 36.6 tp -71.67 119.56 16.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.908 0.385 . . . . 10.0 110.879 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -91.45 118.94 30.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.748 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 25.3 mm -103.22 134.99 42.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.289 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 40.6 mt -126.48 121.59 59.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.018 0.437 . . . . 10.0 110.691 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.38 115.71 4.99 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.115 -0.794 . . . . 10.0 111.115 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 20.5 p -71.51 -40.3 70.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.021 0.439 . . . . 10.0 111.266 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -137.55 151.27 48.21 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.036 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 561' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 561' ' ' ARG . 3.5 mmt85 -90.88 150.7 21.42 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -94.94 146.24 24.37 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.806 -0.358 . . . . 10.0 110.588 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -59.46 -51.95 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.05 117.27 16.71 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.233 -0.894 . . . . 10.0 110.127 179.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 565' ' ' ARG . . . . . 0.506 ' HA ' ' HB3' ' A' ' 568' ' ' ASP . 17.1 tpt180 -66.33 -26.62 67.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.125 -0.488 . . . . 10.0 110.216 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -58.87 -36.84 75.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.526 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 59.9 mt -92.75 -34.78 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.646 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 568' ' ' ASP . . . . . 0.506 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 2.2 t70 -60.89 -44.81 96.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.101 0.477 . . . . 10.0 110.693 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -69.55 -24.82 63.77 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.933 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -66.52 -26.83 67.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.747 0.308 . . . . 10.0 110.49 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 57.2 tp -73.13 -33.94 65.82 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 572' ' ' ARG . . . . . 0.53 ' HD2' ' OD1' ' A' ' 422' ' ' ASP . 13.5 ttp180 -76.66 -30.68 56.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.078 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.82 27.77 3.34 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 121.011 -0.614 . . . . 10.0 113.525 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.46 -54.92 5.85 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 179.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.78 172.63 10.65 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.994 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 85.11 47.39 5.27 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.692 -0.766 . . . . 10.0 111.573 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 577' ' ' ARG . . . . . 0.537 ' H ' ' HB3' ' A' ' 580' ' ' ASP . 54.4 mtt180 -108.53 121.16 44.39 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.185 -0.302 . . . . 10.0 110.185 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 59.46 28.99 18.5 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.701 0.63 . . . . 10.0 112.701 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 104.75 4.47 42.54 Favored Glycine 0 N--CA 1.454 -0.111 0 C-N-CA 120.292 -0.956 . . . . 10.0 113.866 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 580' ' ' ASP . . . . . 0.537 ' HB3' ' H ' ' A' ' 577' ' ' ARG . 0.9 OUTLIER -67.79 157.8 33.93 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.942 0.371 . . . . 10.0 110.253 179.23 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -92.7 -103.99 0.12 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.572 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 97.75 175.61 33.78 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.696 -0.764 . . . . 10.0 112.3 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -153.8 120.63 5.63 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.328 -0.249 . . . . 10.0 110.328 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.97 119.64 34.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.818 0.342 . . . . 10.0 110.864 -179.423 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -117.51 113.54 22.15 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.136 -0.483 . . . . 10.0 109.959 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -102.87 147.0 27.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.897 0.379 . . . . 10.0 111.035 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 587' ' ' TYR . . . . . 0.454 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 31.4 m-85 -135.33 158.14 45.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.474 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 588' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 427' ' ' VAL . 10.1 tp -165.78 163.26 18.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.239 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 589' ' ' SER . . . . . 0.497 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.6 OUTLIER -124.1 159.48 29.88 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.558 -0.292 . . . . 10.0 110.33 179.275 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 590' ' ' MET . . . . . 0.416 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 77.9 mmm -74.7 -17.95 60.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.222 0.534 . . . . 10.0 110.282 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -111.03 24.17 13.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.275 -0.875 . . . . 10.0 109.088 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 592' ' ' ASP . . . . . 0.497 ' HB2' ' O ' ' A' ' 589' ' ' SER . 0.9 OUTLIER -76.32 176.82 7.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.127 -0.942 . . . . 10.0 111.954 -178.71 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -82.32 -28.65 31.54 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.661 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 9.3 tp -70.62 -13.42 62.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.142 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 16.3 mmt -76.06 12.08 1.26 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.969 0.414 . . . . 10.0 111.559 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.505 ' HA ' ' NH1' ' A' ' 596' ' ' ARG . 10.9 mmm180 -110.87 -4.03 15.4 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.572 -0.286 . . . . 10.0 111.059 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 28.0 pt -82.82 -10.16 11.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 121.22 0.533 . . . . 10.0 110.459 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -87.8 3.85 46.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.53 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.42 -83.2 0.03 OUTLIER 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.281 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 3.2 m -69.96 125.47 26.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.864 0.364 . . . . 10.0 110.825 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -69.36 -15.95 63.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.984 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -64.94 -32.48 74.22 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.051 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.5 t -61.95 -55.35 24.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.21 0.528 . . . . 10.0 109.69 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 3.6 m -66.19 -35.52 80.65 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.675 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -65.57 -38.01 94.24 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.453 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 29.9 tpp -73.13 -26.07 61.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.098 0.475 . . . . 10.0 110.757 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 51.9 mtt -72.35 -12.6 61.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.73 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -76.13 -7.19 54.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.019 0.438 . . . . 10.0 110.725 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -83.25 9.37 10.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.085 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 6.3 mp -80.9 -16.01 54.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.014 0.435 . . . . 10.0 110.478 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 89.97 -48.61 3.25 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.0 -0.619 . . . . 10.0 112.562 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 69.3 -66.65 0.25 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.394 0.677 . . . . 10.0 111.387 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 613' ' ' LYS . . . . . 0.469 ' HZ3' ' CD ' ' A' ' 616' ' ' GLU . 30.3 ttmt 66.32 94.23 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.249 0 O-C-N 123.527 0.517 . . . . 10.0 110.686 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 614' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -50.29 107.85 0.19 Allowed 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 123.26 2.64 . . . . 10.0 112.994 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 118.82 -17.47 10.88 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.734 -0.746 . . . . 10.0 112.288 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 616' ' ' GLU . . . . . 0.469 ' CD ' ' HZ3' ' A' ' 613' ' ' LYS . 18.3 tt0 -93.8 132.68 37.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.953 0.406 . . . . 10.0 110.788 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -102.9 91.6 4.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.475 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 6.4 tp -66.75 -35.69 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.548 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 47.45 66.7 0.95 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.576 -0.738 . . . . 10.0 112.193 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 3.3 m170 -109.04 114.73 57.88 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.606 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.86 -15.88 40.85 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.158 2.572 . . . . 10.0 114.207 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -63.58 -29.02 70.33 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.75 -0.38 . . . . 10.0 110.494 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 23.4 t -69.44 -46.16 76.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 87.9 m -59.21 -44.08 92.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.015 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.47 -31.7 72.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.97 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -70.9 -40.84 71.94 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.944 -0.391 . . . . 10.0 109.944 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 97.2 mt -66.53 -49.11 77.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.434 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -58.66 -35.88 73.27 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.968 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -64.92 -41.05 95.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.935 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -69.53 -40.63 76.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.894 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -60.17 -44.17 95.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.314 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 52.9 ttt85 -65.67 -32.6 74.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.35 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 55.4 mttt -65.27 -35.95 82.6 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.649 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.47 -44.17 98.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 109.253 -0.647 . . . . 10.0 109.253 178.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -66.0 -39.12 90.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.383 -0.826 . . . . 10.0 110.096 179.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 19.7 m -64.62 -33.52 76.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.048 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -66.94 -36.5 82.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.28 0.562 . . . . 10.0 109.532 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -64.7 -36.83 85.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.309 -0.86 . . . . 10.0 110.007 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -59.04 -40.29 84.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.467 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -61.28 -41.35 96.81 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.077 0.465 . . . . 10.0 110.185 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 43.2 mt -66.35 -42.46 90.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.986 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 642' ' ' ARG . . . . . 0.594 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 2.1 mmm180 -62.68 -42.06 99.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.98 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -59.64 -40.7 88.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.336 -0.847 . . . . 10.0 110.687 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -63.17 -39.31 94.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.281 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 78.6 mt -69.5 -38.62 77.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.38 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 646' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 89.9 mt -60.1 -36.33 77.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.881 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -68.13 -20.65 64.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.494 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -96.02 -44.15 7.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.19 0.519 . . . . 10.0 110.361 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -69.18 -27.86 65.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.839 -0.619 . . . . 10.0 112.026 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -65.28 -30.92 71.83 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.146 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 651' ' ' VAL . . . . . 0.549 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 30.1 t -62.7 -46.7 95.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.57 -30.44 68.23 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.152 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 653' ' ' ASN . . . . . 0.46 ' HA ' ' NH1' ' A' ' 656' ' ' ARG . 13.9 t30 -66.67 -48.0 70.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.539 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.81 -47.24 85.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.869 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 655' ' ' GLN . . . . . 0.549 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 41.4 mt-30 -64.51 -38.69 91.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.257 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 656' ' ' ARG . . . . . 0.46 ' NH1' ' HA ' ' A' ' 653' ' ' ASN . 18.9 ttp-105 -63.7 -48.46 77.0 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.506 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -61.83 -43.92 97.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.537 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -62.93 -50.89 69.06 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.869 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 7.5 tp -69.49 -34.97 64.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 111.984 0.364 . . . . 10.0 111.984 -178.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -68.1 -36.35 79.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.567 0.222 . . . . 10.0 110.584 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 51.3 m -62.0 -48.09 81.89 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -63.6 -45.24 91.27 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.675 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 34.6 ttt-85 -60.4 -35.47 75.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.821 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -71.04 -38.02 72.55 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.686 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -61.93 -49.4 76.3 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 666' ' ' LEU . . . . . 0.472 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 49.4 mt -66.78 -18.25 65.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.795 -0.638 . . . . 10.0 110.713 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 39.5 tp -81.28 -41.57 21.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.008 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -78.65 -40.08 35.19 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.563 0.579 . . . . 10.0 112.563 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 27.4 m -59.68 140.0 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 121.403 0.621 . . . . 10.0 111.58 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 4.1 m -92.8 -10.08 38.14 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.823 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -130.28 160.97 32.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.946 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.01 14.41 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.877 0.37 . . . . 10.0 111.017 -178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 5.7 m -54.21 -58.73 6.26 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.851 0.358 . . . . 10.0 111.827 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 674' ' ' GLU . . . . . 0.418 ' OE2' ' HA ' ' A' ' 674' ' ' GLU . 5.0 mm-40 -63.52 -34.83 78.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 10.0 112.018 -179.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -45.92 87.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.794 0.331 . . . . 10.0 110.272 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 676' ' ' ILE . . . . . 0.478 ' O ' ' HB2' ' A' ' 680' ' ' ARG . 36.0 mm -67.43 -37.68 79.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.142 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -63.71 -47.75 79.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.216 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 44.8 m -55.42 -48.29 74.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.745 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 42.5 pt -75.71 -25.49 17.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.732 -0.387 . . . . 10.0 111.291 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 680' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 676' ' ' ILE . 27.4 ttm-85 -61.66 -45.51 93.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.989 0.423 . . . . 10.0 110.396 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 681' ' ' GLU . . . . . 0.401 ' HG2' HD22 ' A' ' 740' ' ' LEU . 30.0 mt-10 -68.14 -26.89 66.0 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.644 -0.707 . . . . 10.0 111.0 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -80.45 -48.42 12.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.026 -0.533 . . . . 10.0 111.35 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 79.1 t -59.84 -47.93 89.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.44 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -60.86 -39.72 90.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.17 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -61.71 -48.93 78.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.413 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.84 -39.72 82.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.158 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 10.5 m -64.72 -39.47 93.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.374 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -70.47 -48.02 62.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.621 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 689' ' ' ASP . . . . . 0.4 ' HA ' ' O ' ' A' ' 692' ' ' ILE . 4.5 m-20 -58.36 -29.08 65.7 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.873 -179.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -65.13 -26.97 68.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.806 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -115.81 -17.23 11.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.824 0.345 . . . . 10.0 111.457 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 692' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 689' ' ' ASP . 67.0 mt -128.21 105.53 19.84 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.432 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.16 138.64 52.5 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.46 2.107 . . . . 10.0 111.422 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -51.18 108.69 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 123.056 2.504 . . . . 10.0 113.465 -179.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 59.17 80.78 0.18 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.678 -0.692 . . . . 10.0 111.482 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 3.5 p -137.23 -164.35 1.57 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.434 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 89.9 mt -85.69 146.79 26.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.709 -0.223 . . . . 10.0 110.917 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . 0.446 ' HA ' ' CE3' ' A' ' 701' ' ' TRP . 19.5 tt0 -58.07 -39.11 77.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.434 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.17 -16.93 64.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.957 0.408 . . . . 10.0 111.422 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 24.2 ttt -87.0 -14.47 41.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.229 0.538 . . . . 10.0 110.115 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 701' ' ' TRP . . . . . 0.446 ' CE3' ' HA ' ' A' ' 698' ' ' GLU . 43.8 m0 -84.5 120.22 26.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.617 -0.719 . . . . 10.0 110.28 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -85.9 81.72 8.43 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 703' ' ' ILE . . . . . 0.463 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.9 mm -60.98 -48.82 91.45 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.872 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 704' ' ' PRO . . . . . 0.463 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.9 Cg_exo -54.94 -49.12 17.73 Favored 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 122.091 1.861 . . . . 10.0 112.192 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -63.9 -43.18 97.91 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.89 -0.671 . . . . 10.0 112.223 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.506 ' O ' ' HG ' ' A' ' 710' ' ' LEU . 54.0 tp -63.94 -42.13 97.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.547 0.213 . . . . 10.0 110.847 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 707' ' ' GLN . . . . . 0.479 ' O ' ' HD3' ' A' ' 711' ' ' LYS . 9.3 mt-30 -62.03 -50.73 70.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.759 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.98 -36.17 78.74 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -62.31 -48.23 80.75 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.278 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 710' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 706' ' ' LEU . 88.0 mt -64.33 -34.69 78.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.787 0.327 . . . . 10.0 111.219 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . 0.479 ' HD3' ' O ' ' A' ' 707' ' ' GLN . 8.6 mtpp -74.89 -14.91 60.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.261 -0.427 . . . . 10.0 112.125 -179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -110.15 -45.17 3.63 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.743 0.306 . . . . 10.0 111.618 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -73.06 -41.99 63.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.322 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -109.66 -8.51 14.95 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.988 -0.285 . . . . 10.0 111.7 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 715' ' ' ASP . . . . . 0.464 ' HB2' ' HA ' ' A' ' 828' ' ' LYS . 0.2 OUTLIER 61.64 29.74 18.3 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.098 179.741 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 36.7 tp -117.01 127.73 54.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.861 0.362 . . . . 10.0 110.721 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -90.1 106.38 18.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.39 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 41.7 mt -118.26 119.58 33.09 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.918 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.13 71.38 6.71 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.948 2.432 . . . . 10.0 112.254 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 58.0 mt -64.34 -42.37 95.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.843 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -63.38 -27.88 69.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.963 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -73.69 -47.24 41.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.309 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -66.7 -40.44 88.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.18 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 35.5 tp -58.94 -24.24 62.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.506 -0.77 . . . . 10.0 112.88 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.17 -28.95 13.87 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.814 0.302 . . . . 10.0 111.814 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -86.8 -36.82 18.32 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.178 0.436 . . . . 10.0 112.178 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -120.83 90.07 46.15 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-O 120.739 0.304 . . . . 10.0 110.916 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.31 -14.57 34.48 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.506 2.138 . . . . 10.0 111.663 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.17 -6.59 53.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.388 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 50.0 mt -68.79 -37.56 79.36 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.801 0.334 . . . . 10.0 110.458 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 54.57 -101.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.461 -0.791 . . . . 10.0 111.806 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.84 -55.35 0.77 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.322 . . . . 10.0 111.296 -178.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -56.4 -54.91 40.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.542 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 1.8 m -63.11 -28.61 70.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.996 0.426 . . . . 10.0 110.982 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 5.5 tp -65.24 -43.23 92.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -60.57 -46.92 88.41 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.441 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -58.44 -46.0 87.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.535 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 26.4 mmm-85 -56.92 -41.46 78.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.071 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 96.3 mt -66.9 -47.32 82.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.723 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 740' ' ' LEU . . . . . 0.401 HD22 ' HG2' ' A' ' 681' ' ' GLU . 60.1 tp -62.8 -51.4 67.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.815 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -60.49 -44.19 96.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.739 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -59.82 -35.62 75.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.626 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 20.3 m -69.16 -40.57 78.07 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.454 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 76.3 mt -64.46 -38.59 82.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.312 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.18 -53.79 54.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.756 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 48.5 t -61.45 -37.29 77.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.422 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -60.63 -46.01 91.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.624 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -61.52 -39.84 92.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.847 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -62.1 -37.13 83.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.615 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -70.41 -39.56 74.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.096 0.474 . . . . 10.0 110.1 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 51.2 tt0 -59.89 -37.98 80.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.41 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -61.19 -24.61 66.44 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.888 0.329 . . . . 10.0 111.888 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 34.1 t -88.44 -46.08 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.84 0.352 . . . . 10.0 111.374 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.0 -39.17 50.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.91 0.386 . . . . 10.0 111.327 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.64 138.24 5.14 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.169 -0.772 . . . . 10.0 111.169 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 756' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -58.51 -60.63 3.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.86 0.362 . . . . 10.0 111.811 -178.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -66.71 -34.24 77.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.908 0.385 . . . . 10.0 110.74 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 8.4 tpt -63.68 -42.52 98.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.484 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 59.3 mmm -62.75 -41.72 99.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.331 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.3 mmp_? -58.2 -39.03 77.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.084 0.469 . . . . 10.0 110.3 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.89 -37.11 72.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.175 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -66.7 -48.81 68.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.024 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -58.42 -46.3 86.73 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.155 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 764' ' ' LYS . . . . . 0.472 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 79.2 tttt -59.48 -45.17 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.989 -0.551 . . . . 10.0 110.108 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.53 -43.28 99.25 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.758 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.1 -42.96 97.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.615 0.245 . . . . 10.0 110.416 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 31.3 mtp -61.43 -50.79 71.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.363 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 97.2 mt -61.04 -45.15 95.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.897 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 769' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' B' ' 24' ' ' ALA . 41.1 tt0 -59.53 -52.18 66.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.025 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 13.5 m -58.6 -45.94 88.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.758 0.313 . . . . 10.0 111.024 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.11 -46.05 90.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.466 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -62.75 -45.67 91.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.094 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 773' ' ' SER . . . . . 0.52 ' HB3' ' HB3' ' B' ' 22' ' ' MET . 15.7 m -63.44 -44.41 94.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.718 -0.674 . . . . 10.0 111.094 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 22.8 mt -65.73 -40.07 91.79 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.841 0.353 . . . . 10.0 110.838 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -59.9 -39.25 84.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.927 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.422 ' HE3' HD11 ' A' ' 372' ' ' LEU . 25.1 mttp -61.39 -48.67 80.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.289 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 12.6 tm-20 -65.87 -44.23 85.99 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -57.32 -33.5 67.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.471 -0.786 . . . . 10.0 111.426 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.6 mt -61.91 -53.67 52.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.745 0.307 . . . . 10.0 110.593 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -66.91 -40.31 87.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.801 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.04 -43.95 91.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.762 -0.654 . . . . 10.0 111.495 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 63.2 mmm -61.38 -49.25 77.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.427 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 783' ' ' ASP . . . . . 0.53 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 10.4 t70 -66.19 -39.11 89.43 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.924 -0.31 . . . . 10.0 111.099 -179.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -61.05 -34.52 75.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.87 0.367 . . . . 10.0 110.92 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.3 tp -79.52 -33.98 41.58 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 178.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -62.68 -40.77 98.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.921 -1.036 . . . . 10.0 110.999 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 787' ' ' GLN . . . . . 0.53 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 10.7 pt20 -88.48 9.05 25.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.148 0.499 . . . . 10.0 110.474 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -114.72 31.11 6.5 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.9 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 23.7 mm -78.37 65.16 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 121.773 0.797 . . . . 10.0 110.438 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -127.21 -60.62 1.19 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.628 -0.878 . . . . 10.0 108.628 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 99.4 mt -87.28 -3.51 59.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.934 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -105.56 10.4 33.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.582 -0.736 . . . . 10.0 109.551 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -137.12 146.37 18.28 Favored Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 115.56 -0.746 . . . . 10.0 111.664 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -144.21 -174.49 4.3 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 110.461 -0.2 . . . . 10.0 110.461 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -77.16 158.66 30.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.319 -0.401 . . . . 10.0 111.125 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 67.22 15.8 10.07 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.284 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 9.8 tptm -139.47 145.93 39.41 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.076 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -98.23 143.49 26.38 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -52.65 -34.44 63.67 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.435 2.09 . . . . 10.0 112.074 178.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.76 154.56 33.91 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 74.87 -52.58 0.67 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.945 0.498 . . . . 10.0 109.786 -178.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -62.03 -51.37 68.27 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.157 -0.474 . . . . 10.0 109.955 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -62.31 -31.41 72.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.378 0.608 . . . . 10.0 109.972 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -67.4 -32.69 73.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.72 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 38.2 mtm105 -57.3 -47.52 81.28 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.251 0.548 . . . . 10.0 109.734 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.48 -43.69 76.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.389 -0.823 . . . . 10.0 110.756 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 17.2 m -60.29 -44.19 95.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.737 -0.665 . . . . 10.0 112.01 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -69.27 -43.17 74.45 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.159 -0.216 . . . . 10.0 110.89 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 19.4 m -61.73 -39.06 90.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.946 0.403 . . . . 10.0 110.261 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 37.4 ttm -64.01 -40.38 96.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.168 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -68.02 -40.35 82.95 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.387 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.19 91.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.369 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -63.03 -36.12 82.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.368 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 12.8 ttt -62.9 -45.47 92.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.446 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.9 -42.43 97.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.541 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -63.84 -37.39 87.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.432 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 37.4 m -72.3 -30.7 65.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.617 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 24.6 tp -56.97 -57.61 11.76 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.99 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 40.9 pttt -65.26 -32.48 74.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.959 0.409 . . . . 10.0 110.513 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -61.82 -58.4 8.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.934 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -62.9 -36.62 83.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.852 -178.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 39.9 t -61.58 -54.62 32.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 120.643 0.259 . . . . 10.0 110.655 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 41.1 mm -63.42 -38.99 83.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.698 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 40.7 t -60.23 -50.69 72.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.738 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 28.5 m -59.43 -45.76 90.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.703 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 92.8 mt -62.32 -24.86 67.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 10.0 112.047 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 6.6 m -94.59 -37.86 11.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.687 0.279 . . . . 10.0 111.403 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 828' ' ' LYS . . . . . 0.464 ' HA ' ' HB2' ' A' ' 715' ' ' ASP . 29.4 mtpp -69.29 -25.42 64.24 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.536 0.569 . . . . 10.0 112.536 -178.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.08 115.34 9.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.43 0.634 . . . . 10.0 110.404 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -100.97 140.15 35.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.898 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 6.9 m -130.65 174.75 12.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.081 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 13.5 ptt-85 -73.26 100.4 3.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.117 0.484 . . . . 10.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 1.6 ttp -106.32 103.63 46.53 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.137 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -78.82 -175.35 2.7 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.679 2.253 . . . . 10.0 111.613 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -66.78 125.02 24.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.029 0.442 . . . . 10.0 110.585 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.555 -0.736 . . . . 10.0 109.73 179.715 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.1 tmm? . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.799 -0.445 . . . . 10.0 109.799 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -74.81 152.56 38.98 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.639 0.257 . . . . 10.0 110.318 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 19.7 mt -81.15 78.73 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.376 0.608 . . . . 10.0 110.04 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 7.3 m -90.56 103.83 16.48 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.624 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 89.7 mt -74.12 77.52 1.75 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.133 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.15 134.62 43.91 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.145 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -92.06 134.25 35.0 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.041 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 13.6 mtm-85 -86.5 -142.59 0.1 Allowed 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.825 -0.805 . . . . 10.0 108.825 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 -85.25 158.12 20.41 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.785 -0.766 . . . . 10.0 109.97 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 13.9 ptpt -59.48 156.68 12.68 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.385 0.612 . . . . 10.0 112.472 -178.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mp -114.71 100.52 53.43 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.569 -0.741 . . . . 10.0 110.397 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -73.43 71.7 3.75 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.665 2.243 . . . . 10.0 111.783 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 36.4 mt -119.91 -88.4 0.62 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.211 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . 0.428 ' CB ' ' HB ' ' A' ' 291' ' ' ILE . . . -76.82 -21.55 54.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.986 0.422 . . . . 10.0 110.802 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -69.57 -21.35 24.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.278 0.561 . . . . 10.0 109.848 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.2 -16.96 60.96 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.747 -0.661 . . . . 10.0 110.263 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 78.5 t -63.66 -32.67 57.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.092 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.4 97.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.137 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.6 -12.66 60.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.721 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . 0.503 ' HA2' ' SD ' ' A' ' 235' ' ' MET . . . -71.71 -33.67 63.25 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 111.563 -0.615 . . . . 10.0 111.563 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 10.9 t -69.36 -22.12 25.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.773 0.797 . . . . 10.0 109.424 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.52 ' HB3' ' HB3' ' A' ' 773' ' ' SER . 27.8 mtt -92.59 56.02 2.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.981 -1.009 . . . . 10.0 110.379 -179.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 74.4 m -85.86 95.61 9.5 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.278 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . 0.422 ' O ' ' HG3' ' A' ' 769' ' ' GLN . . . -156.74 56.86 0.54 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.265 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -83.34 141.83 31.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.824 -179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -76.88 -14.82 59.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.946 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 12.9 tpt -72.46 140.01 48.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.457 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.456 -0.783 . . . . 10.0 110.687 -179.985 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.491 ' H2 ' ' CD ' ' A' ' 96' ' ' GLU . 8.7 p . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -68.11 130.38 42.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.728 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 142.43 163.26 9.6 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.804 -0.713 . . . . 10.0 112.157 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.94 160.57 9.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.795 0.331 . . . . 10.0 110.692 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.558 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 3.9 mmp_? -77.05 146.52 37.26 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 60.63 -89.88 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.93 -1.032 . . . . 10.0 113.685 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -46.22 -62.9 1.14 Allowed 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.905 1.076 . . . . 10.0 113.905 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -66.17 -31.67 72.66 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -178.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.406 ' O ' ' HG3' ' A' ' 21' ' ' MET . 0.2 OUTLIER -66.46 -48.77 68.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.726 0.298 . . . . 10.0 110.899 -179.835 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.92 -36.18 78.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.364 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -47.01 87.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.86 0.362 . . . . 10.0 110.375 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 20' ' ' ARG . 2.6 ttp85 -67.21 -33.85 76.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.095 0.474 . . . . 10.0 110.354 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.676 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 62.1 mtt -69.86 -37.4 76.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.334 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.7 tpp180 -62.07 -33.73 74.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.111 -0.495 . . . . 10.0 109.996 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -63.21 -41.14 99.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.766 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.6 t -68.2 -36.65 76.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.659 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -60.24 -37.59 74.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.078 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -62.55 -38.92 91.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.581 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.9 mt -68.12 -42.54 85.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.938 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 79.1 mt -60.78 -39.55 82.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.288 0.565 . . . . 10.0 109.843 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -67.86 -21.97 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.819 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -86.45 -23.1 26.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.58 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.9 mmt -84.77 -23.01 29.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.616 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.596 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 16.3 tt0 -55.84 -52.11 75.0 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 112.423 0.527 . . . . 10.0 112.423 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.473 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 75.8 Cg_exo -52.23 -37.41 70.24 Favored 'Trans proline' 0 C--N 1.361 1.195 0 C-N-CA 121.957 1.771 . . . . 10.0 112.399 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -72.32 -39.06 68.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.393 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 22.7 mmt -65.42 -39.29 91.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.593 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 28.7 mt-10 -63.92 -25.22 68.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.257 0.551 . . . . 10.0 110.06 178.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -82.33 -30.68 30.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.078 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.3 mp -73.25 148.42 43.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.474 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.6 p -75.45 167.42 21.93 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.387 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.9 -37.51 87.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.53 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -68.92 -32.52 72.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.511 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -66.37 -33.72 76.35 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.508 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.32 -46.12 88.15 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.7 ttpt -61.92 -34.13 75.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.08 -0.964 . . . . 10.0 109.481 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.06 -34.37 86.47 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.684 -0.689 . . . . 10.0 111.421 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -66.54 -36.2 82.09 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.024 -0.362 . . . . 10.0 110.024 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.7 m -61.7 -45.68 92.93 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.158 0.504 . . . . 10.0 109.647 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.11 -33.41 75.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.775 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -60.7 -47.7 85.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.292 -0.867 . . . . 10.0 110.284 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -61.42 -41.12 96.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.976 0.417 . . . . 10.0 109.979 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -59.06 -40.27 84.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.529 -0.759 . . . . 10.0 110.402 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -77.59 -36.47 51.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.368 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.409 HH12 ' CD ' ' A' ' 66' ' ' GLU . 63.2 mtp180 -64.68 -31.19 72.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.519 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.1 mt -60.4 -31.99 70.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.844 0.354 . . . . 10.0 110.8 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.5 -28.43 66.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.502 . . . . 10.0 110.479 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -76.23 -14.53 60.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.658 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 110.32 22.36 6.51 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.805 -0.712 . . . . 10.0 112.287 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -73.22 144.43 46.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.785 0.326 . . . . 10.0 110.153 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.0 t -86.86 136.72 22.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.164 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.9 tp -62.34 -39.64 93.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.108 0.48 . . . . 10.0 110.1 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -69.87 -16.48 63.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.21 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -90.9 -15.3 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.403 0.62 . . . . 10.0 110.259 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.0 mt -86.42 -11.98 50.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.104 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.484 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 85.0 mt -50.38 -51.89 59.72 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 113.459 0.911 . . . . 10.0 113.459 -178.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.484 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 52.2 Cg_exo -53.12 -35.89 74.62 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 122.164 1.91 . . . . 10.0 113.488 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.409 ' CD ' HH12 ' A' ' 53' ' ' ARG . 44.5 mt-10 -89.74 -45.45 9.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.724 0.297 . . . . 10.0 111.507 -179.027 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.1 -47.88 84.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.232 -0.44 . . . . 10.0 112.142 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -64.12 -30.67 71.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.721 0.296 . . . . 10.0 110.67 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.13 -43.95 81.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 10.0 109.965 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 47.5 t -61.33 -43.58 96.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.827 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.01 -46.19 97.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.318 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.423 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 11.6 ttm180 -60.64 -41.54 95.14 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.18 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.478 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 18.9 tp10 -63.95 -50.87 66.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.575 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.49 -33.33 71.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.035 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 46.3 m -59.32 -42.82 92.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.282 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.478 ' HE2' ' HA ' ' A' ' 73' ' ' GLU . 40.1 mtmt -73.19 -16.98 61.41 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.299 0.481 . . . . 10.0 112.299 -178.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 -100.13 -37.13 9.08 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.993 -0.283 . . . . 10.0 111.636 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 85.5 t -82.96 -51.45 14.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 120.785 0.326 . . . . 10.0 111.796 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -99.71 -38.31 8.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.928 0.394 . . . . 10.0 111.206 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.39 4.43 49.95 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.94 -0.648 . . . . 10.0 111.517 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 63.9 mtt -111.26 138.13 48.11 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -90.48 135.32 33.77 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.857 0.36 . . . . 10.0 110.673 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.68 112.15 4.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.854 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -59.14 152.83 19.47 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.25 0.547 . . . . 10.0 111.778 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -61.82 -36.55 81.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.286 -0.87 . . . . 10.0 111.644 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.6 m -64.67 -31.62 54.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.06 0.457 . . . . 10.0 110.894 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -73.21 -27.9 61.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.281 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 97.7 mt -66.28 -33.88 76.73 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.718 -0.475 . . . . 10.0 109.718 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.91 -50.07 67.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.471 178.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -62.56 -32.5 83.48 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.317 -0.856 . . . . 10.0 112.066 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -60.21 -36.4 90.62 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 121.06 -0.591 . . . . 10.0 112.196 179.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.676 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 25.0 ttm -74.9 -36.15 62.23 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.4 t -64.41 -41.74 93.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.152 0.501 . . . . 10.0 109.958 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 91.4 mt -73.95 -4.43 35.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.672 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -91.43 -21.36 21.0 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.242 0.544 . . . . 10.0 109.948 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.491 ' CD ' ' H2 ' ' A' ' 9' ' ' VAL . 8.1 mt-10 -105.47 -174.26 2.49 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.827 -179.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -83.56 67.59 9.46 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.135 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 74.2 m -149.2 166.86 27.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.138 0.494 . . . . 10.0 111.731 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 35.8 mm -113.26 135.5 52.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.173 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -110.3 124.8 52.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.923 0.392 . . . . 10.0 111.824 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.31 129.26 36.56 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.45 ' SD ' ' HA ' ' A' ' 108' ' ' LYS . 2.9 ttt -136.12 135.98 39.73 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.895 0.378 . . . . 10.0 111.082 -179.134 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.42 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 13.6 mmm180 -67.96 152.37 45.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.088 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.68 96.33 1.58 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.762 -0.653 . . . . 10.0 111.509 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 138.88 -15.5 3.31 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.382 -0.913 . . . . 10.0 113.537 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -84.23 27.22 0.7 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.978 0.362 . . . . 10.0 111.978 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.71 56.06 16.79 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.561 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.45 ' HA ' ' SD ' ' A' ' 102' ' ' MET . 50.6 tttm -55.38 -50.83 68.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.853 0.358 . . . . 10.0 111.745 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -24.65 63.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.947 0.403 . . . . 10.0 111.829 -179.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 21.2 tp -72.52 -31.64 65.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.867 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 19.0 m -71.41 -28.56 64.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.851 0.358 . . . . 10.0 111.7 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.81 66.13 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.771 1.026 . . . . 10.0 113.771 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 17.0 p -75.46 -22.39 57.32 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.319 0.489 . . . . 10.0 112.319 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 48.4 mt -68.26 -57.68 8.59 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 112.338 0.496 . . . . 10.0 112.338 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -64.63 -28.39 60.85 Favored 'Trans proline' 0 C--N 1.356 0.965 0 C-N-CA 122.055 1.837 . . . . 10.0 112.032 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.34 -49.26 67.54 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.458 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -62.43 -45.88 91.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.896 0.379 . . . . 10.0 110.685 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 25.8 tp -59.45 -50.27 74.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.788 -0.642 . . . . 10.0 111.842 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -75.71 -19.13 59.3 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.897 0.332 . . . . 10.0 111.897 -178.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.7 -26.73 65.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.889 0.376 . . . . 10.0 110.942 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 47.6 mt -61.2 -23.02 65.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.561 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.2 p -69.74 -24.22 63.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.869 0.366 . . . . 10.0 110.831 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.35 9.7 81.49 Favored Glycine 0 C--N 1.333 0.389 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.656 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -86.59 -11.78 50.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.702 0.287 . . . . 10.0 111.525 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.08 110.84 2.6 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.5 -0.857 . . . . 10.0 113.834 178.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 62.1 t -84.59 114.56 25.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -93.11 104.07 16.3 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.943 0.402 . . . . 10.0 111.034 -178.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 39.2 t -93.48 123.9 45.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.204 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 96.3 t -105.2 121.92 57.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.993 -179.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 2.7 p -108.83 165.36 11.62 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.459 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 15.5 m -75.9 -29.83 20.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.85 0.357 . . . . 10.0 111.529 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -145.04 168.54 20.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.405 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.08 -23.09 63.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.166 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -58.73 -52.5 65.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.569 -0.741 . . . . 10.0 110.646 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 30.5 mt -69.47 -35.68 75.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.716 0.293 . . . . 10.0 110.461 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.43 -50.89 71.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.05 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.29 -36.41 61.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.018 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.438 HH21 ' CG ' ' A' ' 139' ' ' ASP . 5.9 ttp85 -56.33 -58.88 6.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.523 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . 0.438 ' CG ' HH21 ' A' ' 138' ' ' ARG . 1.5 m-20 -69.36 -31.97 70.73 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.08 -0.509 . . . . 10.0 112.019 -178.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.488 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -60.87 -37.89 83.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.762 0.315 . . . . 10.0 111.214 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.2 mm-40 -91.59 -28.86 17.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.486 -0.325 . . . . 10.0 111.487 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -74.59 -43.86 53.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.827 0.346 . . . . 10.0 111.383 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 40.3 m-20 -88.41 -0.89 57.68 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.072 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.488 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 53.3 ttm-85 -61.69 -49.93 84.26 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.591 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' PRO . . . . . 0.464 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 17.2 Cg_exo -68.86 5.02 1.51 Allowed 'Trans proline' 0 C--N 1.361 1.218 0 C-N-CA 122.353 2.035 . . . . 10.0 112.504 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.6 tp -105.93 -52.45 2.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.726 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -73.86 -46.48 44.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.499 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.423 ' HA ' ' O ' ' A' ' 152' ' ' LEU . 82.3 mt-10 -68.91 -19.65 64.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.883 0.373 . . . . 10.0 111.047 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -73.39 -24.24 60.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.302 0.573 . . . . 10.0 109.556 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 71.4 mt -96.56 -11.18 25.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.938 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 114.99 -6.63 21.83 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.509 -0.853 . . . . 10.0 113.592 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . 0.423 ' O ' ' HA ' ' A' ' 148' ' ' GLU . 92.4 mt -80.89 144.95 31.58 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.167 0.484 . . . . 10.0 110.733 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.1 p -95.39 133.15 39.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.508 -0.315 . . . . 10.0 111.108 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 35.2 t -108.97 130.73 61.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.441 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -124.98 145.53 15.74 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 111.665 -0.574 . . . . 10.0 111.665 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 4.2 tp -119.08 129.16 75.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.962 0.41 . . . . 10.0 110.511 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -114.26 112.67 23.48 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.162 -0.472 . . . . 10.0 109.999 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 49.3 mt -109.46 148.98 39.19 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.384 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' PRO . . . . . 0.437 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 19.0 Cg_endo -58.3 121.24 9.65 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.753 2.302 . . . . 10.0 112.539 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.2 6.74 62.79 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.928 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' MET . . . . . 0.439 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 44.2 ttm -67.31 139.07 94.56 Favored Pre-proline 0 C--N 1.325 -0.473 0 C-N-CA 122.049 0.14 . . . . 10.0 110.96 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -52.69 147.32 31.65 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.885 2.39 . . . . 10.0 112.367 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . 0.436 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -54.47 -48.75 94.04 Favored Pre-proline 0 CA--C 1.54 0.563 0 N-CA-C 112.785 0.661 . . . . 10.0 112.785 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.436 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.8 Cg_exo -57.65 -42.33 61.36 Favored 'Trans proline' 0 C--N 1.358 1.062 0 C-N-CA 121.946 1.764 . . . . 10.0 112.346 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -64.96 -41.7 95.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.836 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.445 ' HZ1' ' CG ' ' A' ' 185' ' ' ASP . 60.8 mttm -58.91 -43.5 91.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.137 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -58.13 -40.61 81.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.932 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -68.48 -40.65 80.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.682 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -65.86 -43.01 89.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.351 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' TYR . . . . . 0.433 ' HD2' ' O ' ' A' ' 166' ' ' LYS . 42.1 m-85 -74.34 -22.79 59.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.998 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.19 -14.37 59.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.654 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -71.58 173.14 8.43 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.305 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -74.72 -39.43 61.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.286 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.0 mp -127.61 121.35 56.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.883 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 6.4 m -112.36 111.98 23.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.847 0.356 . . . . 10.0 111.359 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -91.34 133.34 35.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.101 -0.5 . . . . 10.0 109.692 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -167.72 179.55 41.03 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.347 -0.93 . . . . 10.0 112.838 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.09 152.16 21.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.541 0.21 . . . . 10.0 110.549 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -60.47 -41.38 94.07 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.953 0.353 . . . . 10.0 111.953 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -56.46 -50.95 70.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.709 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . 0.437 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 3.8 tp10 -70.71 -38.49 73.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.91 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -56.81 -39.44 74.17 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.861 0.363 . . . . 10.0 111.152 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -70.72 -44.33 57.18 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.821 -0.704 . . . . 10.0 112.242 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -67.17 -35.28 79.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.915 0.388 . . . . 10.0 110.738 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . 0.445 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 6.8 m-20 -59.16 -44.62 92.14 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.689 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -62.85 -38.22 89.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.466 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 54.2 mt -62.65 -47.19 84.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.514 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 188' ' ' ARG . 42.4 mtm-85 -67.27 -40.7 86.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 10.0 110.491 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.11 -49.12 78.88 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.395 -0.821 . . . . 10.0 111.608 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.66 -3.6 47.98 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.784 -0.644 . . . . 10.0 112.656 -178.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 23.0 ttp -104.21 4.0 33.44 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.879 0.371 . . . . 10.0 110.966 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -69.72 174.01 5.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.82 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -109.34 -21.59 12.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.053 0.454 . . . . 10.0 110.601 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.05 142.33 45.2 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.871 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' PRO . . . . . 0.407 ' HD3' ' O ' ' A' ' 667' ' ' LEU . 13.2 Cg_endo -57.72 -30.18 88.19 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.811 2.341 . . . . 10.0 112.721 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -69.91 -17.5 63.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.963 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -83.14 -13.03 56.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.302 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -56.09 157.74 4.43 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.382 0.426 . . . . 10.0 111.426 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 8.2 m -128.57 -25.26 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.228 -0.442 . . . . 10.0 112.007 -179.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -92.77 -178.2 4.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.065 0.459 . . . . 10.0 111.361 -179.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -134.03 -178.2 4.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.765 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 17.4 ttmm -57.32 131.8 51.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.274 0.559 . . . . 10.0 111.593 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 12.5 mt -82.65 74.57 9.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.158 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -84.33 -63.45 1.34 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.94 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -128.3 137.28 51.88 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.065 0.459 . . . . 10.0 111.731 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.45 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . . . -129.71 127.59 40.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.364 -0.835 . . . . 10.0 109.984 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 61.8 tp -119.79 108.9 14.96 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.08 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.3 p -98.75 131.26 46.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 CA-C-O 121.048 0.452 . . . . 10.0 110.776 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -59.05 -66.21 0.54 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.614 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' GLU . . . . . 0.506 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 34.3 tt0 -112.3 111.05 21.64 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.833 0.349 . . . . 10.0 110.577 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . 0.421 ' O ' ' HB2' ' A' ' 215' ' ' LEU . 34.3 m -82.34 -18.59 10.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.844 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . 0.408 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.0 OUTLIER -51.82 -57.49 9.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.173 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 4.9 p -88.61 -59.17 2.3 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.965 -0.561 . . . . 10.0 112.051 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 69.2 mt -52.73 -38.31 27.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 113.913 1.079 . . . . 10.0 113.913 -177.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 215' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 211' ' ' VAL . 8.0 mt -96.47 -53.79 3.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.933 0.716 . . . . 10.0 112.933 -178.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 216' ' ' ILE . . . . . 0.408 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 46.7 mm -75.91 -57.15 6.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 113.064 0.764 . . . . 10.0 113.064 -177.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -64.22 -42.7 96.48 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.035 0.383 . . . . 10.0 112.035 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -90.09 16.65 8.04 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 -178.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.88 -38.69 91.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.883 0.373 . . . . 10.0 111.071 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -106.13 31.68 4.95 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.308 -0.406 . . . . 10.0 111.488 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 33.9 m -105.12 102.99 39.56 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 222' ' ' PRO . . . . . 0.405 ' HA ' ' HA ' ' A' ' 376' ' ' THR . 72.5 Cg_endo -94.95 129.38 0.48 Allowed 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.095 2.53 . . . . 10.0 113.473 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 223' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' A' ' 374' ' ' SER . 86.9 mt -82.91 110.87 18.27 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 77.0 mt -108.33 125.95 65.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 65.8 mt -96.28 111.92 27.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 108.578 -0.897 . . . . 10.0 108.578 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 20.1 m -86.47 148.56 25.49 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.784 0.326 . . . . 10.0 111.144 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -167.46 92.22 0.1 Allowed Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.828 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 228' ' ' PRO . . . . . 0.436 ' HA ' ' OE1' ' A' ' 370' ' ' GLN . 9.5 Cg_exo -71.7 119.57 6.31 Favored 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 122.862 2.375 . . . . 10.0 112.781 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 229' ' ' ALA . . . . . 0.485 ' O ' ' HA ' ' B' ' 21' ' ' VAL . . . -154.94 80.89 1.08 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.964 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 68.11 176.93 0.26 Allowed 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.738 0.648 . . . . 10.0 110.359 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -168.85 -82.57 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.004 0.431 . . . . 10.0 110.361 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 232' ' ' SER . . . . . 0.402 ' O ' ' HB2' ' A' ' 236' ' ' TYR . 15.1 m -140.63 38.42 1.84 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.462 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 1.4 p -56.12 -75.07 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.899 -179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -69.11 -23.08 63.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.281 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 22.0 ttm -66.23 -55.04 18.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.588 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 232' ' ' SER . 0.5 OUTLIER -61.25 -36.93 81.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.598 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 237' ' ' LYS . . . . . 0.454 ' O ' ' HD3' ' A' ' 241' ' ' LYS . 64.8 mmtt -65.49 -15.35 62.57 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.021 -0.536 . . . . 10.0 112.326 -179.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 34.2 tpt85 -108.7 -33.32 7.03 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.836 -0.346 . . . . 10.0 110.875 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 89.7 t -75.96 -40.19 37.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.949 0.404 . . . . 10.0 111.083 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.58 22.41 0.35 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.591 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 241' ' ' LYS . . . . . 0.454 ' HD3' ' O ' ' A' ' 237' ' ' LYS . 1.8 mptm? -112.82 15.97 19.66 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.616 0.228 . . . . 10.0 111.616 -179.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -90.3 -11.35 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-O 120.955 0.407 . . . . 10.0 111.005 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 243' ' ' ILE . . . . . 0.422 ' HB ' ' HD3' ' A' ' 244' ' ' PRO . 44.8 mt -58.38 -47.06 99.48 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.952 0.723 . . . . 10.0 112.952 -179.283 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 244' ' ' PRO . . . . . 0.422 ' HD3' ' HB ' ' A' ' 243' ' ' ILE . 23.9 Cg_exo -66.14 -0.34 4.03 Favored 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 122.165 1.91 . . . . 10.0 113.78 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -105.07 6.47 33.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.038 0.447 . . . . 10.0 110.271 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 18.9 mt -98.53 167.87 10.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.221 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 247' ' ' ILE . . . . . 0.408 ' O ' ' HG3' ' A' ' 248' ' ' ARG . 2.4 mt -121.35 14.5 6.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.652 0.263 . . . . 10.0 111.209 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 248' ' ' ARG . . . . . 0.491 ' HA ' ' CG ' ' A' ' 253' ' ' ASP . 3.4 ptm180 40.67 77.51 0.05 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.951 0.9 . . . . 10.0 112.397 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -171.12 -44.97 0.02 OUTLIER 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.985 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 250' ' ' GLU . . . . . 0.452 ' O ' ' HE2' ' A' ' 251' ' ' LYS . 1.6 tt0 -153.25 128.8 10.0 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.823 0.305 . . . . 10.0 111.823 -179.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . 0.452 ' HE2' ' O ' ' A' ' 250' ' ' GLU . 0.1 OUTLIER 72.73 130.11 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.112 0.883 . . . . 10.0 112.953 177.412 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 252' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 68.18 -58.39 0.46 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.661 -1.154 . . . . 10.0 113.34 178.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 253' ' ' ASP . . . . . 0.491 ' CG ' ' HA ' ' A' ' 248' ' ' ARG . 1.3 p30 -70.65 -34.39 72.0 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.663 0.246 . . . . 10.0 111.663 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.91 130.24 35.11 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.148 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . 0.425 ' HG2' HG22 ' A' ' 256' ' ' THR . 0.6 OUTLIER -85.06 -32.51 22.82 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.839 0.352 . . . . 10.0 110.37 -179.565 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 256' ' ' THR . . . . . 0.425 HG22 ' HG2' ' A' ' 255' ' ' GLU . 6.2 p -124.8 -90.95 0.55 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.688 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 18.7 t80 58.32 -91.35 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.309 -0.86 . . . . 10.0 111.072 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 53.69 29.38 9.34 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.134 0.492 . . . . 10.0 111.429 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 112.72 -47.8 1.0 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.807 -0.711 . . . . 10.0 112.73 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -118.28 -72.46 0.69 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.958 0.408 . . . . 10.0 110.276 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 83.87 -91.56 1.64 Allowed Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.777 -0.725 . . . . 10.0 113.435 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -145.32 172.77 12.68 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.464 0.173 . . . . 10.0 110.559 -178.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -88.8 -175.43 4.88 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.363 -0.381 . . . . 10.0 110.518 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 9.9 m -73.59 97.03 2.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.159 0.504 . . . . 10.0 112.117 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -150.41 -70.1 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.504 178.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -169.88 129.81 0.98 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.678 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -76.62 85.15 3.28 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 268' ' ' LYS . . . . . 0.536 ' NZ ' ' HB2' ' A' ' 268' ' ' LYS . 2.4 ttmp? -157.71 83.26 0.89 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.781 -179.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 10.6 m -76.64 85.0 3.3 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.258 0.552 . . . . 10.0 109.933 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -60.72 -20.34 60.95 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.41 -0.814 . . . . 10.0 111.306 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -74.95 -9.77 58.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.017 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 21.8 t 67.72 -81.7 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 C-N-CA 123.122 0.569 . . . . 10.0 110.776 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 1.2 t30 59.66 29.99 19.58 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 122.73 0.412 . . . . 10.0 111.467 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 9.3 tp 58.58 -142.76 0.65 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.243 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 7.7 t -167.93 166.49 13.32 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 121.324 -0.15 . . . . 10.0 110.793 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 55.46 104.09 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.329 0 O-C-N 124.315 1.009 . . . . 10.0 112.743 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.23 16.06 11.46 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.32 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . -123.57 -24.52 1.92 Allowed Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.446 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 90.4 mt 62.04 57.09 2.15 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.198 0.523 . . . . 10.0 110.826 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 9.6 p -159.1 -13.3 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.849 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 7.7 mp -79.64 -47.44 15.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.93 0.395 . . . . 10.0 109.995 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 30.5 pt -72.39 1.48 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.589 -0.732 . . . . 10.0 112.159 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.72 -33.79 72.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.891 0.377 . . . . 10.0 110.401 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -77.22 -15.54 59.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.251 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.09 -31.32 62.77 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 178.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 77.2 mt -65.84 161.28 21.37 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.67 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 287' ' ' VAL . . . . . 0.426 ' O ' ' HG2' ' A' ' 288' ' ' LYS . 41.0 t 70.02 154.31 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 115.639 -0.709 . . . . 10.0 110.668 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 288' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 287' ' ' VAL . 0.0 OUTLIER 72.04 176.11 0.28 Allowed 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.845 0.858 . . . . 10.0 111.527 179.368 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 289' ' ' GLU . . . . . 0.436 ' HA ' ' OE1' ' A' ' 289' ' ' GLU . 4.8 mm-40 72.11 -78.44 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.357 0.663 . . . . 10.0 111.728 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 290' ' ' GLY . . . . . 0.457 ' O ' ' HB ' ' A' ' 291' ' ' ILE . . . 153.44 155.1 7.02 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.571 -0.823 . . . . 10.0 112.04 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 291' ' ' ILE . . . . . 0.457 ' HB ' ' O ' ' A' ' 290' ' ' GLY . 26.3 mm 75.53 127.56 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 C-N-CA 123.001 0.52 . . . . 10.0 109.869 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER 67.77 26.82 7.65 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -77.43 58.09 1.64 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.789 -1.096 . . . . 10.0 111.162 -179.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -152.06 -163.9 1.84 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.47 -0.786 . . . . 10.0 109.615 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -81.61 79.54 1.83 Allowed Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.545 -0.836 . . . . 10.0 111.777 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -142.41 -179.43 6.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.596 0.236 . . . . 10.0 110.568 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 8.6 t -117.6 -171.19 2.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.851 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . 0.431 ' O ' ' HG3' ' A' ' 307' ' ' MET . 26.6 tp -104.33 -14.95 15.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.213 -0.448 . . . . 10.0 111.442 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 50.2 p90 -110.37 16.65 21.5 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.765 -0.374 . . . . 10.0 111.356 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 1.4 m -59.63 131.36 88.44 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.334 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.75 -11.9 33.79 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.843 2.362 . . . . 10.0 112.32 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -77.02 -13.04 60.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.287 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 303' ' ' ASN . . . . . 0.482 HD22 ' HB2' ' A' ' 306' ' ' LEU . 18.1 t30 -143.16 92.47 2.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.071 0.462 . . . . 10.0 110.597 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 1.8 tp -98.8 -21.87 5.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.332 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 2.0 tpt -60.43 -53.06 62.12 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.273 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 306' ' ' LEU . . . . . 0.482 ' HB2' HD22 ' A' ' 303' ' ' ASN . 3.0 mm? -76.04 -32.74 59.49 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.929 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 307' ' ' MET . . . . . 0.431 ' HG3' ' O ' ' A' ' 298' ' ' LEU . 0.1 OUTLIER -62.27 -38.06 87.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.922 0.391 . . . . 10.0 111.155 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 308' ' ' HIS . . . . . 0.422 ' HE2' ' CG ' ' A' ' 351' ' ' ASP . 2.5 t60 -80.42 -6.65 58.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.546 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 64.8 m170 -95.97 -36.3 11.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.627 -0.26 . . . . 10.0 110.545 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 26.9 m -69.47 -32.31 52.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.821 0.343 . . . . 10.0 110.473 179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.14 -23.8 57.88 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.397 0.618 . . . . 10.0 110.248 179.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 312' ' ' ALA . . . . . 0.459 ' O ' ' HG2' ' A' ' 315' ' ' ARG . . . -68.15 -33.79 75.14 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.311 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -65.78 -29.77 70.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.338 0.59 . . . . 10.0 110.201 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 9.2 mp -74.08 -43.19 58.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.573 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 315' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 312' ' ' ALA . 36.0 ptt180 -71.09 -23.03 62.03 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.922 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -89.41 13.9 12.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.375 0.607 . . . . 10.0 110.1 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -129.67 -39.67 1.43 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.94 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . 0.534 ' O ' ' HG3' ' A' ' 268' ' ' LYS . . . -105.25 -35.97 7.38 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.351 0.5 . . . . 10.0 112.351 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -84.37 -65.81 0.97 Allowed 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 121.041 -0.264 . . . . 10.0 111.282 -179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -83.44 115.93 22.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.007 0.432 . . . . 10.0 110.275 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 321' ' ' THR . . . . . 0.605 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 0.3 OUTLIER -101.69 130.37 48.05 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.42 -179.3 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 322' ' ' ARG . . . . . 0.577 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 2.2 tpt180 -65.59 139.7 58.46 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.471 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 323' ' ' ASP . . . . . 0.577 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 25.5 m-20 85.48 -14.59 0.56 Allowed 'General case' 0 N--CA 1.477 0.892 0 O-C-N 124.442 1.089 . . . . 10.0 113.443 178.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 324' ' ' VAL . . . . . 0.605 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 2.2 p -121.45 -47.07 2.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 C-N-CA 120.579 -0.449 . . . . 10.0 111.088 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -88.95 -34.7 16.8 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.407 0.622 . . . . 10.0 110.164 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -148.16 145.6 28.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.753 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 14.4 tt -133.24 110.11 14.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 121.545 0.688 . . . . 10.0 110.036 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 41.4 t -95.63 114.13 31.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.857 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -138.07 134.24 34.48 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.804 -0.634 . . . . 10.0 110.323 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 62.53 20.95 12.32 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.372 0.42 . . . . 10.0 111.303 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 87.71 2.74 81.43 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.535 -0.84 . . . . 10.0 112.224 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -99.54 123.91 44.24 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 110.315 -0.254 . . . . 10.0 110.315 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 25.9 t -91.19 97.79 7.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 26.6 mt -99.56 128.43 51.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.684 -179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 52.9 mt -91.49 133.2 33.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.664 -0.495 . . . . 10.0 109.664 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 336' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' A' ' 324' ' ' VAL . 2.9 t -112.39 112.13 39.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.964 0.411 . . . . 10.0 111.186 -178.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -71.2 123.68 22.76 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.5 -5.51 59.18 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.033 0.383 . . . . 10.0 112.033 -178.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 31.5 m80 -80.2 -50.54 10.12 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.97 -0.292 . . . . 10.0 111.539 -179.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 38.7 p -116.46 -2.82 11.95 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 69.55 55.9 9.28 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.667 -0.777 . . . . 10.0 111.618 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -115.94 123.4 47.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.823 0.344 . . . . 10.0 111.38 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.84 103.64 15.44 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.198 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 59.5 mtt -102.31 110.13 22.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.585 -179.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -88.98 -25.76 21.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.944 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -106.52 65.1 0.27 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.645 -0.788 . . . . 10.0 112.164 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -140.57 125.16 17.93 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.673 -0.491 . . . . 10.0 109.673 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -101.35 163.39 12.3 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.851 -0.425 . . . . 10.0 109.851 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 349' ' ' TRP . . . . . 0.4 ' HB3' ' HB2' ' A' ' 353' ' ' LEU . 12.4 m95 -145.78 120.69 9.98 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.217 -0.29 . . . . 10.0 110.217 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.24 178.88 1.35 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.82 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 351' ' ' ASP . . . . . 0.422 ' CG ' ' HE2' ' A' ' 308' ' ' HIS . 9.1 t70 68.66 2.32 3.39 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.255 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 74.2 33.55 56.63 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.836 -0.697 . . . . 10.0 112.265 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . 0.4 ' HB2' ' HB3' ' A' ' 349' ' ' TRP . 82.6 mt -59.16 -47.83 83.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.848 0.356 . . . . 10.0 110.847 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 354' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -84.7 -10.69 57.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.344 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 355' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -64.32 -41.22 96.92 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.967 0.413 . . . . 10.0 110.273 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -69.28 -28.88 66.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.591 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 48.7 t -67.38 -52.27 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.597 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -61.67 -25.57 67.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.735 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -75.76 -44.95 39.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.419 178.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -68.68 -41.9 78.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.793 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -81.5 160.63 23.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.084 -0.507 . . . . 10.0 109.777 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -86.12 59.54 4.68 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.631 -0.795 . . . . 10.0 112.743 -179.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 8.0 m -135.19 177.47 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.587 0.232 . . . . 10.0 111.034 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -83.5 139.06 33.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.485 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 365' ' ' ILE . . . . . . . . . . . . . 47.6 mt -84.18 140.46 16.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.287 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -73.85 153.41 39.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.898 0.38 . . . . 10.0 110.629 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -86.9 -27.27 23.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.792 -179.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 368' ' ' GLU . . . . . 0.457 ' HA ' ' OE1' ' A' ' 368' ' ' GLU . 6.0 mm-40 62.86 -121.26 0.61 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.966 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -149.53 134.2 17.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.541 0.21 . . . . 10.0 110.795 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 370' ' ' GLN . . . . . 0.436 ' OE1' ' HA ' ' A' ' 228' ' ' PRO . 22.2 mp0 -114.01 165.93 12.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.885 0.374 . . . . 10.0 110.744 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 22.7 m -112.14 133.32 54.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.373 -179.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 62.5 mt -99.33 -37.58 9.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.164 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -162.62 155.41 19.47 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.638 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 374' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 41.6 m -155.13 135.59 13.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.495 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 18.9 tt -149.73 136.8 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.165 0.507 . . . . 10.0 110.62 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 376' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 222' ' ' PRO . 0.2 OUTLIER -90.64 143.73 26.45 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.855 -0.612 . . . . 10.0 109.715 179.204 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -55.5 -48.42 74.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.835 0.35 . . . . 10.0 110.522 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -57.59 -40.24 78.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.643 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 62.7 m-20 -73.99 -14.94 61.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.981 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -88.63 -42.53 11.96 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.319 -0.622 . . . . 10.0 109.319 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -70.05 -18.41 63.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.769 -0.651 . . . . 10.0 110.7 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -74.3 -11.39 60.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.407 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 43.1 mt -93.49 0.44 56.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.564 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.45 ' CD2' ' HB3' ' A' ' 206' ' ' ALA . 26.1 m-85 -94.52 142.33 27.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.591 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -75.1 -61.51 1.87 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.196 0.522 . . . . 10.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -102.34 107.68 18.78 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 44.8 tp -120.72 120.02 34.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.971 -0.558 . . . . 10.0 109.911 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -143.04 166.49 24.49 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.524 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.89 173.92 46.06 Favored Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.083 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 13.6 mtm -110.93 146.88 35.8 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.707 0.289 . . . . 10.0 110.232 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 6.7 t -126.63 160.13 31.59 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -84.7 163.11 38.25 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.489 -0.863 . . . . 10.0 111.985 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 393' ' ' THR . . . . . 0.42 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 3.2 m -71.08 73.1 0.62 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.196 0.522 . . . . 10.0 110.482 179.214 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -135.44 -30.54 1.01 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.778 -0.646 . . . . 10.0 111.8 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 19.9 t70 61.51 -114.55 0.56 Allowed 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 14.0 m 65.52 -86.39 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.898 0.703 . . . . 10.0 112.898 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -84.03 30.51 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 10.0 111.456 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -58.13 -45.6 87.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.456 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -65.61 -23.15 66.76 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.628 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -75.86 -29.3 58.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.633 0.254 . . . . 10.0 110.443 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -60.02 -42.52 94.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.994 0.426 . . . . 10.0 110.524 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.4 m -81.84 -5.76 58.49 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.963 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 17.8 m -106.14 -40.85 5.52 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.855 -0.338 . . . . 10.0 111.795 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 53.9 mt -85.99 -46.31 16.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.554 -0.293 . . . . 10.0 111.593 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -108.51 -6.11 16.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.625 0.25 . . . . 10.0 111.316 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 58.96 44.76 15.98 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.017 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 36.1 mt -112.02 138.13 49.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.776 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . 0.558 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 28.7 t0 -82.47 142.62 31.75 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.729 -0.471 . . . . 10.0 109.729 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 1.8 m -100.79 106.31 17.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.931 0.396 . . . . 10.0 111.487 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 83.9 t -107.05 132.81 53.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.205 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 60.2 t -96.76 126.55 49.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.52 -0.309 . . . . 10.0 110.398 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 44.8 t -95.73 131.56 29.06 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.548 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -65.17 154.42 73.56 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.645 2.23 . . . . 10.0 112.757 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.5 p -79.91 168.68 18.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.034 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -78.9 -33.41 45.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.436 0.636 . . . . 10.0 109.407 179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -124.22 151.07 65.39 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.401 -0.818 . . . . 10.0 109.557 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.68 110.4 1.44 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.502 2.135 . . . . 10.0 111.999 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 58.8 ttp -72.92 102.52 3.47 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.112 0.482 . . . . 10.0 110.545 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.8 pt -96.14 60.72 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.238 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 -86.25 128.53 34.92 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -93.81 97.97 10.77 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.832 0.348 . . . . 10.0 111.136 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -90.14 122.19 32.88 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.068 -0.715 . . . . 10.0 109.068 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 22.4 mt -104.65 150.78 38.95 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.734 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.98 141.77 98.65 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.945 2.43 . . . . 10.0 112.56 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -60.26 131.91 52.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.976 -0.557 . . . . 10.0 110.907 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.27 106.4 17.59 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.951 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 72.8 t -103.93 123.19 57.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.834 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 428' ' ' TYR . . . . . 0.406 ' HB3' ' HB2' ' A' ' 433' ' ' GLU . 2.5 m-85 -105.91 -175.18 2.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.625 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.54 -77.42 0.25 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.438 -0.505 . . . . 10.0 110.27 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 76.0 p -83.77 156.39 22.56 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.2 -0.296 . . . . 10.0 110.2 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -62.93 -27.07 69.13 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.024 -0.361 . . . . 10.0 110.024 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.12 -45.15 87.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.796 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 433' ' ' GLU . . . . . 0.406 ' HB2' ' HB3' ' A' ' 428' ' ' TYR . 18.8 mt-10 -65.73 -42.22 91.31 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.492 178.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -57.82 -51.59 68.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.803 -1.09 . . . . 10.0 111.344 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 45.7 mm -67.87 -38.46 80.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.682 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.82 -39.59 92.31 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.813 0.34 . . . . 10.0 110.459 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -61.57 -38.11 86.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.24 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 84.4 mt -63.37 -44.46 99.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.648 178.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.99 -43.77 96.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.262 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -60.48 -43.04 97.37 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.44 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . 0.614 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 30.2 t70 -66.47 -42.93 86.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.108 179.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 75.3 mt -61.14 -39.36 82.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.451 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -59.07 -39.98 83.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.999 0.428 . . . . 10.0 110.44 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.25 -39.69 82.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.221 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.614 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 10.7 mmt180 -66.91 -46.73 73.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.246 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -36.41 82.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.883 0.373 . . . . 10.0 110.597 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.39 -32.9 74.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.33 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -89.89 -5.51 56.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.179 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 77.98 29.17 54.99 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.821 -0.704 . . . . 10.0 111.719 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' GLN . . . . . 0.528 ' OE1' ' HD2' ' A' ' 445' ' ' ARG . 62.4 tt0 -99.38 126.96 35.84 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-O 120.401 0.143 . . . . 10.0 111.015 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.15 142.62 56.42 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 122.592 2.195 . . . . 10.0 111.307 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 52.3 t -119.86 131.45 72.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.569 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 43.3 tp -120.18 104.25 9.93 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.396 -0.594 . . . . 10.0 109.396 178.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 32.2 t -90.23 124.07 42.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.789 -0.642 . . . . 10.0 110.256 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -104.37 81.58 0.34 Allowed Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.799 -0.715 . . . . 10.0 111.977 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.13 104.82 13.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.886 0.374 . . . . 10.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 33.9 pt -72.41 -21.52 20.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.194 0.521 . . . . 10.0 110.166 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' SER . . . . . 0.452 ' HB2' ' HB2' ' A' ' 461' ' ' LYS . 1.1 m -99.27 118.98 37.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.483 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 57.2 mt -59.09 -41.35 83.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.945 0.402 . . . . 10.0 111.865 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 27.6 mp0 -63.93 -24.63 67.8 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.186 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . 0.452 ' HB2' ' HB2' ' A' ' 458' ' ' SER . 0.1 OUTLIER -77.69 -31.42 52.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.426 -0.352 . . . . 10.0 110.607 -179.488 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 49.1 m -60.49 -38.91 85.82 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.126 0.488 . . . . 10.0 109.939 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.46 -42.98 82.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.342 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 55.1 tp -64.13 -52.1 60.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.663 -0.698 . . . . 10.0 111.498 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.0 -30.34 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 120.672 0.272 . . . . 10.0 111.013 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 9.1 t -66.75 -40.97 88.48 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.36 -47.02 83.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.121 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -60.97 -40.49 93.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.141 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 17.0 mt -65.92 -35.81 81.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.951 0.405 . . . . 10.0 110.586 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.0 m -75.04 -33.83 61.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.091 0.472 . . . . 10.0 109.803 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -64.4 -41.17 96.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.111 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -75.86 -31.51 59.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.306 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 94.82 41.38 4.12 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.014 -0.613 . . . . 10.0 112.497 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 35.1 mt -110.53 137.81 41.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 CA-C-O 120.664 0.269 . . . . 10.0 110.999 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -61.57 134.98 57.46 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.477 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -163.68 156.47 18.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.78 0.324 . . . . 10.0 111.177 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -140.33 133.36 29.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.1 t -105.0 133.69 48.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.857 0.36 . . . . 10.0 111.426 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . 0.421 ' HB3' ' OE2' ' A' ' 487' ' ' GLU . 80.0 mt -84.93 138.83 32.26 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -144.34 135.94 25.79 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.293 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -59.2 -24.32 63.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 10.0 112.018 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -78.7 -9.27 59.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.605 0.24 . . . . 10.0 110.963 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' PHE . . . . . 0.48 ' O ' ' HG3' ' A' ' 487' ' ' GLU . 59.2 m-85 -131.79 49.95 2.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.992 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' HIS . . . . . 0.438 ' HA ' ' OE1' ' A' ' 487' ' ' GLU . 3.3 m80 -57.46 -33.64 68.16 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.912 0.387 . . . . 10.0 111.26 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.92 -33.57 76.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.103 0.478 . . . . 10.0 110.468 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -77.83 -36.68 49.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.647 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 483' ' ' PHE . 49.4 mt-10 -59.29 -39.01 81.64 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.661 -0.7 . . . . 10.0 110.523 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -59.61 -27.13 66.05 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.297 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -88.51 -38.24 15.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.861 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.87 -48.09 72.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.393 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 81.3 t -60.63 -30.95 47.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.828 0.347 . . . . 10.0 111.062 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -61.83 -28.37 69.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.312 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -120.36 21.58 11.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.824 0.345 . . . . 10.0 110.846 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -67.71 -20.03 65.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.996 0.427 . . . . 10.0 110.911 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -98.01 11.97 64.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.876 -0.678 . . . . 10.0 112.068 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -73.39 140.13 79.03 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 110.088 -0.338 . . . . 10.0 110.088 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -52.3 123.16 12.04 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.701 2.267 . . . . 10.0 113.047 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 73.68 15.99 3.94 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 123.948 0.78 . . . . 10.0 112.921 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -91.56 119.88 31.88 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.567 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 40.2 t -100.15 107.99 22.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.067 0.461 . . . . 10.0 110.374 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 8.0 m -107.39 129.84 54.87 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.528 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 61.1 mt -109.54 114.18 46.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.219 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -97.37 114.93 26.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.817 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 16.0 m -86.48 112.45 21.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.203 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 65.8 t30 58.75 77.18 0.31 Allowed 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.667 0.604 . . . . 10.0 111.204 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.35 141.11 55.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.942 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -91.66 -171.09 2.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.404 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -75.73 153.8 44.5 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.695 -0.764 . . . . 10.0 112.475 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.506 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 59.2 mtt180 66.6 -80.83 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.293 0.637 . . . . 10.0 112.104 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.57 144.76 13.65 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.114 -0.565 . . . . 10.0 111.928 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.03 154.13 41.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.63 0.252 . . . . 10.0 111.206 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -75.71 120.58 21.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.883 0.373 . . . . 10.0 110.961 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 93.4 mt -99.58 108.76 23.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.788 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 6.8 t -78.79 131.07 35.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.92 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 48.9 mt -65.85 127.38 31.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.321 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 95.97 -9.44 68.05 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.084 -0.579 . . . . 10.0 111.672 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 113.72 -176.67 17.39 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.864 -0.894 . . . . 10.0 110.864 -179.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 5.3 p -121.75 93.37 3.98 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.147 0.498 . . . . 10.0 110.642 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 17.9 p-90 -60.35 -27.04 67.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.443 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -62.5 -36.37 82.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.226 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.36 -35.15 35.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.061 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' GLU . . . . . 0.407 ' O ' ' HG ' ' A' ' 526' ' ' LEU . 47.8 mt-10 -62.62 -44.96 94.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.822 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 28.1 m -71.65 -25.95 25.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-O 120.994 0.426 . . . . 10.0 110.809 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -73.7 -25.51 60.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.151 0.5 . . . . 10.0 110.171 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -87.18 -0.83 57.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.491 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 522' ' ' GLU . 88.4 mt -84.24 148.57 26.64 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.886 0.374 . . . . 10.0 111.21 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -69.3 -39.92 77.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.9 -0.591 . . . . 10.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -152.85 88.66 3.85 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.21 104.11 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.057 2.504 . . . . 10.0 112.359 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.17 148.71 29.43 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.722 -0.672 . . . . 10.0 109.875 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -52.41 -50.85 61.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.951 0.405 . . . . 10.0 111.669 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 51.0 mp0 -64.69 -31.87 73.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.629 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -68.99 -44.09 73.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.029 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 79.1 mt -61.59 -42.72 95.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.183 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -61.21 -42.06 97.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.378 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -63.57 -47.33 81.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.552 . . . . 10.0 110.167 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 61.2 mt -63.95 -37.51 79.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.254 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -61.78 -43.29 99.15 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -68.63 -43.43 76.37 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.449 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.67 -47.18 86.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.582 -0.736 . . . . 10.0 109.868 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 61.3 t90 -63.83 -39.5 94.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.335 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -54.04 -48.46 70.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.579 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 39.0 t -61.85 -43.88 98.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.607 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -65.72 -44.11 87.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.95 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -58.94 -50.86 72.47 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.373 -0.83 . . . . 10.0 111.167 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.49 -24.02 63.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.347 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -67.48 -36.82 81.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.273 0.559 . . . . 10.0 109.716 178.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.16 -32.06 55.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.549 -0.75 . . . . 10.0 110.008 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 84.3 mt -64.33 -39.95 94.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.188 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -69.97 -36.26 75.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.918 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -64.94 -49.16 71.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.465 -0.789 . . . . 10.0 110.793 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 141.42 23.43 0.24 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.399 -0.905 . . . . 10.0 113.609 179.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 74.47 -166.78 54.81 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.502 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 30.5 tp -75.44 125.84 29.81 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.17 -0.307 . . . . 10.0 110.17 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -98.53 110.61 23.18 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.391 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 27.4 mm -90.24 133.89 30.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.818 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 14.0 mt -124.82 121.34 60.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.264 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -107.42 134.29 12.12 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.834 -0.698 . . . . 10.0 111.496 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 17.3 p -92.57 -57.32 2.71 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.112 0.482 . . . . 10.0 111.362 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -114.31 133.05 55.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.438 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -77.36 134.62 38.42 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -78.26 139.4 38.89 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.201 -0.296 . . . . 10.0 110.201 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -57.14 -48.09 79.52 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 564' ' ' SER . . . . . 0.441 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.3 OUTLIER -77.53 114.94 16.88 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.186 178.121 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -65.8 -24.08 66.84 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.535 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -61.42 -48.86 79.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.961 0.41 . . . . 10.0 110.463 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 69.0 mt -75.83 -34.83 28.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.118 0.485 . . . . 10.0 110.205 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -63.31 -41.1 98.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.35 -0.841 . . . . 10.0 110.621 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -75.59 -35.27 60.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.831 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -62.68 -27.42 69.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.909 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 20.4 tp -71.35 -28.59 64.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.1 0.476 . . . . 10.0 110.218 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -81.25 -30.43 34.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.248 0.547 . . . . 10.0 109.905 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.34 7.41 17.88 Favored Glycine 0 CA--C 1.52 0.382 0 CA-C-N 115.627 -0.715 . . . . 10.0 113.446 -179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -74.16 -30.59 62.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.988 0.394 . . . . 10.0 109.989 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 2.4 t -93.65 162.96 13.73 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.191 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 66.46 51.98 38.64 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.869 -0.681 . . . . 10.0 112.161 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -88.71 146.24 25.17 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.266 -0.272 . . . . 10.0 110.266 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 60.61 20.51 10.4 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 123.544 0.528 . . . . 10.0 110.438 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 75.5 40.4 32.79 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.995 -0.548 . . . . 10.0 112.641 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.33 -163.72 1.01 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.73 0.265 . . . . 10.0 110.963 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -92.33 177.32 6.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.266 0.555 . . . . 10.0 111.981 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 153.42 173.51 22.71 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.583 -0.735 . . . . 10.0 111.664 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 2.6 p -146.96 148.45 31.76 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.005 -0.369 . . . . 10.0 110.005 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.6 137.42 31.89 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.621 0.248 . . . . 10.0 111.137 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -158.91 147.88 18.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.735 178.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -115.19 147.62 40.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.266 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -130.02 111.62 12.68 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 4.9 mp -122.18 179.39 4.56 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.115 0.483 . . . . 10.0 111.594 -178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 51.9 p -132.3 179.91 5.83 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.059 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 71.4 mmm -83.46 -8.32 59.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.857 0.361 . . . . 10.0 111.151 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.12 9.74 40.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.196 0.522 . . . . 10.0 110.062 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.67 149.2 38.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.659 -0.7 . . . . 10.0 110.533 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -59.94 -28.17 67.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.164 -0.471 . . . . 10.0 111.603 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 7.2 tp -63.8 -26.41 68.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.415 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 22.4 mmt -77.44 -2.74 36.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.875 0.369 . . . . 10.0 111.286 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -101.92 -1.51 31.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.231 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 16.6 pt -94.36 4.6 8.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.965 0.412 . . . . 10.0 110.807 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -86.17 19.76 2.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.953 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.44 -59.29 0.55 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.733 0.813 . . . . 10.0 111.997 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 1.7 m -122.1 139.28 53.91 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.304 -0.258 . . . . 10.0 110.304 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -64.93 -26.16 68.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.09 0.471 . . . . 10.0 110.336 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.2 -32.56 70.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.461 179.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.8 t -67.35 -45.56 85.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.67 -0.492 . . . . 10.0 109.67 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.01 -22.97 63.06 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.404 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -59.92 -25.95 62.42 Favored Glycine 0 C--N 1.332 0.331 0 CA-C-N 115.912 -0.585 . . . . 10.0 112.715 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -65.41 -18.55 65.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.666 0.269 . . . . 10.0 111.047 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -94.99 -14.57 24.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.907 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -69.01 -30.42 68.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.893 0.378 . . . . 10.0 110.747 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm -98.28 30.2 3.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.912 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 38.8 tp -84.99 -8.47 58.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.618 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 91.42 -57.01 3.13 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.711 -0.756 . . . . 10.0 111.808 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 69.88 -69.26 0.17 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.352 0.661 . . . . 10.0 111.795 179.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp 66.57 93.58 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.277 0 O-C-N 123.563 0.539 . . . . 10.0 110.858 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 614' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.29 101.94 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.96 2.44 . . . . 10.0 112.472 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 123.18 -18.81 7.81 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.036 -0.602 . . . . 10.0 111.86 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -98.55 136.96 37.9 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.123 -0.325 . . . . 10.0 110.123 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -80.45 104.9 11.3 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.331 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -61.8 -35.9 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.046 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 40.22 65.91 0.68 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.72 0.808 . . . . 10.0 112.942 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -117.77 108.97 42.02 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.44 -23.2 44.22 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 123.062 2.508 . . . . 10.0 114.447 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 65.6 p-90 -68.13 -18.93 64.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.749 -0.38 . . . . 10.0 111.433 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 87.5 t -64.5 -49.29 81.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.05 -33.68 75.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.616 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -69.14 -44.72 71.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.51 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -63.17 -43.57 97.87 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.591 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 89.8 mt -63.51 -44.78 98.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.559 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -61.32 -37.58 83.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.988 0.423 . . . . 10.0 110.677 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -66.13 -45.56 80.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.042 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -62.89 -45.71 91.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.638 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 631' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' A' ' 635' ' ' GLU . 44.1 mt-30 -60.64 -48.63 80.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.778 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -60.92 -34.2 74.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.189 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -64.71 -42.57 95.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.998 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 634' ' ' VAL . . . . . 0.497 ' O ' ' HB3' ' A' ' 637' ' ' ARG . 70.1 t -62.81 -42.39 96.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.025 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.587 ' HA ' ' ND2' ' A' ' 638' ' ' ASN . 4.5 mm-40 -68.26 -28.98 67.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.743 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 51.1 m -67.37 -28.47 67.98 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.461 0.648 . . . . 10.0 109.339 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 637' ' ' ARG . . . . . 0.497 ' HB3' ' O ' ' A' ' 634' ' ' VAL . 16.8 ttp180 -67.31 -38.18 84.55 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.137 -0.938 . . . . 10.0 109.64 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . 0.587 ' ND2' ' HA ' ' A' ' 635' ' ' GLU . 12.2 m-20 -60.26 -45.42 93.34 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.579 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -57.53 -46.02 84.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.125 -0.943 . . . . 10.0 111.533 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.51 -43.81 98.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.618 0.247 . . . . 10.0 110.801 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 73.9 mt -64.57 -46.81 91.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.372 -0.377 . . . . 10.0 110.275 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 642' ' ' ARG . . . . . 0.433 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 12.2 mtm-85 -61.1 -42.41 98.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.061 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -58.05 -44.13 87.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.602 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.42 -44.88 95.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.621 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 71.7 mt -66.54 -40.76 89.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.005 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 646' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 82.6 mt -61.68 -27.92 69.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.115 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -69.0 -20.69 64.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.96 0.41 . . . . 10.0 110.682 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -101.52 -39.7 7.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.658 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -67.19 -34.21 77.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.653 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 650' ' ' ASP . . . . . 0.433 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 4.4 t0 -65.94 -26.93 67.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.91 0.386 . . . . 10.0 111.153 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 24.3 t -63.07 -44.47 99.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.158 0.504 . . . . 10.0 110.1 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -71.7 -29.13 64.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.701 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -66.91 -46.68 74.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.379 -0.828 . . . . 10.0 110.43 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -57.23 -48.71 78.14 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.516 0.51 . . . . 10.0 110.533 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 655' ' ' GLN . . . . . 0.411 HE22 ' HB2' ' A' ' 807' ' ' SER . 74.2 mt-30 -62.23 -42.53 99.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.792 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 9.8 ttp-105 -63.31 -42.58 99.03 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 120.974 0.416 . . . . 10.0 109.984 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 46.1 ttp180 -59.87 -47.09 87.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.769 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -66.37 -46.66 75.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.046 -179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 10.1 tp -69.07 -33.47 58.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 121.126 -0.23 . . . . 10.0 111.61 -179.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -68.11 -31.42 71.0 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.182 -0.303 . . . . 10.0 110.182 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.3 m -67.55 -45.87 74.4 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.769 -0.456 . . . . 10.0 109.769 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -65.58 -44.84 85.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.442 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -61.27 -37.14 82.09 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.35 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -73.98 -35.94 64.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.203 -0.453 . . . . 10.0 111.19 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -63.5 -49.25 74.31 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.688 -0.486 . . . . 10.0 109.688 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 666' ' ' LEU . . . . . 0.458 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 88.1 mt -59.76 -28.98 67.86 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.169 0.509 . . . . 10.0 110.282 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.407 ' O ' ' HD3' ' A' ' 195' ' ' PRO . 0.9 OUTLIER -74.73 -46.56 36.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.507 -0.77 . . . . 10.0 110.594 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.68 -49.34 59.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.757 -0.656 . . . . 10.0 112.051 -178.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 9.8 m -73.28 150.94 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.065 0.459 . . . . 10.0 111.055 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 11.1 m -101.92 -36.8 8.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.238 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -79.96 90.18 5.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.866 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 9.6 p -92.87 -9.97 9.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.543 0.687 . . . . 10.0 109.477 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.63 -42.35 67.67 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 114.829 -1.078 . . . . 10.0 111.838 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -56.22 -51.44 68.07 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.341 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 2.4 m -60.94 -45.81 93.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.084 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 48.1 mm -55.13 -47.32 77.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.474 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -70.65 -39.72 73.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.586 -0.279 . . . . 10.0 111.436 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 50.0 m -60.99 -46.58 90.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.47 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 38.0 pt -76.24 -21.22 15.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.234 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 23.5 ttm-85 -60.01 -46.91 87.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.799 0.333 . . . . 10.0 110.77 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -62.28 -45.16 94.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.64 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -62.05 -52.01 65.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.592 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 88.7 t -57.81 -45.36 87.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.236 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -63.79 -46.04 86.99 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.929 -0.308 . . . . 10.0 110.592 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -61.38 -47.68 84.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.667 -0.242 . . . . 10.0 110.704 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.25 -39.24 78.65 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.195 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 26.8 m -69.42 -39.09 78.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.428 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -67.97 -46.96 80.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.545 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 689' ' ' ASP . . . . . 0.483 ' HA ' ' O ' ' A' ' 692' ' ' ILE . 85.4 m-20 -59.81 -20.84 59.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.959 -178.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -69.46 -41.87 75.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.505 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -105.47 -14.62 15.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.947 0.403 . . . . 10.0 111.489 -179.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 692' ' ' ILE . . . . . 0.483 ' O ' ' HA ' ' A' ' 689' ' ' ASP . 35.3 mt -132.67 97.66 17.12 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.678 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.12 130.76 37.83 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.333 2.022 . . . . 10.0 111.389 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 694' ' ' PRO . . . . . 0.489 ' HA ' ' NH2' ' A' ' 736' ' ' ARG . 12.1 Cg_endo -56.1 118.44 5.23 Favored 'Trans proline' 0 C--O 1.238 0.499 0 C-N-CA 122.614 2.209 . . . . 10.0 112.508 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 62.12 72.09 0.51 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.438 -0.801 . . . . 10.0 111.257 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 52.0 p -141.84 -167.38 2.43 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.994 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 78.8 mt -83.58 142.79 30.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.473 -0.331 . . . . 10.0 110.578 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . 0.493 ' HA ' ' CD2' ' A' ' 701' ' ' TRP . 24.5 tt0 -61.11 -26.32 67.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.212 0.53 . . . . 10.0 111.153 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -71.08 -16.39 62.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.905 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 14.6 mmt -97.35 6.3 48.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.657 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 701' ' ' TRP . . . . . 0.493 ' CD2' ' HA ' ' A' ' 698' ' ' GLU . 49.7 m0 -98.49 114.5 26.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.088 -178.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 702' ' ' ASP . . . . . 0.604 ' OD1' ' HD3' ' B' ' 6' ' ' ARG . 9.5 t70 -86.15 77.74 9.52 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 703' ' ' ILE . . . . . 0.481 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 36.9 mm -53.52 -48.75 91.86 Favored Pre-proline 0 CA--C 1.537 0.459 0 CA-C-N 115.193 -0.912 . . . . 10.0 112.13 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 704' ' ' PRO . . . . . 0.481 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 47.6 Cg_exo -56.44 -37.4 97.26 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 121.805 1.67 . . . . 10.0 112.303 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -69.45 -40.26 79.35 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 121.246 -0.502 . . . . 10.0 112.344 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 37.8 tp -67.15 -44.59 79.43 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -63.65 -37.2 86.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.966 -0.561 . . . . 10.0 109.926 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.93 -48.49 75.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.516 -0.765 . . . . 10.0 110.611 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -74.77 -34.84 62.53 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.869 -0.605 . . . . 10.0 111.664 -178.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 51.3 mt -68.14 -50.77 52.51 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.729 0.27 . . . . 10.0 111.729 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -66.38 -31.84 72.86 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.028 0.381 . . . . 10.0 112.028 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -87.7 -71.19 0.58 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.748 0.647 . . . . 10.0 112.748 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.28 -58.53 6.83 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.214 0.82 . . . . 10.0 113.214 -176.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -79.06 -11.8 60.0 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.478 0.918 . . . . 10.0 113.478 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 2.2 t70 63.13 24.59 14.5 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.537 0.684 . . . . 10.0 110.051 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . 0.431 ' HG ' ' HG ' ' A' ' 718' ' ' LEU . 18.9 tp -104.71 98.74 8.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.34 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -82.99 97.16 8.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.124 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.431 ' HG ' ' HG ' ' A' ' 716' ' ' LEU . 80.3 mt -129.12 119.75 19.87 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.074 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -82.09 79.06 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.627 2.218 . . . . 10.0 111.399 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 57.9 mt -60.96 -39.29 81.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.51 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -66.04 -13.97 60.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.103 0.478 . . . . 10.0 111.162 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 722' ' ' GLU . . . . . 0.501 ' O ' ' HD2' ' A' ' 726' ' ' LYS . 4.4 tp10 -92.96 -10.4 36.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.701 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 45.2 m0 -96.97 -48.62 5.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.745 0.307 . . . . 10.0 111.643 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 63.2 mt -56.78 -22.63 37.4 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.269 0.84 . . . . 10.0 113.269 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.47 -19.75 21.69 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.794 0.294 . . . . 10.0 111.794 -179.259 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 726' ' ' LYS . . . . . 0.501 ' HD2' ' O ' ' A' ' 722' ' ' GLU . 36.3 mttp -99.93 -38.43 8.61 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.702 0.26 . . . . 10.0 111.702 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -128.74 86.41 57.62 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-O 121.162 0.506 . . . . 10.0 110.796 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -65.93 -13.27 39.08 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.925 2.417 . . . . 10.0 111.749 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 40.2 mp0 -66.02 -15.2 62.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.344 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 35.6 mt -71.74 -40.24 69.51 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 110.078 -0.341 . . . . 10.0 110.078 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 53.35 -88.27 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.053 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -144.31 -49.94 0.28 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.901 -0.32 . . . . 10.0 111.817 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -59.25 -58.89 6.66 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.781 0.325 . . . . 10.0 110.688 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.0 -26.35 68.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.554 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 27.7 tp -65.57 -47.45 75.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.58 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 736' ' ' ARG . . . . . 0.489 ' NH2' ' HA ' ' A' ' 694' ' ' PRO . 73.8 mtt-85 -64.87 -44.9 88.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.266 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -57.08 -40.34 76.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.359 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 15.3 mmm-85 -61.25 -40.19 93.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.937 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 79.6 mt -64.99 -43.71 96.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.399 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 52.1 tp -71.02 -37.45 72.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.415 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -66.87 -40.89 87.99 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.984 0.421 . . . . 10.0 110.599 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -66.67 -36.08 81.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.361 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.44 -41.57 88.96 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 82.1 mt -65.8 -35.87 76.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 178.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.19 -55.28 26.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.98 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.401 ' HA ' ' HD3' ' A' ' 749' ' ' ARG . 88.1 t -58.24 -35.87 55.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.328 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -59.24 -51.01 71.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.304 179.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -64.5 -38.2 90.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.617 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 749' ' ' ARG . . . . . 0.401 ' HD3' ' HA ' ' A' ' 746' ' ' VAL . 77.2 mtp180 -61.07 -36.75 80.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.403 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -80.34 -36.93 33.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.589 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -60.32 -42.84 96.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.597 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -65.22 -12.63 53.36 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 84.3 t -79.58 -43.34 23.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.725 0.298 . . . . 10.0 111.326 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 15.1 m -99.54 -20.21 5.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 112.066 0.395 . . . . 10.0 112.066 -179.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 110.04 144.35 10.23 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.707 -0.759 . . . . 10.0 112.002 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 756' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -60.16 -43.75 95.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.732 0.301 . . . . 10.0 110.899 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -58.99 -43.72 91.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.843 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.9 tpt -65.2 -44.25 88.96 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.383 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 50.9 mmm -63.02 -46.95 85.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.621 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -56.48 -39.73 73.72 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.916 0.389 . . . . 10.0 110.8 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -70.94 -40.8 71.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.142 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -63.69 -44.31 94.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.869 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -57.35 -45.47 84.31 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.028 0.442 . . . . 10.0 110.503 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 764' ' ' LYS . . . . . 0.458 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 72.4 tttt -62.17 -45.47 93.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.005 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -61.72 -44.18 98.26 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.833 -0.621 . . . . 10.0 112.309 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 65.3 t -63.47 -44.59 98.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.392 0.139 . . . . 10.0 110.906 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.69 -49.05 77.79 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.838 0.351 . . . . 10.0 110.583 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 73.3 mt -64.85 -39.93 94.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.15 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -58.89 -57.57 12.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.199 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 17.1 m -60.4 -41.05 93.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.369 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.45 -47.15 85.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.924 0.393 . . . . 10.0 109.991 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 772' ' ' ASP . . . . . 0.5 ' CG ' ' HZ2' ' A' ' 776' ' ' LYS . 9.9 t70 -64.82 -41.67 95.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.773 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 773' ' ' SER . . . . . 0.41 ' HB3' ' O ' ' B' ' 19' ' ' ALA . 23.2 m -62.04 -45.03 95.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.129 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 35.8 mt -69.53 -32.34 71.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.737 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -63.1 -40.01 96.39 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.5 ' HZ2' ' CG ' ' A' ' 772' ' ' ASP . 14.4 mptt -63.2 -42.79 99.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.861 -0.608 . . . . 10.0 110.268 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 14.2 tm-20 -65.58 -49.5 68.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.712 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 778' ' ' HIS . . . . . 0.526 ' O ' ' HG2' ' A' ' 782' ' ' MET . 43.3 t60 -58.48 -34.23 70.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.339 -0.846 . . . . 10.0 111.276 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.5 mt -62.08 -42.12 98.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.882 0.372 . . . . 10.0 110.275 179.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -73.05 -41.45 64.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.447 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.18 -32.01 71.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.695 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 782' ' ' MET . . . . . 0.526 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 84.8 mmm -62.68 -35.2 78.89 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.08 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -63.25 -50.55 69.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.854 0.359 . . . . 10.0 110.086 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -62.13 -27.07 68.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.24 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 9.5 mt -75.21 -45.86 37.64 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.28 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -60.69 -51.96 67.15 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.628 -179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.71 -28.02 63.41 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.778 0.323 . . . . 10.0 110.375 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -68.05 -18.93 71.42 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.746 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 16.2 mm -63.05 -24.38 35.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.736 0.303 . . . . 10.0 110.717 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 34.3 m80 -69.77 -14.75 62.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.779 0.323 . . . . 10.0 110.264 179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 16.6 mt -112.44 -34.32 5.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.669 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 792' ' ' ARG . . . . . 0.475 ' HD3' ' OE2' ' A' ' 806' ' ' GLU . 30.6 mtt180 -80.39 -21.68 42.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.143 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -78.1 79.19 1.49 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.252 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 6.8 p90 -69.81 167.81 16.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.047 0.451 . . . . 10.0 110.982 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -70.13 170.92 10.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.987 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 30.3 tp60 68.81 12.53 8.68 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.339 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -154.76 150.88 28.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.155 -0.475 . . . . 10.0 109.967 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -89.03 139.51 28.92 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.191 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -59.92 -25.45 79.53 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.799 2.333 . . . . 10.0 112.869 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 800' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 801' ' ' GLN . 34.3 mtmm -79.59 162.58 25.24 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 801' ' ' GLN . . . . . 0.43 ' HB2' ' O ' ' A' ' 800' ' ' LYS . 8.4 mm100 72.62 -53.53 0.7 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.536 0.522 . . . . 10.0 110.803 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -59.92 -47.87 84.03 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -54.91 -35.51 64.23 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.738 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -69.3 -47.01 65.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.373 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -61.16 -41.35 96.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.538 -0.301 . . . . 10.0 111.026 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 806' ' ' GLU . . . . . 0.475 ' OE2' ' HD3' ' A' ' 792' ' ' ARG . 2.2 mm-40 -62.82 -51.05 68.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.266 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 807' ' ' SER . . . . . 0.411 ' HB2' HE22 ' A' ' 655' ' ' GLN . 6.2 p -67.6 -38.71 84.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.395 -0.366 . . . . 10.0 111.742 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -63.34 -34.23 77.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.538 0.209 . . . . 10.0 110.814 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 57.9 m -62.53 -38.41 89.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.138 0.494 . . . . 10.0 110.19 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 46.8 ttm -71.95 -34.14 68.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.112 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -62.63 -41.28 98.92 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.539 -0.541 . . . . 10.0 109.539 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -66.21 -44.33 84.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.166 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -64.16 -32.09 73.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.5 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 28.7 ttp -63.18 -41.88 99.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.467 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 49.1 mt -68.06 -35.55 78.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.915 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 816' ' ' GLU . . . . . 0.536 ' CD ' ' HZ2' ' A' ' 819' ' ' LYS . 47.2 mm-40 -65.13 -45.3 85.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.059 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 7.3 m -71.75 -27.95 63.32 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.002 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 29.4 tp -54.76 -58.81 6.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.348 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 819' ' ' LYS . . . . . 0.536 ' HZ2' ' CD ' ' A' ' 816' ' ' GLU . 12.9 pttp -67.99 -26.35 65.87 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.348 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -61.17 -48.25 82.44 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.862 0.363 . . . . 10.0 110.364 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.83 -46.69 62.3 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.332 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 54.1 t -51.08 -52.52 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.807 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 27.8 mm -64.65 -43.79 96.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.591 -0.277 . . . . 10.0 111.427 -179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 30.9 m -62.88 -45.9 90.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.735 0.302 . . . . 10.0 110.859 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 95.1 m -61.61 -41.87 98.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.606 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 57.0 mt -71.96 -37.19 69.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.433 -0.348 . . . . 10.0 111.816 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 15.6 m -75.41 -32.83 60.87 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.81 0.338 . . . . 10.0 110.908 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -86.47 15.47 5.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.401 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.2 p -62.46 128.79 24.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -93.82 96.11 9.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.957 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 23.3 m -109.32 164.07 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.489 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 10.5 mmt-85 -85.79 81.03 8.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.576 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 95.2 mtp -65.04 116.64 31.8 Favored Pre-proline 0 C--N 1.328 -0.335 0 N-CA-C 110.047 -0.353 . . . . 10.0 110.047 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -89.0 -152.73 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.991 2.461 . . . . 10.0 112.773 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -71.25 103.22 2.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.389 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.741 -0.647 . . . . 10.0 110.455 -179.927 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mpp? . . . . . 0 N--CA 1.483 1.217 0 CA-C-O 120.672 0.272 . . . . 10.0 110.503 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 11.2 tpt -131.7 111.95 12.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.174 -0.466 . . . . 10.0 109.782 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 7.9 mt -91.51 85.79 2.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.114 0.483 . . . . 10.0 110.48 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.39 96.23 5.29 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.155 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 23.9 mt -97.21 126.15 42.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.43 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.604 ' HD3' ' OD1' ' A' ' 702' ' ' ASP . 7.8 ttm180 -99.94 131.72 45.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.737 0.303 . . . . 10.0 110.306 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.27 143.11 30.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.195 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.88 36.49 2.17 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.499 0.666 . . . . 10.0 109.763 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -149.44 145.0 26.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.374 -0.83 . . . . 10.0 109.331 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 26.4 tttm -139.21 134.8 33.22 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.731 0.3 . . . . 10.0 110.42 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 17.9 mt -130.01 79.96 72.0 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.239 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.91 -15.6 29.52 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.49 2.126 . . . . 10.0 112.589 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.02 -21.55 65.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.264 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.38 -52.36 58.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.636 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 17.0 m -80.26 -21.41 11.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.59 -0.277 . . . . 10.0 111.549 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.97 -33.99 75.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.302 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 16.2 t -77.38 -36.65 24.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.492 -0.322 . . . . 10.0 110.548 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.36 -49.84 73.97 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 121.075 0.464 . . . . 10.0 110.904 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . 0.41 ' O ' ' HB3' ' A' ' 773' ' ' SER . . . -85.46 4.4 35.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.084 0.469 . . . . 10.0 110.448 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -102.1 20.38 45.55 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.87 -0.605 . . . . 10.0 112.395 -179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.485 ' HA ' ' O ' ' A' ' 229' ' ' ALA . 18.0 m -85.15 1.73 4.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.4 0.619 . . . . 10.0 110.472 179.378 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 12.9 tmm? -67.15 125.7 26.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.526 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.62 58.47 0.73 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.186 0.517 . . . . 10.0 110.564 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -122.37 21.53 10.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.977 0.418 . . . . 10.0 111.09 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -81.26 53.1 1.96 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.109 0.481 . . . . 10.0 110.722 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.67 75.36 8.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.572 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -125.29 148.87 48.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.582 -179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.158 -0.925 . . . . 10.0 109.797 -179.769 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 91.1 t . . . . . 0 N--CA 1.477 0.89 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -75.28 143.55 42.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.157 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 98.67 -151.2 19.5 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.869 -0.682 . . . . 10.0 111.617 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.96 175.33 10.14 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.585 0.231 . . . . 10.0 110.406 179.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.441 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 15.7 mmt85 -116.24 172.49 7.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.731 0.301 . . . . 10.0 111.286 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.6 t30 62.95 -90.1 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.391 -0.822 . . . . 10.0 111.36 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -59.39 -50.4 74.09 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.124 0.487 . . . . 10.0 111.4 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -68.15 -35.31 77.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.537 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.5 m -62.13 -46.63 88.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.814 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.2 mt -59.72 -40.73 88.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.879 0.371 . . . . 10.0 110.797 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.7 OUTLIER -65.28 -49.61 68.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.006 -179.801 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -63.4 -38.22 90.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.947 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.546 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -66.6 -42.11 87.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.711 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -58.39 -37.11 74.61 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.555 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -62.64 -37.35 86.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.355 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.3 t -75.48 -37.57 37.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.739 179.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -58.49 -36.59 59.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.927 178.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -59.42 -41.21 89.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.801 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.5 mt -65.2 -43.41 95.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.876 -0.602 . . . . 10.0 109.954 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.1 mt -61.94 -41.77 92.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.204 179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -63.39 -36.1 82.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.733 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.37 -24.26 50.67 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.33 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 35.6 mtt -86.2 -16.51 37.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.45 -0.341 . . . . 10.0 111.382 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.472 ' OE1' ' HD2' ' A' ' 82' ' ' ARG . 3.9 tt0 -57.88 -53.56 64.52 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-O 119.485 -0.293 . . . . 10.0 111.537 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.443 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 31.2 Cg_exo -60.52 -25.89 81.62 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.647 1.565 . . . . 10.0 111.86 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -71.84 -45.35 61.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.243 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.2 mmt -66.06 -26.01 67.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.663 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -67.95 -15.2 63.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.004 -0.543 . . . . 10.0 110.994 179.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -93.07 -5.0 51.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.322 0.582 . . . . 10.0 110.038 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.7 mp -98.1 145.15 26.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.29 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.5 p -77.66 170.55 16.38 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.171 -0.468 . . . . 10.0 109.862 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.83 -43.5 90.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.149 0.5 . . . . 10.0 110.364 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -65.55 -30.53 71.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.652 -0.704 . . . . 10.0 111.043 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -70.05 -33.91 72.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.622 0.249 . . . . 10.0 110.409 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 73.3 mt -65.45 -42.24 92.58 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -64.81 -31.3 72.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.261 -0.881 . . . . 10.0 109.417 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.6 -34.47 89.11 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.412 -0.813 . . . . 10.0 112.144 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.433 ' HZ3' ' CD ' ' A' ' 49' ' ' GLU . 29.1 mmmt -65.3 -36.16 83.21 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.979 -0.378 . . . . 10.0 109.979 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.9 m -61.74 -43.67 98.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.269 0.557 . . . . 10.0 109.66 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.9 -30.29 68.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.774 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.433 ' CD ' ' HZ3' ' A' ' 46' ' ' LYS . 4.0 tt0 -68.2 -45.89 72.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.592 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -58.53 -42.84 88.68 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.178 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -60.51 -46.63 89.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.914 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.21 -32.72 73.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.352 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 43.4 mtp180 -68.24 -49.35 61.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.857 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 82.6 mt -61.05 -31.96 71.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.006 0.432 . . . . 10.0 110.535 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -62.22 -44.99 95.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.902 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -83.08 -48.99 9.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.07 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 163.53 111.48 0.26 Allowed Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.51 -0.636 . . . . 10.0 111.51 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -166.66 154.68 9.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 43.9 t -99.83 131.67 46.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.409 HD12 ' O ' ' A' ' 118' ' ' LEU . 14.8 tp -60.09 -42.72 95.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.193 0.521 . . . . 10.0 110.269 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.6 mp0 -65.4 -19.68 66.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.014 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -87.21 -18.58 29.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.356 0.598 . . . . 10.0 110.176 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.7 mt -83.06 -13.68 55.3 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.951 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.498 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 89.3 mt -48.69 -53.41 36.69 Favored Pre-proline 0 CA--C 1.542 0.652 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -178.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.498 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.1 Cg_exo -53.38 -47.34 27.93 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.021 1.814 . . . . 10.0 113.098 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -74.9 -46.45 35.9 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.813 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.97 75.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.977 -178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -62.18 -34.73 76.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.85 -179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.8 -44.38 85.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.192 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.44 -45.69 98.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.237 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 59.1 t -61.8 -44.94 99.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.127 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.7 ttm180 -60.26 -42.87 96.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.116 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.1 tp10 -61.36 -48.67 80.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.379 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.97 73.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.911 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.7 m -62.08 -35.11 77.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.952 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.5 mtmt -78.36 -18.2 55.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.527 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -98.42 -45.9 5.97 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 111.782 0.29 . . . . 10.0 111.782 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 76.5 t -76.05 -54.92 12.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.687 0.28 . . . . 10.0 111.639 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -90.11 -43.05 10.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.714 0.292 . . . . 10.0 111.205 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.2 16.62 24.75 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.806 -0.711 . . . . 10.0 111.591 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.6 mtm -131.04 124.18 30.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.754 0.311 . . . . 10.0 110.191 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.472 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 9.5 ttp180 -71.07 133.35 46.21 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.875 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.95 117.5 7.09 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.412 ' HB2' ' HG3' ' A' ' 87' ' ' GLN . 33.1 m-85 -56.66 149.56 17.52 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.451 0.469 . . . . 10.0 111.278 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -61.71 -34.08 75.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.037 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.6 m -68.1 -29.96 46.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 10.0 110.79 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.428 HE22 HD22 ' A' ' 110' ' ' LEU . 96.3 mt-30 -70.64 -31.09 67.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.07 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 74.6 mt -64.29 -34.19 77.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.793 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.5 mt -66.85 -49.75 64.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.684 178.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -63.58 -46.25 92.72 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.629 -0.714 . . . . 10.0 112.501 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.29 -31.93 78.92 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.996 -0.621 . . . . 10.0 112.213 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' MET . . . . . 0.546 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 14.9 ttm -72.6 -35.44 67.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.993 0.425 . . . . 10.0 110.44 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.7 t -70.31 -36.33 66.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.127 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 93.8 mt -72.92 3.08 5.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.713 -0.676 . . . . 10.0 112.091 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -80.04 -30.08 39.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.336 0.589 . . . . 10.0 109.485 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -104.75 -167.22 1.32 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.409 -0.814 . . . . 10.0 111.051 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 -86.38 57.58 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.065 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 408' ' ' ASP . 31.4 m -127.9 147.79 50.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.957 -0.565 . . . . 10.0 112.05 -178.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 43.5 mm -100.16 123.85 53.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 108.745 -0.835 . . . . 10.0 108.745 177.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.69 134.45 51.96 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.05 0.452 . . . . 10.0 112.056 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 102' ' ' MET . 0.0 OUTLIER -97.21 158.72 15.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.61 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.447 ' H ' ' CD ' ' A' ' 101' ' ' GLU . 49.2 ttm -171.69 134.97 0.84 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.836 -0.801 . . . . 10.0 108.836 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -62.06 151.6 34.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.239 0.542 . . . . 10.0 111.476 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.0 m -71.51 92.74 1.14 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.929 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 152.7 -28.85 0.84 Allowed Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.783 -0.722 . . . . 10.0 112.205 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.438 ' HB2' ' SD ' ' A' ' 102' ' ' MET . 5.5 mm-40 -66.96 -17.26 64.83 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.769 0.319 . . . . 10.0 111.135 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.28 67.21 0.64 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.744 -0.741 . . . . 10.0 112.429 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -61.07 -58.84 6.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.84 0.352 . . . . 10.0 111.049 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.1 -36.29 81.26 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.969 -179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.428 HD22 HE22 ' A' ' 87' ' ' GLN . 31.6 tp -67.81 -27.2 66.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.271 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 95.7 m -80.19 -30.4 38.72 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.013 0.435 . . . . 10.0 111.252 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.405 ' HB3' HD22 ' A' ' 207' ' ' LEU . . . -67.29 -12.3 59.76 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.072 0.767 . . . . 10.0 113.072 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 31.8 p -75.63 -24.41 56.45 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.02 0.378 . . . . 10.0 112.02 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 52.4 mt -65.95 -56.23 18.29 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.098 0.407 . . . . 10.0 112.098 -179.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -65.06 -26.16 58.25 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.891 1.727 . . . . 10.0 111.881 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.28 -52.71 44.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.526 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.407 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 68.8 t80 -60.41 -43.9 96.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.082 0.467 . . . . 10.0 110.688 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.409 ' O ' HD12 ' A' ' 60' ' ' LEU . 34.7 tp -60.55 -51.07 71.0 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.638 -0.71 . . . . 10.0 112.009 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -73.31 -24.11 60.36 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.839 0.311 . . . . 10.0 111.839 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -67.12 -24.07 65.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.711 0.291 . . . . 10.0 110.975 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 71.6 mt -59.9 -26.46 65.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.609 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.0 p -66.48 -29.39 69.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.895 0.378 . . . . 10.0 111.171 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.96 14.14 67.78 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.782 -0.723 . . . . 10.0 112.602 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -93.06 -12.5 30.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.838 0.351 . . . . 10.0 111.165 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 88.85 119.49 1.67 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.783 -0.723 . . . . 10.0 113.012 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.1 t -80.41 115.54 23.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -86.16 92.0 8.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.004 0.43 . . . . 10.0 110.339 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 28.3 t -84.65 122.97 38.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.153 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.464 ' O ' ' HA ' ' A' ' 208' ' ' VAL . 87.1 t -109.7 122.47 64.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.363 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.22 148.16 39.45 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.831 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 4.1 m -54.17 -37.84 36.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 O-C-N 123.486 0.492 . . . . 10.0 112.029 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -141.44 168.53 19.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.561 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -75.17 -26.74 59.3 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.145 -0.48 . . . . 10.0 111.532 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -56.66 -52.88 63.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.892 0.377 . . . . 10.0 110.544 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 98.3 mt -70.76 -34.64 72.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.582 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.61 -52.6 64.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.687 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -67.81 -35.54 78.8 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.999 0.428 . . . . 10.0 110.339 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 138' ' ' ARG . 4.5 ttp180 -58.0 -59.03 5.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.061 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . 0.404 ' CG ' HH21 ' A' ' 138' ' ' ARG . 2.2 m-20 -70.86 -27.98 64.23 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.597 0.592 . . . . 10.0 112.597 -178.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -59.81 -44.28 94.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.861 0.362 . . . . 10.0 110.906 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -88.89 -25.44 22.13 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.429 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -71.86 -46.92 56.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.916 0.388 . . . . 10.0 111.241 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -89.36 0.34 56.89 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.438 -0.347 . . . . 10.0 111.046 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 58.3 ttm-85 -60.69 -49.67 88.66 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' PRO . . . . . 0.472 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 28.0 Cg_exo -62.96 -10.57 20.88 Favored 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 122.178 1.919 . . . . 10.0 112.888 -179.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.0 tp -92.66 -50.17 5.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.052 0.453 . . . . 10.0 110.288 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -71.79 -45.87 60.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.007 -0.542 . . . . 10.0 112.004 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.94 -24.75 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.982 0.42 . . . . 10.0 110.792 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -70.37 -33.15 71.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.764 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 60.1 mt -84.29 -14.91 48.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.811 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 109.94 16.97 10.01 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.798 -0.715 . . . . 10.0 112.951 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 37.2 mt -102.58 134.08 46.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.795 0.331 . . . . 10.0 110.435 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.03 126.69 34.34 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.567 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 46.9 t -106.06 128.63 60.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.908 0.385 . . . . 10.0 110.828 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -124.13 146.99 16.49 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.075 -0.583 . . . . 10.0 111.773 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.6 tp -118.56 125.8 74.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.062 0.458 . . . . 10.0 110.44 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -101.68 113.38 26.49 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.054 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 36.0 mt -100.37 141.71 23.23 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.742 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' PRO . . . . . 0.45 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 24.0 Cg_endo -61.07 107.21 0.44 Allowed 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.962 2.441 . . . . 10.0 112.854 -179.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.69 16.3 46.17 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.021 -0.609 . . . . 10.0 113.372 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 12.4 ptm -77.64 159.58 76.54 Favored Pre-proline 0 CA--C 1.535 0.393 0 CA-C-N 117.26 0.53 . . . . 10.0 109.9 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -52.06 143.52 40.74 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.062 2.508 . . . . 10.0 113.291 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . 0.439 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -57.89 -49.11 95.53 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.794 -0.639 . . . . 10.0 112.422 -179.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.439 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 41.9 Cg_exo -58.69 -36.31 97.36 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.599 1.533 . . . . 10.0 112.046 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.02 -39.25 90.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.513 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.437 ' HZ1' ' CG ' ' A' ' 185' ' ' ASP . 57.5 mttm -60.95 -43.58 98.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.155 179.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -59.8 -39.37 84.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.667 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -68.16 -39.32 82.63 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.988 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -73.08 -38.87 66.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.011 -0.541 . . . . 10.0 111.501 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -75.54 -26.29 57.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.686 0.279 . . . . 10.0 111.564 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -80.34 1.48 28.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.048 0.452 . . . . 10.0 110.756 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -81.61 176.32 9.75 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.802 -0.636 . . . . 10.0 109.722 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -78.24 -33.42 49.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.881 0.372 . . . . 10.0 110.522 -179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 88.0 mt -136.79 122.16 26.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.121 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.1 m -115.51 122.73 46.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.833 0.349 . . . . 10.0 111.194 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -97.95 136.2 38.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.898 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.81 170.32 43.08 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.441 -0.885 . . . . 10.0 112.817 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.5 m -88.48 151.12 22.75 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 122.43 0.292 . . . . 10.0 110.679 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -57.62 -42.31 83.09 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 -179.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -58.21 -54.26 48.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.615 -0.266 . . . . 10.0 111.421 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' GLU . . . . . 0.45 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.4 tp10 -65.27 -37.67 87.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.091 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.81 -39.24 80.56 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.897 0.379 . . . . 10.0 110.701 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -76.13 -42.64 23.57 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.85 -0.69 . . . . 10.0 111.596 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -37.97 86.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.89 0.376 . . . . 10.0 110.429 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . 0.437 ' CG ' ' HZ1' ' A' ' 166' ' ' LYS . 8.3 m-20 -59.5 -44.06 93.21 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.429 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.64 -38.78 91.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.47 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 47.5 mt -64.58 -46.62 81.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.819 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 28.3 mtm180 -69.68 -35.86 75.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.124 0.488 . . . . 10.0 110.545 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.03 -50.65 71.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.483 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.3 -0.9 30.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.732 -0.667 . . . . 10.0 112.438 -178.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 25.7 ttp -105.39 10.77 33.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.193 0.521 . . . . 10.0 110.403 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' ALA . . . . . 0.4 ' HB1' ' HB2' ' A' ' 197' ' ' GLU . . . -78.05 166.07 23.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.254 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -103.83 -26.24 12.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.078 0.466 . . . . 10.0 110.227 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -118.05 138.52 25.56 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.49 -23.94 76.59 Favored 'Trans proline' 0 CA--C 1.53 0.284 0 C-N-CA 122.614 2.209 . . . . 10.0 112.534 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 37.8 mp0 -78.44 -13.01 60.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.464 -0.334 . . . . 10.0 111.079 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . 0.4 ' HB2' ' HB1' ' A' ' 192' ' ' ALA . 67.6 mt-10 -82.39 -4.99 58.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.549 -0.296 . . . . 10.0 110.902 -179.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 198' ' ' ARG . 45.6 mtt85 -62.68 157.78 20.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.284 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 12.2 m -133.29 -14.63 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.057 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -91.79 163.79 13.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.179 0.514 . . . . 10.0 111.558 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -122.76 174.86 6.86 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.679 -0.86 . . . . 10.0 108.679 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -55.23 124.67 17.74 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.122 0.487 . . . . 10.0 111.182 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 10.4 mt -79.82 72.32 6.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.307 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 9.7 t-160 -88.49 -53.57 4.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.733 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -128.78 138.68 52.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.916 0.388 . . . . 10.0 111.789 -178.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' ALA . . . . . 0.559 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . . . -129.97 135.84 48.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.552 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 112' ' ' ALA . 35.7 tp -131.69 109.92 10.52 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.354 -179.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 2.9 p -104.97 140.55 22.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.67 0.272 . . . . 10.0 110.98 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.34 -40.59 70.6 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' GLU . . . . . 0.413 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 7.5 tt0 -135.27 113.72 11.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.036 0.446 . . . . 10.0 111.029 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 34.2 m -84.54 -14.88 11.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.111 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . 0.408 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 0.9 OUTLIER -55.53 -71.13 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.729 -179.18 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.1 m -76.13 -38.09 57.23 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.473 0.546 . . . . 10.0 112.473 -178.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' ILE . . . . . 0.497 ' O ' ' HB2' ' A' ' 218' ' ' GLU . 45.5 mt -71.55 -43.54 71.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 113.993 1.108 . . . . 10.0 113.993 -177.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 17.0 mt -93.74 -50.68 5.26 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.929 0.714 . . . . 10.0 112.929 -177.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 216' ' ' ILE . . . . . 0.408 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 48.6 mm -73.14 -56.68 8.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -70.97 -39.49 72.48 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 218' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 214' ' ' ILE . 6.0 mm-40 -91.61 19.27 6.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.89 -51.4 69.44 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 220' ' ' ARG . . . . . 0.423 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -96.85 32.36 2.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.96 0.409 . . . . 10.0 111.392 -178.571 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 17.4 m -101.86 105.02 39.24 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-O 120.92 0.39 . . . . 10.0 110.197 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 222' ' ' PRO . . . . . 0.423 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 73.1 Cg_endo -91.33 132.25 1.44 Allowed 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.939 2.426 . . . . 10.0 112.778 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 223' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 374' ' ' SER . 69.2 mt -78.22 105.65 9.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.156 -0.474 . . . . 10.0 109.768 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 59.0 mt -86.49 122.88 39.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.775 -0.648 . . . . 10.0 112.18 -178.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 59.8 mt -105.45 134.29 47.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.273 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 22.3 m -116.41 166.88 11.56 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.477 -0.194 . . . . 10.0 110.477 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -128.91 158.77 22.05 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.514 -0.85 . . . . 10.0 112.797 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -76.93 -22.43 11.56 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.655 2.237 . . . . 10.0 112.362 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -130.27 71.91 1.47 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -81.86 -108.82 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.905 -0.589 . . . . 10.0 112.033 -178.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.59 175.12 3.03 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.272 0.558 . . . . 10.0 111.801 -178.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 15.5 m -142.18 145.37 34.09 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.492 0.663 . . . . 10.0 111.677 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.01 -35.81 69.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.911 -1.041 . . . . 10.0 111.521 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -50.22 -42.01 50.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.092 -0.958 . . . . 10.0 112.876 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -72.06 -58.94 3.02 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.815 -0.354 . . . . 10.0 111.695 -178.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 236' ' ' TYR . . . . . 0.413 ' HB3' ' HB1' ' A' ' 359' ' ' ALA . 43.8 m-85 -55.9 -41.43 74.49 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.249 0.462 . . . . 10.0 112.249 -178.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -67.5 -40.33 85.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.574 0.226 . . . . 10.0 111.1 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -40.6 88.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.978 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 98.9 t -68.48 -43.18 84.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.123 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -78.18 7.44 6.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.712 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 3.8 tptm -89.1 -25.94 21.62 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.672 -0.24 . . . . 10.0 111.512 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 10.8 tp -88.35 -18.27 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.885 0.374 . . . . 10.0 111.555 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 243' ' ' ILE . . . . . 0.455 ' HB ' ' HD3' ' A' ' 244' ' ' PRO . 57.1 mt -63.55 -48.69 80.52 Favored Pre-proline 0 CA--C 1.541 0.603 0 N-CA-C 112.765 0.654 . . . . 10.0 112.765 -179.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 244' ' ' PRO . . . . . 0.455 ' HD3' ' HB ' ' A' ' 243' ' ' ILE . 24.6 Cg_exo -65.17 -6.71 13.65 Favored 'Trans proline' 0 C--N 1.358 1.06 0 C-N-CA 122.144 1.896 . . . . 10.0 112.996 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -81.63 -16.84 50.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.966 0.413 . . . . 10.0 110.651 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 11.8 mt -90.74 162.42 14.89 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.551 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 29.7 pt -114.6 148.19 17.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.336 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 248' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 248' ' ' ARG . 6.3 ptm85 -77.25 107.32 9.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.204 0.526 . . . . 10.0 111.657 -179.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 249' ' ' GLN . . . . . 0.415 ' HB3' ' O ' ' A' ' 248' ' ' ARG . 6.2 pt20 169.38 -30.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.64 -1.164 . . . . 10.0 108.847 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 250' ' ' GLU . . . . . 0.488 ' HG2' ' N ' ' A' ' 251' ' ' LYS . 16.9 tt0 -179.59 163.29 1.17 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.263 -0.88 . . . . 10.0 109.233 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . 0.488 ' N ' ' HG2' ' A' ' 250' ' ' GLU . 48.7 mttm 75.91 80.8 0.1 Allowed 'General case' 0 N--CA 1.468 0.467 0 O-C-N 123.992 0.808 . . . . 10.0 112.479 178.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 252' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 45.48 36.02 2.26 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.749 -1.114 . . . . 10.0 113.263 177.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -95.17 -33.28 12.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.08 0.467 . . . . 10.0 110.833 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -113.58 172.98 6.64 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.954 -179.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.7 -21.61 32.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.305 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 36.2 m -155.03 -69.1 0.13 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.165 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 24.4 t80 62.55 -84.76 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.61 0.569 . . . . 10.0 110.971 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 60.63 -163.34 0.25 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.874 0.47 . . . . 10.0 111.308 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -78.39 -5.48 87.73 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.863 -0.684 . . . . 10.0 111.984 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -83.9 -68.46 0.71 Allowed 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 110.004 -0.369 . . . . 10.0 110.004 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 68.07 -146.75 46.78 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.964 -0.636 . . . . 10.0 112.901 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -161.97 152.13 16.93 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.833 -0.803 . . . . 10.0 108.833 -179.515 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -73.62 -167.62 0.47 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 120.525 -0.47 . . . . 10.0 110.862 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.72 69.85 0.12 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.412 0.893 . . . . 10.0 113.412 -178.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 1.4 m -153.97 35.45 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 109.027 -0.731 . . . . 10.0 109.027 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 266' ' ' ASP . . . . . 0.555 ' OD1' ' HG2' ' A' ' 268' ' ' LYS . 2.1 t0 73.54 167.02 0.3 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.143 -0.935 . . . . 10.0 110.008 -178.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -126.8 11.98 7.27 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 121.029 -0.269 . . . . 10.0 111.538 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 268' ' ' LYS . . . . . 0.555 ' HG2' ' OD1' ' A' ' 266' ' ' ASP . 0.6 OUTLIER -68.95 113.71 6.6 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.712 0.291 . . . . 10.0 110.37 179.73 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 20.6 m -87.08 78.86 8.83 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.092 0.473 . . . . 10.0 110.942 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 7.2 mmt85 -69.6 -0.86 7.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.216 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -73.83 -15.08 61.18 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.691 179.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 23.3 t 64.12 94.04 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 O-C-N 123.563 0.539 . . . . 10.0 111.111 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -112.57 -80.48 0.59 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.132 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 47.7 mt 59.09 83.0 0.13 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.157 0.504 . . . . 10.0 111.088 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 4.8 t -132.32 154.33 49.83 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.631 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -74.6 73.8 1.98 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.383 -0.372 . . . . 10.0 111.588 -179.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -115.53 176.11 5.22 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.18 -0.304 . . . . 10.0 110.18 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 278' ' ' GLY . . . . . 0.409 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . 80.89 -59.11 4.76 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.131 -0.557 . . . . 10.0 111.935 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 278' ' ' GLY . 4.1 mm? 72.2 -47.66 0.67 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.52 0.728 . . . . 10.0 111.666 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.36 -17.88 22.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.068 0.461 . . . . 10.0 111.136 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 80.5 mt -68.32 -41.24 81.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.453 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 7.3 tp -62.57 -20.93 26.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 120.837 0.351 . . . . 10.0 111.079 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -73.04 -24.67 60.74 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.184 0.516 . . . . 10.0 109.951 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -88.43 -36.14 16.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.755 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.61 -43.72 96.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.401 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 48.1 mt -70.23 173.13 7.07 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.284 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 287' ' ' VAL . . . . . 0.549 ' O ' ' HG2' ' A' ' 288' ' ' LYS . 21.6 t 69.88 161.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.004 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 288' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 287' ' ' VAL . 0.0 OUTLIER 67.78 179.05 0.23 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.602 0.761 . . . . 10.0 111.291 -179.914 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 72.33 170.65 0.32 Allowed 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.308 0.643 . . . . 10.0 112.102 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -88.55 -14.86 60.93 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 115.581 -0.736 . . . . 10.0 113.241 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 291' ' ' ILE . . . . . . . . . . . . . 13.1 tt -83.45 136.57 22.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 O-C-N 122.51 -0.406 . . . . 10.0 110.779 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 43.0 ttm 64.5 106.43 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 O-C-N 123.71 0.631 . . . . 10.0 111.962 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -87.98 -21.03 25.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.021 0.439 . . . . 10.0 110.585 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -89.8 -179.85 5.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.765 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -104.77 68.57 0.26 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 121.046 -0.597 . . . . 10.0 111.991 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -95.61 157.14 16.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.922 0.391 . . . . 10.0 110.746 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 48.5 m -90.36 124.54 35.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.52 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.8 tp -75.58 -13.26 60.34 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -178.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 299' ' ' TYR . . . . . 0.4 ' HA ' ' SD ' ' A' ' 307' ' ' MET . 46.2 p90 -93.01 5.83 50.08 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.596 -0.442 . . . . 10.0 111.382 -179.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 49.0 m -75.74 155.64 85.02 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.241 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -55.4 -30.01 71.1 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 123.221 2.614 . . . . 10.0 113.39 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -81.71 -6.96 59.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.019 0.438 . . . . 10.0 111.381 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -118.72 7.11 11.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.905 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 10.6 tp -60.81 -25.08 34.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.334 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -63.49 -50.2 70.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.149 0.5 . . . . 10.0 109.928 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.16 -41.76 73.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.608 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 307' ' ' MET . . . . . 0.4 ' SD ' ' HA ' ' A' ' 299' ' ' TYR . 27.1 ttt -57.36 -43.72 83.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.983 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -66.32 -33.81 76.57 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.327 -0.233 . . . . 10.0 110.857 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -74.84 -39.95 61.32 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.177 -0.209 . . . . 10.0 111.348 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 23.8 m -70.59 -35.28 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 C-N-CA 120.679 -0.408 . . . . 10.0 110.599 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 60.4 m -65.56 -35.59 81.28 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.384 0.611 . . . . 10.0 109.758 178.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 312' ' ' ALA . . . . . . . . . . . . . . . -67.08 -32.87 74.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.855 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 313' ' ' ALA . . . . . 0.447 ' HA ' ' CB ' ' A' ' 356' ' ' ALA . . . -73.29 -33.75 65.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.488 -0.778 . . . . 10.0 110.554 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 1.8 mp -70.27 -46.63 63.97 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.773 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 315' ' ' ARG . . . . . . . . . . . . . 30.5 ptt180 -64.38 -26.29 68.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.851 0.358 . . . . 10.0 110.706 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -77.48 2.33 16.54 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.235 0.54 . . . . 10.0 110.814 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -115.56 2.6 13.84 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.883 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -140.39 -51.93 0.49 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.335 -0.393 . . . . 10.0 111.073 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -67.56 -43.06 81.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.034 0.445 . . . . 10.0 110.489 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -98.7 97.59 8.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.076 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 321' ' ' THR . . . . . 0.436 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 3.0 m -88.48 135.73 33.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.076 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 322' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 0.2 OUTLIER -60.49 145.93 46.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.715 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 323' ' ' ASP . . . . . 0.454 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 0.2 OUTLIER 81.42 -50.07 0.26 Allowed 'General case' 0 N--CA 1.468 0.446 0 O-C-N 124.306 1.003 . . . . 10.0 112.83 178.393 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 324' ' ' VAL . . . . . 0.436 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 13.6 p -86.28 -35.19 8.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 112.671 0.619 . . . . 10.0 112.671 -178.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -97.64 -35.17 10.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.103 0.478 . . . . 10.0 110.957 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 326' ' ' TYR . . . . . 0.419 ' HH ' ' CD ' ' A' ' 361' ' ' GLU . 34.7 p90 -151.28 146.31 25.95 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.364 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 9.9 tp -122.98 132.14 71.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.195 -0.668 . . . . 10.0 109.195 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 2.7 m -102.59 130.89 51.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.165 0.507 . . . . 10.0 111.053 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 329' ' ' LYS . . . . . 0.56 ' O ' ' HD3' ' A' ' 329' ' ' LYS . 0.0 OUTLIER -145.61 127.61 15.53 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.122 179.48 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 3.7 p30 49.16 30.14 2.88 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.964 0.906 . . . . 10.0 112.941 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 91.37 -2.42 78.06 Favored Glycine 0 C--N 1.328 0.138 0 C-N-CA 120.74 -0.743 . . . . 10.0 113.195 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -100.32 136.86 39.56 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.811 0.339 . . . . 10.0 110.306 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 27.1 t -104.06 115.31 45.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.573 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 59.3 mt -107.13 130.59 58.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.39 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 4.3 mp -77.52 126.74 38.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 46.8 t -101.99 122.03 53.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.243 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.53 119.82 23.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.91 -0.587 . . . . 10.0 109.727 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -83.2 -12.61 56.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.989 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -76.94 -51.98 10.22 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.07 -0.252 . . . . 10.0 111.638 -178.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.49 -10.41 11.94 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.211 0.448 . . . . 10.0 112.211 -179.087 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 84.98 30.51 25.76 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.809 -0.71 . . . . 10.0 111.852 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -87.33 161.72 17.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.91 0.386 . . . . 10.0 110.81 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.31 115.71 27.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.278 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 59.4 mtt -113.14 101.15 9.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.869 0.366 . . . . 10.0 110.684 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -95.65 -26.05 15.89 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.982 0.42 . . . . 10.0 110.968 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -96.8 48.53 1.63 Allowed Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.767 -0.73 . . . . 10.0 112.894 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -135.99 106.4 6.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.016 0.436 . . . . 10.0 110.441 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 348' ' ' ARG . . . . . 0.404 ' NH2' ' HB2' ' A' ' 366' ' ' GLN . 5.0 tpt180 -101.0 95.81 6.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.272 -179.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -73.48 144.13 46.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 10.0 109.948 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 6.1 m -91.53 -168.8 2.12 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 29.7 t70 71.63 -57.66 0.6 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.418 1.087 . . . . 10.0 112.144 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 145.01 58.34 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.433 -0.889 . . . . 10.0 112.614 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 9.0 mp -97.3 -25.87 15.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.08 0.467 . . . . 10.0 110.872 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 354' ' ' HIS . . . . . 0.4 ' O ' ' HB ' ' A' ' 357' ' ' VAL . 29.9 p80 -129.41 -12.32 4.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.436 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 355' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -59.73 -34.39 72.88 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.639 -0.709 . . . . 10.0 110.71 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 356' ' ' ALA . . . . . 0.447 ' CB ' ' HA ' ' A' ' 313' ' ' ALA . . . -83.42 -23.37 32.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.878 -0.601 . . . . 10.0 109.67 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 357' ' ' VAL . . . . . 0.413 ' O ' ' HG2' ' A' ' 360' ' ' LYS . 40.9 t -66.68 -43.89 89.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.458 -0.792 . . . . 10.0 109.479 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -64.38 -18.18 64.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.232 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 359' ' ' ALA . . . . . 0.413 ' HB1' ' HB3' ' A' ' 236' ' ' TYR . . . -91.87 -35.58 13.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.818 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 360' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 357' ' ' VAL . 12.5 ptmm? -74.89 -36.94 62.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.716 0.294 . . . . 10.0 110.537 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 361' ' ' GLU . . . . . 0.419 ' CD ' ' HH ' ' A' ' 326' ' ' TYR . 5.9 mm-40 -84.31 163.64 19.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.215 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -84.01 50.71 4.45 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.108 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 18.9 m -115.34 177.32 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.479 0.181 . . . . 10.0 110.567 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.56 109.07 21.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.814 0.34 . . . . 10.0 110.685 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 365' ' ' ILE . . . . . . . . . . . . . 12.4 mt -61.92 127.97 22.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.974 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 366' ' ' GLN . . . . . 0.404 ' HB2' ' NH2' ' A' ' 348' ' ' ARG . 36.6 mm-40 -70.44 166.93 19.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.497 -0.319 . . . . 10.0 110.787 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -72.5 -18.96 61.62 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.973 0.416 . . . . 10.0 110.619 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 70.13 -178.13 0.22 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.397 -0.819 . . . . 10.0 112.315 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -154.31 99.11 2.18 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.118 -0.946 . . . . 10.0 109.32 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -110.55 -101.97 0.39 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.842 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 89.2 m -163.46 137.36 5.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.535 0.207 . . . . 10.0 111.286 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 21.6 mt -96.65 -62.24 1.3 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -138.51 154.14 48.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.469 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 374' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 58.1 m -156.01 146.13 21.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.009 0.433 . . . . 10.0 111.478 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 16.5 tt -145.96 141.0 21.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.752 179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.63 145.43 25.68 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.318 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -56.8 -41.14 77.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.774 0.321 . . . . 10.0 110.314 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 378' ' ' GLN . . . . . 0.505 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.4 tm0? -55.96 -41.9 75.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.902 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -78.06 -30.66 49.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.054 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -68.1 -49.05 63.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.989 0.423 . . . . 10.0 110.304 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -72.78 -17.31 61.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.758 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.63 -25.27 63.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.348 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 73.9 mt -78.92 -12.87 60.05 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.806 -0.633 . . . . 10.0 111.753 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 384' ' ' TYR . . . . . 0.559 ' CD2' ' HB3' ' A' ' 206' ' ' ALA . 30.1 m-85 -80.81 138.75 36.25 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.799 0.333 . . . . 10.0 110.875 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -72.95 -73.48 0.2 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.186 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -91.41 90.55 7.73 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 66.2 tp -99.46 106.34 18.37 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.58 -0.737 . . . . 10.0 109.705 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -122.74 161.44 23.92 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.801 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -179.3 172.64 44.66 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.136 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 65.2 mtm -112.71 152.46 29.04 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.951 0.405 . . . . 10.0 110.576 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 9.6 t -122.04 -176.69 3.4 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.076 -0.713 . . . . 10.0 109.076 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -106.43 165.18 13.53 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.623 -0.799 . . . . 10.0 111.584 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 4.7 m -71.08 74.52 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.399 0.618 . . . . 10.0 109.99 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 394' ' ' ALA . . . . . 0.417 ' HA ' ' HB3' ' A' ' 569' ' ' ASN . . . -131.39 -48.72 0.99 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.992 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 395' ' ' ASP . . . . . 0.503 ' CG ' ' H ' ' A' ' 396' ' ' THR . 21.0 t70 66.38 -140.54 0.16 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 -178.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 396' ' ' THR . . . . . 0.503 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 4.8 m 70.0 -77.72 0.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 122.777 0.431 . . . . 10.0 111.652 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -81.72 15.15 2.28 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.2 0.524 . . . . 10.0 111.191 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 398' ' ' ALA . . . . . 0.435 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -66.99 -23.43 65.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.714 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -75.74 -10.92 59.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.906 0.384 . . . . 10.0 111.091 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 400' ' ' GLU . . . . . 0.443 ' HG2' ' CD1' ' A' ' 639' ' ' PHE . 43.0 mt-10 -89.27 -14.27 36.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.506 -0.316 . . . . 10.0 111.085 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 401' ' ' PHE . . . . . 0.435 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 18.7 m-85 -60.9 -51.7 68.17 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.961 0.41 . . . . 10.0 110.553 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 402' ' ' SER . . . . . 0.403 ' O ' ' HA ' ' A' ' 406' ' ' LYS . 0.7 OUTLIER -75.62 -21.0 58.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.418 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 29.1 m -81.84 -47.17 13.16 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.5 mt -88.68 -60.2 2.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 112.709 0.633 . . . . 10.0 112.709 -177.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 405' ' ' TYR . . . . . 0.505 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 68.8 m-85 -90.98 -4.78 56.18 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.635 0.606 . . . . 10.0 112.635 -177.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 406' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 402' ' ' SER . 67.4 mmtt 59.82 53.6 4.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.072 0.463 . . . . 10.0 110.205 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 407' ' ' LEU . . . . . . . . . . . . . 34.9 mt -111.47 144.17 41.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.257 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . 0.561 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . 36.8 t0 -78.87 167.95 20.42 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.884 -0.784 . . . . 10.0 108.884 178.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 19.6 m -138.72 121.82 16.84 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 121.963 -0.46 . . . . 10.0 112.123 -178.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 85.7 t -132.39 131.31 60.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.934 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.2 t -94.11 119.62 42.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.222 -0.288 . . . . 10.0 110.222 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 41.1 t -93.56 132.66 29.61 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 116.405 -0.362 . . . . 10.0 110.587 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -67.96 159.25 53.78 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.763 2.309 . . . . 10.0 112.548 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 15.2 p -82.84 166.5 18.92 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.914 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -63.11 -37.23 86.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.421 0.629 . . . . 10.0 109.685 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 -136.86 147.88 60.93 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.913 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.52 135.6 50.27 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 122.297 1.998 . . . . 10.0 111.942 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 56.8 mtm -71.86 138.65 48.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.869 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.3 mt -104.17 10.74 8.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.61 0.719 . . . . 10.0 109.431 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 15.7 ttp-105 -66.62 124.99 24.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.095 -0.957 . . . . 10.0 110.928 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . 0.529 ' O ' ' HA ' ' A' ' 583' ' ' SER . 89.4 mttt -105.89 136.25 45.87 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -104.82 148.98 26.05 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.864 0.364 . . . . 10.0 111.014 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 72.5 mt -125.25 148.04 59.44 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.941 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -61.47 164.31 15.75 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.914 2.409 . . . . 10.0 113.986 -178.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -84.24 116.96 23.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.018 -0.992 . . . . 10.0 109.608 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 59.0 mt -96.22 102.72 14.55 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.3 0.571 . . . . 10.0 110.256 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 42.9 t -93.19 129.44 43.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.199 -0.909 . . . . 10.0 110.772 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 428' ' ' TYR . . . . . 0.483 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 79.3 m-85 -112.39 -178.6 3.45 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.078 179.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 429' ' ' MET . . . . . 0.56 ' HB2' ' OE2' ' A' ' 433' ' ' GLU . 20.1 mmt -74.21 -76.7 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.879 0.371 . . . . 10.0 111.112 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 59.4 p -89.72 160.45 16.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.162 -0.472 . . . . 10.0 111.052 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 431' ' ' GLU . . . . . 0.433 ' OE1' ' HD3' ' A' ' 434' ' ' LYS . 9.5 tp10 -60.85 -27.26 67.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.717 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -59.47 -48.47 81.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.895 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 433' ' ' GLU . . . . . 0.56 ' OE2' ' HB2' ' A' ' 429' ' ' MET . 14.3 mt-10 -62.68 -39.17 93.12 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.079 0.466 . . . . 10.0 110.29 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 434' ' ' LYS . . . . . 0.433 ' HD3' ' OE1' ' A' ' 431' ' ' GLU . 63.9 tttt -60.67 -51.45 69.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.311 -0.859 . . . . 10.0 110.798 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 49.4 mm -66.4 -42.79 91.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.982 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -60.3 -37.39 80.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.78 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.99 -37.4 85.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.444 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 438' ' ' ILE . . . . . . . . . . . . . 76.8 mt -62.95 -42.95 98.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.922 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 41.6 mm -56.89 -42.36 78.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.674 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -64.54 -47.28 79.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.165 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -59.89 -39.09 84.16 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.079 0.466 . . . . 10.0 110.411 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 78.7 mt -71.38 -45.74 67.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.547 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -50.03 -49.68 50.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.836 -0.62 . . . . 10.0 111.468 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -58.93 -44.04 91.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.672 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.436 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 38.3 mtt-85 -75.17 -22.0 58.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.316 -178.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 29.7 m -68.34 -36.62 79.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.128 0.49 . . . . 10.0 110.163 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.9 -25.55 30.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.999 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 34.8 mttp -79.14 -31.36 44.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.209 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 101.57 35.64 4.03 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.429 -0.891 . . . . 10.0 112.698 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' GLN . . . . . 0.436 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 59.7 tt0 -112.8 125.6 29.63 Favored Pre-proline 0 C--N 1.323 -0.561 0 O-C-N 122.673 -0.31 . . . . 10.0 110.825 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -65.36 136.88 48.93 Favored 'Trans proline' 0 C--O 1.237 0.447 0 C-N-CA 122.497 2.131 . . . . 10.0 111.153 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 60.9 t -123.04 122.96 66.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.505 -178.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 45.7 tp -109.7 112.22 24.15 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 41.5 t -96.06 121.31 46.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.13 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -103.93 105.01 2.55 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.713 -0.756 . . . . 10.0 112.175 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 17.2 p -103.02 139.51 38.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.754 0.312 . . . . 10.0 110.529 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 7.5 pt -100.88 3.89 10.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.378 0.609 . . . . 10.0 110.051 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 3.5 p -133.82 128.8 35.48 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.978 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 28.8 mt -62.12 -36.7 75.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.025 0.44 . . . . 10.0 110.587 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -57.95 -41.59 83.17 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.582 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -36.74 77.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.844 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 3.8 m -58.98 -46.07 89.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.951 0.405 . . . . 10.0 110.402 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -71.86 -32.32 67.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.66 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 61.4 tp -68.43 -54.88 14.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.616 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.9 p -63.48 -30.16 49.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.904 0.383 . . . . 10.0 110.336 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 10.5 t -64.5 -43.91 92.6 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -65.45 -42.43 92.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.33 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -63.28 -43.51 97.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.619 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 47.0 mt -62.88 -42.03 99.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.246 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 35.3 m -64.41 -34.89 79.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.045 0.45 . . . . 10.0 110.017 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -63.29 -39.8 95.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.049 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.09 -4.88 56.75 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.295 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 75.88 26.78 63.92 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.025 -0.607 . . . . 10.0 112.378 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 71.3 mt -94.35 116.13 34.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.916 0.388 . . . . 10.0 110.803 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -64.2 131.67 48.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.202 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -155.93 157.89 37.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.992 -178.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -121.41 134.54 55.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.933 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 11.0 t -110.6 132.63 58.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.681 0.277 . . . . 10.0 110.809 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.09 164.66 22.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.529 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -157.1 117.9 3.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.144 -0.48 . . . . 10.0 109.834 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -59.57 -21.31 60.13 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.911 -0.586 . . . . 10.0 112.27 -179.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -76.38 -19.78 57.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.684 0.278 . . . . 10.0 111.113 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -127.18 64.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.473 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -59.59 -30.4 68.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.232 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.55 -28.89 69.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.583 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -84.56 -33.9 23.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.02 0.438 . . . . 10.0 109.898 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -58.37 -36.91 74.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.723 -0.672 . . . . 10.0 110.966 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -53.62 -35.6 61.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 10.0 111.974 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -83.01 -35.16 26.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.917 0.389 . . . . 10.0 110.675 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 75.8 mt -66.86 -54.0 29.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.297 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 49.4 t -61.54 -30.67 48.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.16 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -60.69 -29.96 69.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.607 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 71.4 mm-40 -114.27 21.38 14.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.773 0.321 . . . . 10.0 110.942 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.68 -17.63 62.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.028 0.442 . . . . 10.0 111.069 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -101.27 15.27 57.82 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.046 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -79.33 142.09 58.18 Favored Pre-proline 0 C--N 1.324 -0.542 0 N-CA-C 110.075 -0.342 . . . . 10.0 110.075 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.93 123.3 12.14 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.539 2.16 . . . . 10.0 112.789 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 71.5 16.68 5.88 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.615 -0.721 . . . . 10.0 112.751 178.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.74 110.23 21.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.984 0.421 . . . . 10.0 110.605 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 20.4 t -92.74 114.44 29.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.983 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 2.0 m -115.95 134.3 55.12 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.02 -179.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 62.7 mt -110.61 120.75 62.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 120.85 0.357 . . . . 10.0 110.069 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -111.29 124.25 51.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.605 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 14.5 m -103.56 119.65 39.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.54 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 14.1 m120 54.98 48.14 20.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.619 -0.718 . . . . 10.0 111.956 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 49.2 ttm -74.72 121.2 21.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.099 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -69.66 -174.16 0.69 Allowed 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.608 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -73.89 -178.13 37.2 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.065 -0.588 . . . . 10.0 112.587 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.413 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 52.6 mtt180 63.98 -95.52 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.83 0.452 . . . . 10.0 110.504 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 81.21 167.04 37.4 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.929 -0.653 . . . . 10.0 113.096 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.59 167.81 21.2 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.618 0.247 . . . . 10.0 111.087 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -85.53 106.76 17.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.747 0.308 . . . . 10.0 110.339 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 65.9 mt -80.62 108.95 14.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.257 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 19.6 t -88.12 127.78 40.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.638 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 50.3 mt -71.6 132.3 44.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.162 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 90.72 11.52 61.9 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.743 -0.741 . . . . 10.0 111.751 -179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 94.68 179.45 37.7 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.891 -0.671 . . . . 10.0 111.774 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 2.6 p -117.45 96.0 5.21 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.805 0.336 . . . . 10.0 110.976 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 18.0 p-90 -59.84 -25.81 65.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.795 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -66.72 -34.26 77.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.656 -0.702 . . . . 10.0 110.48 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.34 -31.15 38.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.262 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.14 -46.08 75.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.686 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.0 m -69.02 -27.2 34.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.846 0.355 . . . . 10.0 110.754 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -78.84 -9.11 59.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.982 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -93.56 -7.54 43.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.144 0.497 . . . . 10.0 110.483 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 60.3 mt -99.01 134.65 41.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.936 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -65.63 -49.7 67.74 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.191 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -126.63 88.55 54.14 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.703 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -83.29 112.99 2.01 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.972 2.448 . . . . 10.0 111.591 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 530' ' ' THR . . . . . 0.516 ' H ' ' NE2' ' A' ' 533' ' ' GLN . 16.7 p -87.82 176.52 7.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.581 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -58.96 -44.93 91.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.947 0.403 . . . . 10.0 111.054 -179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.482 ' OE1' ' HB ' ' A' ' 530' ' ' THR . 1.2 mp0 -63.61 -36.23 83.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.651 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . 0.516 ' NE2' ' H ' ' A' ' 530' ' ' THR . 31.9 mt-30 -65.97 -49.87 66.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.953 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 74.2 mt -60.33 -45.32 96.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.605 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . 0.424 ' CD ' ' HZ3' ' A' ' 538' ' ' LYS . 14.2 tp10 -64.54 -44.13 91.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.795 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -60.43 -50.02 75.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.691 -0.231 . . . . 10.0 110.811 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 85.0 mt -62.64 -45.07 99.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.607 -0.27 . . . . 10.0 110.67 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . 0.424 ' HZ3' ' CD ' ' A' ' 535' ' ' GLU . 5.5 ttmt -60.75 -45.16 95.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.887 0.375 . . . . 10.0 110.782 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.18 95.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.259 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' ASP . . . . . 0.583 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 0.1 OUTLIER -67.64 -40.43 84.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.389 -0.368 . . . . 10.0 110.057 179.617 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 44.3 t90 -59.8 -42.15 92.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.142 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -53.37 -44.0 68.23 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.79 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 59.6 t -65.47 -47.61 86.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.739 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 544' ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 13.4 mtm180 -63.72 -33.27 75.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.346 0.593 . . . . 10.0 110.272 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -65.52 -50.59 64.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.186 -0.915 . . . . 10.0 111.063 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.79 -26.81 64.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.298 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.2 -39.45 92.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.189 0.519 . . . . 10.0 109.88 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 86.2 t -65.85 -37.34 79.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.994 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 98.5 mt -66.09 -32.74 74.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.202 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -69.97 -38.98 76.22 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.275 179.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -69.0 -44.24 73.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.125 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 145.26 18.56 0.17 Allowed Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.075 -1.06 . . . . 10.0 113.684 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 77.54 -169.75 54.85 Favored Glycine 0 C--N 1.328 0.13 0 C-N-CA 120.668 -0.777 . . . . 10.0 112.352 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 63.8 tp -72.2 125.53 27.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.0 0.428 . . . . 10.0 110.409 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -94.31 123.62 37.83 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.786 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 40.8 mm -105.43 128.19 59.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.343 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 557' ' ' ILE . . . . . 0.405 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.2 mt -120.77 123.2 69.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 120.989 0.423 . . . . 10.0 110.49 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.53 122.08 7.05 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 111.321 -0.712 . . . . 10.0 111.321 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 18.3 p -82.51 -56.27 3.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.143 0.497 . . . . 10.0 111.113 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 14.4 mp0 -110.73 141.46 44.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.617 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 15.1 mmt180 -87.13 123.49 32.24 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.149 -0.685 . . . . 10.0 109.149 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -67.19 143.72 56.4 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.704 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -57.15 -66.12 0.51 Allowed 'General case' 0 N--CA 1.462 0.154 0 O-C-N 123.431 0.457 . . . . 10.0 109.99 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.58 121.62 20.01 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 565' ' ' ARG . . . . . 0.415 ' HB2' ' HB3' ' A' ' 631' ' ' GLN . 16.9 tpt180 -60.5 -21.2 62.16 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 123.457 0.473 . . . . 10.0 111.659 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -55.43 -61.4 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.962 0.41 . . . . 10.0 110.749 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 30.0 mt -71.31 -24.51 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.032 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -63.08 -49.34 74.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.485 0.659 . . . . 10.0 109.523 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 569' ' ' ASN . . . . . 0.417 ' HB3' ' HA ' ' A' ' 394' ' ' ALA . 50.2 t30 -67.58 -38.55 84.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.954 -1.021 . . . . 10.0 110.676 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -67.12 -30.95 71.1 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.799 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 44.4 tp -66.82 -32.78 74.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.988 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -85.64 -33.77 21.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.485 -0.78 . . . . 10.0 110.995 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.63 54.81 2.49 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 121.235 -0.507 . . . . 10.0 113.902 -179.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -92.15 -51.46 5.17 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.46 -167.87 2.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.173 179.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 73.92 39.11 47.58 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.475 -0.869 . . . . 10.0 112.238 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 577' ' ' ARG . . . . . 0.549 ' H ' ' HB3' ' A' ' 580' ' ' ASP . 51.3 mtt180 -97.58 122.45 40.65 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 58.73 41.17 22.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.015 0.436 . . . . 10.0 111.793 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 82.16 32.33 29.14 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 121.039 -0.601 . . . . 10.0 113.096 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 580' ' ' ASP . . . . . 0.549 ' HB3' ' H ' ' A' ' 577' ' ' ARG . 6.1 t70 -81.11 163.65 22.98 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -89.47 -139.49 0.13 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.905 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 120.65 167.41 13.36 Favored Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 120.666 -0.778 . . . . 10.0 112.326 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 583' ' ' SER . . . . . 0.529 ' HA ' ' O ' ' A' ' 421' ' ' LYS . 1.3 p -149.19 122.27 8.86 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.442 0.163 . . . . 10.0 110.619 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.49 125.81 39.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.721 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 585' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 4.3 tpm_? -132.99 124.83 28.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.539 -0.3 . . . . 10.0 110.192 179.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -116.43 140.01 49.82 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.9 0.381 . . . . 10.0 111.114 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -132.18 122.97 26.12 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.104 -0.702 . . . . 10.0 109.104 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 5.3 mt -130.39 179.25 6.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.829 0.347 . . . . 10.0 111.286 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 38.8 p -142.55 178.6 7.5 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.803 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 74.7 mmm -85.31 -4.32 59.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.09 0.471 . . . . 10.0 110.271 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -105.33 0.58 27.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.507 -0.769 . . . . 10.0 109.9 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.57 154.86 41.08 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.76 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -69.59 -24.71 63.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.256 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 10.1 tp -59.42 -34.23 72.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.295 -0.411 . . . . 10.0 111.342 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 14.8 mmt -64.38 -16.72 62.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.764 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -82.73 -10.66 58.79 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 17.2 pt -82.15 -8.85 11.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.225 -0.59 . . . . 10.0 110.201 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -84.39 -13.9 50.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.26 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.85 -68.36 0.16 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.419 -0.81 . . . . 10.0 111.954 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 28.1 m -71.52 115.78 11.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.35 -0.386 . . . . 10.0 111.233 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -68.45 -19.71 64.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.138 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -38.4 79.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.188 179.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.7 t -63.08 -51.84 66.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.011 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 604' ' ' SER . . . . . 0.426 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 1.2 m -63.08 -34.5 77.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.446 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -63.21 -39.14 97.56 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.138 -0.553 . . . . 10.0 111.756 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 14.1 tpt -70.02 -29.04 66.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.134 0.492 . . . . 10.0 110.267 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 607' ' ' MET . . . . . 0.426 ' O ' ' HE2' ' A' ' 612' ' ' MET . 63.0 mtt -70.66 -21.47 62.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.784 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 608' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 604' ' ' SER . 48.9 mtt180 -73.1 -6.46 45.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.101 0.477 . . . . 10.0 110.409 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -79.97 -4.07 50.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.501 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 31.3 tp -65.75 -39.31 90.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.109 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 109.73 -40.77 2.43 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.916 -0.659 . . . . 10.0 111.458 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 612' ' ' MET . . . . . 0.454 ' CG ' ' HA ' ' A' ' 428' ' ' TYR . 1.7 mpt? 60.63 -106.47 0.26 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.028 0.531 . . . . 10.0 111.677 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.94 109.88 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.326 0 O-C-N 123.666 0.603 . . . . 10.0 111.283 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 614' ' ' PRO . . . . . 0.483 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 37.8 Cg_endo -66.3 85.5 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.61 2.207 . . . . 10.0 112.491 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 162.44 -44.2 0.36 Allowed Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.902 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.43 54.71 3.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.118 0.485 . . . . 10.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -81.47 84.89 6.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.578 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 14.9 tt -86.56 1.87 5.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.936 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 71.75 141.47 0.05 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.435 0.694 . . . . 10.0 111.462 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -147.36 92.89 4.76 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.122 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -61.49 -28.33 83.34 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 123.407 2.738 . . . . 10.0 114.115 -178.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 37.8 p-90 -61.0 -25.3 66.79 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 111.852 0.316 . . . . 10.0 111.852 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.94 -50.12 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.725 0.298 . . . . 10.0 110.232 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 68.0 m -59.6 -38.5 81.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.859 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -63.84 -39.54 94.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.862 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -69.57 -43.61 72.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.175 179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.13 -44.02 99.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.585 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -61.28 -40.4 94.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.596 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -66.21 -45.04 82.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.199 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -61.67 -46.64 88.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.993 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 631' ' ' GLN . . . . . 0.415 ' HB3' ' HB2' ' A' ' 565' ' ' ARG . 56.5 mt-30 -58.83 -43.15 90.63 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.961 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 51.2 mtp85 -71.08 -33.85 70.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.279 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -63.29 -38.79 92.52 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.007 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 69.6 t -58.63 -47.67 88.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.241 178.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -73.21 -23.5 60.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.704 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.0 m -67.66 -29.65 69.0 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -78.12 -32.63 50.56 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.846 -1.07 . . . . 10.0 108.526 177.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -60.3 -49.92 75.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.128 -0.942 . . . . 10.0 109.802 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 639' ' ' PHE . . . . . 0.443 ' CD1' ' HG2' ' A' ' 400' ' ' GLU . 32.2 t80 -56.62 -38.22 71.79 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.56 179.087 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 640' ' ' ASP . . . . . 0.462 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 32.4 t70 -59.34 -35.49 73.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.602 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 24.9 mt -82.75 -38.97 15.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.119 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 642' ' ' ARG . . . . . 0.492 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 5.5 mtm180 -61.03 -39.16 88.72 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.666 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 643' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 18.8 pttm -66.31 -25.32 66.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.016 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 644' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 15.8 mm100 -66.95 -39.65 87.33 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.621 -0.511 . . . . 10.0 109.621 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 33.1 mt -66.94 -39.69 87.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.629 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 646' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 46.9 mt -63.42 -35.55 80.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.733 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 647' ' ' GLU . . . . . 0.408 ' CD ' ' HZ3' ' A' ' 804' ' ' LYS . 3.0 mm-40 -63.62 -24.11 67.66 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.115 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 648' ' ' TYR . . . . . 0.407 ' CZ ' ' HG3' ' A' ' 800' ' ' LYS . 48.1 m-85 -97.28 -39.95 8.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.132 0.491 . . . . 10.0 110.979 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -75.21 -27.02 59.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.713 0.634 . . . . 10.0 112.713 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 650' ' ' ASP . . . . . 0.462 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 5.4 t0 -68.16 -21.56 64.89 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.216 0.531 . . . . 10.0 110.368 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 17.8 t -68.23 -49.45 66.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -68.49 -25.51 65.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.054 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -61.5 -54.24 45.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 10.0 111.043 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -61.9 -42.98 99.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.912 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -64.89 -38.66 91.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.652 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 14.0 ttp-105 -65.25 -45.88 82.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.788 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -61.35 -40.28 93.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.487 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.4 -54.18 36.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.764 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.2 tp -67.09 -35.29 74.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 116.64 -0.255 . . . . 10.0 111.603 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -64.27 -41.71 96.78 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 110.356 -0.239 . . . . 10.0 110.356 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 15.0 t -61.9 -50.3 72.73 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -57.56 -45.95 84.53 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.779 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 19.3 ttt-85 -62.19 -36.98 83.56 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.931 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -74.36 -37.12 63.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.754 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.01 -41.44 96.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 10.0 110.65 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 77.2 mt -83.15 -5.03 58.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.393 0.616 . . . . 10.0 110.499 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 52.1 tp -91.26 -47.19 7.64 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.351 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -65.69 -41.26 92.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.502 -0.772 . . . . 10.0 112.046 -179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 34.0 m -73.35 145.59 11.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.9 0.381 . . . . 10.0 111.302 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.66 -27.17 29.28 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.974 0.416 . . . . 10.0 110.055 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -81.48 -178.04 6.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.486 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 7.4 p -179.82 -24.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.392 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -37.29 63.59 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.412 -0.813 . . . . 10.0 111.329 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.96 -53.98 52.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.641 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.55 -41.92 99.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.837 -0.619 . . . . 10.0 110.564 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 29.5 mm -57.91 -51.44 70.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.663 -0.698 . . . . 10.0 111.56 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 -68.68 -32.2 71.85 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 49.8 m -65.8 -49.63 67.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.741 0.305 . . . . 10.0 110.548 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 679' ' ' ILE . . . . . . . . . . . . . 42.8 pt -73.83 -21.49 18.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 120.826 -0.35 . . . . 10.0 111.084 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 49.2 ttm-85 -59.58 -38.67 81.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.795 0.331 . . . . 10.0 110.536 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.99 -34.85 79.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.82 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -80.39 -41.95 23.71 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.457 -178.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 64.7 t -59.63 -47.6 90.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-O 120.941 0.4 . . . . 10.0 110.76 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -64.71 -38.52 91.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.07 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.1 tttm -59.95 -51.48 69.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.504 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.85 -36.86 77.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.232 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 25.8 m -68.81 -43.73 75.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.702 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.4 mt -66.74 -47.24 83.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.412 . . . . 10.0 110.394 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -58.32 -24.46 59.72 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.915 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -74.06 -18.28 60.85 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 691' ' ' TYR . . . . . 0.429 ' OH ' ' HD3' ' A' ' 709' ' ' ARG . 97.5 m-85 -122.53 -25.82 4.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.937 0.399 . . . . 10.0 111.071 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 51.4 mt -126.06 102.46 27.74 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.866 -0.607 . . . . 10.0 109.701 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -60.99 132.49 42.3 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.499 2.132 . . . . 10.0 111.594 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -44.3 104.92 0.06 OUTLIER 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 123.654 2.903 . . . . 10.0 113.653 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 53.75 80.98 0.1 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.008 -0.996 . . . . 10.0 111.802 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 8.8 p -137.27 -163.1 1.37 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.98 -0.554 . . . . 10.0 110.604 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 5.1 mt -78.05 128.79 34.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.278 179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . 0.574 ' HA ' ' CD2' ' A' ' 701' ' ' TRP . 11.4 pm0 -55.57 -28.14 53.29 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.41 -22.52 61.85 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.074 0.464 . . . . 10.0 110.59 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 22.9 ttt -92.87 11.24 27.86 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.181 0.515 . . . . 10.0 110.797 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 701' ' ' TRP . . . . . 0.574 ' CD2' ' HA ' ' A' ' 698' ' ' GLU . 53.8 m0 -97.77 126.18 42.99 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.227 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -85.38 79.44 9.47 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 703' ' ' ILE . . . . . 0.507 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.3 mm -62.16 -50.39 80.34 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.318 -0.855 . . . . 10.0 111.461 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 704' ' ' PRO . . . . . 0.507 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 35.6 Cg_exo -58.24 -46.11 27.11 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.886 1.724 . . . . 10.0 112.189 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -61.03 -44.64 97.94 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.007 -0.616 . . . . 10.0 112.583 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 40.0 tp -66.73 -42.63 85.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.511 0.196 . . . . 10.0 111.053 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -60.6 -50.9 71.65 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.473 -0.33 . . . . 10.0 110.651 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -62.92 -37.22 86.14 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.573 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . 0.429 ' HD3' ' OH ' ' A' ' 691' ' ' TYR . 7.1 tpt180 -61.48 -48.64 80.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.502 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 89.4 mt -63.28 -35.59 80.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.292 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -70.49 -41.4 72.75 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.266 0.469 . . . . 10.0 112.266 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -85.31 -44.15 13.08 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 113.051 0.76 . . . . 10.0 113.051 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.36 -34.59 25.58 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.444 0.905 . . . . 10.0 113.444 -176.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -115.97 -1.26 12.56 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.735 1.013 . . . . 10.0 113.735 -177.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 33.0 t70 60.72 35.0 19.8 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.672 0.749 . . . . 10.0 109.952 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 13.8 tp -123.2 108.1 12.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.136 -179.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -90.92 103.69 16.37 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.109 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 80.6 mt -122.16 123.84 27.1 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.897 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 719' ' ' PRO . . . . . 0.437 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 87.8 Cg_endo -82.08 70.5 7.08 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.762 2.308 . . . . 10.0 111.233 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 91.7 mt -56.42 -39.6 62.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.295 -0.866 . . . . 10.0 111.649 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -58.49 -47.95 82.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.606 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 722' ' ' GLU . . . . . 0.437 ' HB2' ' HB2' ' A' ' 719' ' ' PRO . 27.0 mm-40 -64.92 -34.59 78.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.428 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -63.19 -49.95 72.22 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.972 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 35.6 tp -75.74 -24.79 56.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.063 0.459 . . . . 10.0 110.736 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -69.17 -50.92 43.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.846 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -81.25 -34.54 32.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.13 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -119.44 90.29 42.21 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.617 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -70.39 -15.68 34.77 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.116 1.877 . . . . 10.0 111.63 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -72.49 -7.88 52.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.303 -0.862 . . . . 10.0 110.918 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.92 -35.56 80.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.301 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 731' ' ' HIS . . . . . 0.414 ' HB3' ' H ' ' A' ' 732' ' ' GLU . 7.0 t-80 51.92 -102.18 0.12 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.426 -0.807 . . . . 10.0 111.066 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 732' ' ' GLU . . . . . 0.414 ' H ' ' HB3' ' A' ' 731' ' ' HIS . 0.0 OUTLIER -141.64 -53.07 0.44 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.017 0.437 . . . . 10.0 110.465 -179.733 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -56.26 -48.7 76.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.637 -0.71 . . . . 10.0 111.385 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 2.4 m -66.25 -28.4 68.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.239 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 48.1 tp -66.46 -41.95 88.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.462 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 55.9 mtt-85 -60.82 -39.65 89.78 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.815 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -60.75 -42.79 98.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.604 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 7.6 mmm-85 -64.45 -43.41 94.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.561 -0.745 . . . . 10.0 111.388 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 94.1 mt -62.7 -48.71 86.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.976 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 34.3 tp -64.42 -46.23 84.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.054 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.71 88.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 10.0 111.433 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -66.06 -36.06 82.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.554 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 54.1 p -63.79 -37.72 88.41 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.814 0.34 . . . . 10.0 110.2 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 744' ' ' ILE . . . . . 0.413 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 30.6 mt -72.58 -38.21 58.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.079 -0.51 . . . . 10.0 109.882 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -58.97 -49.66 77.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.131 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 60.3 t -66.57 -36.07 76.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.102 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -60.08 -48.2 82.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.414 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 748' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 27.2 mt-30 -60.61 -40.82 93.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.806 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 749' ' ' ARG . . . . . 0.457 ' HD3' ' OE2' ' A' ' 836' ' ' GLU . 19.8 ttp-105 -63.05 -43.39 98.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.349 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -70.09 -37.33 75.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.134 0.492 . . . . 10.0 109.988 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.9 -42.08 98.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.64 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -62.33 -19.95 63.85 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.235 0.458 . . . . 10.0 112.235 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.6 t -82.99 -43.58 18.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.131 0.491 . . . . 10.0 110.68 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 17.4 t -81.84 -37.49 15.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.244 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 119.81 134.25 4.75 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 110.706 -0.957 . . . . 10.0 110.706 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 756' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -54.03 -59.58 4.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.727 0.299 . . . . 10.0 111.789 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 26.3 mp0 -63.51 -36.13 82.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.085 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 16.1 tpt -65.15 -41.46 94.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.688 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 47.3 mmm -62.18 -40.22 95.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.727 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -59.58 -39.62 84.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.367 0.604 . . . . 10.0 110.027 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -70.59 -36.93 73.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.677 -0.692 . . . . 10.0 109.735 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -66.5 -47.56 72.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.294 -0.866 . . . . 10.0 110.245 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -58.15 -45.33 87.61 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.39 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -60.9 -45.54 94.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.385 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.34 -47.25 90.92 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 121.086 -0.578 . . . . 10.0 112.454 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.28 -44.41 95.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.703 0.287 . . . . 10.0 110.556 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -56.83 -50.4 72.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.119 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.28 -45.94 91.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.579 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.98 -44.25 96.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.591 -0.277 . . . . 10.0 110.979 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 11.1 m -62.64 -38.91 92.1 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.478 -0.328 . . . . 10.0 110.557 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 17.8 mt -59.87 -52.1 66.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.519 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -61.86 -42.02 98.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.718 -0.674 . . . . 10.0 111.303 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 44.1 m -58.95 -54.21 49.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.561 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 6.1 mp -67.7 -27.66 67.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.669 -0.242 . . . . 10.0 111.366 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 15.5 t-105 -62.53 -41.75 99.07 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.527 ' HZ1' ' HB3' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -61.12 -47.31 86.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.685 -0.688 . . . . 10.0 109.628 178.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 777' ' ' GLU . . . . . 0.403 ' CD ' ' HZ2' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -55.93 -42.62 76.4 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.205 179.537 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 778' ' ' HIS . . . . . 0.647 ' O ' ' HG2' ' A' ' 782' ' ' MET . 59.2 t60 -65.01 -46.46 81.27 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.445 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.6 mt -59.57 -46.42 88.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.873 0.368 . . . . 10.0 111.01 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.54 90.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.766 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.99 -34.38 76.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.623 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 782' ' ' MET . . . . . 0.647 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 97.3 mmm -58.0 -50.95 71.63 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.176 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 783' ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 8.1 t70 -73.24 -36.3 66.39 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-O 120.651 0.262 . . . . 10.0 110.417 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -56.98 -36.87 70.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.605 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 57.3 tp -88.62 -30.93 18.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.499 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -56.76 -45.96 81.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.683 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 787' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 10.0 pt20 -75.31 -3.18 31.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.158 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -98.02 -11.29 49.99 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.717 -0.553 . . . . 10.0 111.717 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 50.5 mm -73.64 86.14 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.818 0.818 . . . . 10.0 109.717 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -172.63 -30.88 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.662 -1.154 . . . . 10.0 108.666 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 32.5 mt -108.21 -41.58 4.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.056 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 22.1 ttm180 -73.77 128.01 34.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.345 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . 131.49 -175.59 19.55 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.965 -0.635 . . . . 10.0 112.022 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -152.18 -177.19 6.02 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.409 -0.219 . . . . 10.0 110.409 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -74.44 157.15 36.11 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.875 0.369 . . . . 10.0 111.749 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 65.3 35.26 7.72 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.535 -0.757 . . . . 10.0 111.121 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -148.94 131.47 15.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.328 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -77.65 128.46 79.6 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.192 -0.458 . . . . 10.0 109.877 179.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.91 -38.69 86.9 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.892 2.395 . . . . 10.0 113.321 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 800' ' ' LYS . . . . . 0.473 ' NZ ' ' HB2' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -67.97 -43.5 78.83 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 -179.755 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -64.21 -39.36 93.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.526 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.36 -46.53 79.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.929 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 803' ' ' TYR . . . . . 0.404 ' CD2' ' HD1' ' A' ' 648' ' ' TYR . 72.6 t80 -59.29 -38.92 81.42 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.125 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 804' ' ' LYS . . . . . 0.408 ' HZ3' ' CD ' ' A' ' 647' ' ' GLU . 85.2 mttt -59.24 -46.12 89.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.931 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 34.8 mtm105 -58.9 -46.93 86.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.236 0.541 . . . . 10.0 110.077 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -59.42 -43.86 92.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.563 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 14.3 m -67.36 -38.78 85.34 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.446 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -67.21 -41.04 86.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.732 0.301 . . . . 10.0 110.4 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 10.9 m -65.77 -39.35 90.92 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 22.9 ttm -63.73 -34.9 78.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.278 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -69.54 -45.72 68.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.543 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.8 -50.55 71.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.972 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -60.1 -32.38 70.93 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.074 0.464 . . . . 10.0 110.861 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 40.8 ttp -65.64 -49.22 69.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.029 179.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.26 -40.57 94.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 816' ' ' GLU . . . . . 0.419 ' HA ' ' HE2' ' A' ' 819' ' ' LYS . 34.6 mm-40 -61.11 -41.88 97.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.083 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 4.8 m -75.78 -28.34 58.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.569 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 31.0 tp -61.08 -60.38 3.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.857 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 819' ' ' LYS . . . . . 0.419 ' HE2' ' HA ' ' A' ' 816' ' ' GLU . 44.7 pttt -59.16 -32.97 70.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.692 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -62.82 -57.41 10.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.679 -0.692 . . . . 10.0 111.31 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -65.39 -34.11 77.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.911 -178.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 822' ' ' VAL . . . . . 0.404 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 39.6 t -58.62 -53.27 49.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.712 0.291 . . . . 10.0 110.511 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 33.9 mm -64.66 -39.76 86.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.535 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 36.2 m -62.37 -50.64 70.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.05 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 29.0 m -58.26 -41.77 85.0 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 111.961 0.356 . . . . 10.0 111.961 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 826' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 98.9 mt -65.55 -23.98 67.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.936 0.398 . . . . 10.0 111.343 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 4.5 m -95.34 -21.19 18.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.365 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -74.49 -9.92 59.05 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.565 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.4 p -56.97 125.79 13.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 121.198 0.523 . . . . 10.0 110.439 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -104.7 115.71 30.79 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.193 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 3.4 m -138.33 156.21 29.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.322 -0.854 . . . . 10.0 109.089 179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 8.9 ptt180 -62.78 140.08 58.73 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 123.224 0.327 . . . . 10.0 110.208 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 34.9 mmt -88.68 120.08 70.13 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.729 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.69 159.33 38.96 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.519 2.146 . . . . 10.0 111.858 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -82.9 113.69 20.68 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.179 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 836' ' ' GLU . . . . . 0.457 ' OE2' ' HD3' ' A' ' 749' ' ' ARG . 16.7 mt-10 . . . . . 0 C--O 1.247 0.933 0 CA-C-O 118.531 -0.747 . . . . 10.0 109.825 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 48.2 tpp -83.78 104.92 14.27 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.953 0.406 . . . . 10.0 109.983 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 mt -118.91 86.23 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.069 0.462 . . . . 10.0 110.172 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.86 93.71 4.69 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.59 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 70.0 mt -79.58 86.77 5.19 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.714 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -93.64 132.64 37.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.574 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 24.0 mtmt -124.48 151.37 44.68 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.907 -0.405 . . . . 10.0 109.907 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.44 ' HA ' ' HE ' ' B' ' 8' ' ' ARG . 4.3 mmp_? -133.09 -44.43 0.86 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.957 0.408 . . . . 10.0 110.262 179.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.32 104.25 12.49 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 178.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 17.7 pttm -103.15 160.22 14.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.126 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 80.8 mt -107.54 104.0 51.1 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.901 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.98 3.94 5.67 Favored 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.603 2.202 . . . . 10.0 112.219 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 57.2 mt -62.66 -29.5 70.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.307 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.67 -46.18 86.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.193 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 m -84.65 -18.12 9.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.92 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.77 -34.76 78.62 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.37 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 42.2 t -65.8 -45.63 91.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.012 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.19 -48.09 83.16 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.421 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.75 -32.33 73.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.713 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -65.62 -22.58 69.93 Favored Glycine 0 N--CA 1.452 -0.286 0 CA-C-N 115.676 -0.693 . . . . 10.0 112.549 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 99.1 t -57.07 -38.04 58.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.106 0.479 . . . . 10.0 110.962 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 9.6 tpt -86.69 -16.82 35.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.303 0.573 . . . . 10.0 110.728 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 71.1 m -87.5 77.89 8.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.676 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -76.68 68.56 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.075 -0.511 . . . . 10.0 111.054 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -83.83 72.15 10.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.459 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -95.77 -10.68 28.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.18 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -107.78 84.33 1.94 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.307 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.639 -0.696 . . . . 10.0 110.367 -179.869 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.5 t80 . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.848 0.356 . . . . 10.0 110.191 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 114.52 137.27 6.42 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 121.102 -0.57 . . . . 10.0 111.853 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.88 128.2 20.51 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.028 0.442 . . . . 10.0 111.223 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.494 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 1.2 mmp_? -63.19 142.76 58.26 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.668 -0.696 . . . . 10.0 111.492 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.438 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 0.9 OUTLIER 71.89 -81.99 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.302 -0.863 . . . . 10.0 112.232 179.129 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -49.65 -66.16 0.44 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.92 0.711 . . . . 10.0 112.92 -178.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 19' ' ' ARG . 7.8 ttm105 -71.02 -27.63 63.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.679 0.276 . . . . 10.0 111.454 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.9 m -61.88 -38.08 86.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.371 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 14' ' ' ASN . 90.1 mt -59.55 -49.83 76.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.678 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 16' ' ' ARG . 26.8 ptt-85 -75.62 -29.34 59.17 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.813 -0.355 . . . . 10.0 111.383 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -63.93 -40.68 97.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.094 0.473 . . . . 10.0 109.736 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.444 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -68.49 -35.46 77.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.124 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.7 tpp180 -61.26 -35.62 77.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.617 -0.72 . . . . 10.0 110.783 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.89 -40.82 85.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.654 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.0 t -74.78 -39.81 46.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.448 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.8 t -57.57 -37.92 61.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.658 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -62.64 -44.73 95.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.498 . . . . 10.0 110.206 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.1 mt -60.77 -45.11 98.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.345 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 61.9 mt -59.56 -43.16 90.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.513 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -66.68 -33.18 75.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.488 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.496 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -76.81 -34.11 57.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.155 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 16.4 ttt -83.18 -9.66 59.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.361 -0.382 . . . . 10.0 111.295 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.435 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 19.3 tt0 -58.72 -51.74 79.67 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-O 119.39 -0.338 . . . . 10.0 111.885 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.496 ' HD2' ' O ' ' A' ' 30' ' ' ALA . 60.3 Cg_exo -53.87 -33.37 71.3 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.082 1.854 . . . . 10.0 111.772 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -71.37 -39.54 71.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.275 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 20.0 mmt -65.73 -33.59 76.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.621 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -66.5 -14.02 61.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.057 0.456 . . . . 10.0 110.813 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -94.81 -8.09 38.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.362 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.9 mp -88.45 142.0 28.07 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.675 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 p -75.15 167.07 22.62 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.725 0.297 . . . . 10.0 110.529 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.83 -42.98 90.52 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.384 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -69.8 -19.7 63.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.507 -0.315 . . . . 10.0 111.423 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -75.43 -36.76 60.72 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 110.293 -0.262 . . . . 10.0 110.293 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.7 mt -61.79 -41.41 97.7 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -64.74 -35.11 80.01 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.58 -1.191 . . . . 10.0 109.416 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.63 -28.83 70.36 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.341 -0.845 . . . . 10.0 112.295 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -71.83 -37.19 70.36 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 33.1 m -60.87 -45.25 95.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 10.0 109.959 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.62 -33.09 73.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.011 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -63.34 -43.62 97.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.573 -0.74 . . . . 10.0 110.304 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.7 m-30 -61.38 -37.26 82.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.284 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 9.4 tpp180 -60.54 -45.4 93.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.729 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.57 -44.3 74.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.896 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 -61.09 -37.11 81.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.279 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.0 mt -59.93 -38.04 81.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.389 -0.368 . . . . 10.0 111.077 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -86.56 -14.34 43.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.066 0.46 . . . . 10.0 110.706 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -77.69 -52.57 8.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.71 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 157.45 45.93 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.398 -0.819 . . . . 10.0 111.594 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -117.63 139.01 51.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.706 0.289 . . . . 10.0 110.338 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 42.6 t -85.51 138.66 18.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.813 -0.439 . . . . 10.0 109.813 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.46 HD11 ' O ' ' A' ' 118' ' ' LEU . 22.6 tp -57.74 -45.0 86.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.985 0.421 . . . . 10.0 110.836 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 25.7 mp0 -64.7 -16.97 63.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.835 -0.62 . . . . 10.0 111.433 179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -91.95 -14.7 29.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.07 0.462 . . . . 10.0 110.298 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.2 mt -87.61 -8.91 55.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.144 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.481 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 69.8 mt -50.16 -50.92 66.97 Favored Pre-proline 0 CA--C 1.543 0.699 0 N-CA-C 113.387 0.884 . . . . 10.0 113.387 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.481 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.7 Cg_exo -52.05 -48.39 21.85 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 122.251 1.967 . . . . 10.0 113.199 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.5 ' O ' HG23 ' A' ' 70' ' ' VAL . 48.1 mt-10 -77.04 -43.99 32.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.621 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.502 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -59.15 -51.6 69.31 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.184 0.438 . . . . 10.0 112.184 -178.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -63.74 -32.38 73.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.661 0.267 . . . . 10.0 111.178 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.23 -43.37 91.64 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.855 -0.424 . . . . 10.0 109.855 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 66' ' ' GLU . 96.9 t -62.36 -43.05 97.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.127 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 67' ' ' ALA . 46.2 t -62.01 -44.32 98.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.565 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.427 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 9.8 ttm180 -62.02 -40.87 97.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.393 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -67.57 -52.9 33.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.267 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.72 -41.72 77.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.712 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.1 m -62.59 -31.38 72.19 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -179.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -72.46 -20.43 61.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.662 0.268 . . . . 10.0 111.195 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -100.55 -27.53 13.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.826 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 90.1 t -89.82 -51.45 12.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.688 0.28 . . . . 10.0 111.725 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -104.84 -26.88 12.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.041 0.448 . . . . 10.0 111.124 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 85.66 11.67 73.82 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.862 -0.685 . . . . 10.0 111.499 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 68.3 mtt -112.2 122.02 46.57 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.803 0.335 . . . . 10.0 110.603 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.411 ' HD2' ' OE2' ' A' ' 32' ' ' GLU . 12.7 ttp180 -84.03 134.32 34.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.111 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -70.38 115.66 9.82 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -60.97 156.21 18.19 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.369 0.418 . . . . 10.0 111.254 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -60.12 -37.14 79.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.144 -179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.3 m -65.13 -32.28 57.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.902 0.382 . . . . 10.0 110.57 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -73.77 -33.54 64.3 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.079 -0.509 . . . . 10.0 109.74 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.56 -39.03 92.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.57 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.447 ' O ' HG23 ' A' ' 93' ' ' VAL . 67.8 mt -62.2 -53.05 60.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.198 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.76 -45.95 95.18 Favored Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 115.745 -0.661 . . . . 10.0 112.444 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.22 -32.49 82.78 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.284 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.444 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 25.9 ttm -71.88 -38.95 69.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.826 0.346 . . . . 10.0 110.343 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 89' ' ' LEU . 90.7 t -67.6 -30.96 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.398 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.0 mt -69.2 -3.67 14.57 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.675 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -83.26 -20.85 33.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.527 0.68 . . . . 10.0 109.369 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -93.39 -162.92 0.98 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.538 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.7 ttt180 -107.38 58.64 0.62 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.56 -0.904 . . . . 10.0 108.56 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 3.1 m -130.58 164.52 24.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.295 -0.866 . . . . 10.0 111.224 -178.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.513 HD12 HG11 ' A' ' 211' ' ' VAL . 44.4 mm -109.88 127.36 66.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.692 -0.685 . . . . 10.0 109.24 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.83 127.94 53.84 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.995 0.369 . . . . 10.0 111.995 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -82.07 124.49 29.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.64 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 19.0 ttm -120.03 124.32 45.59 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.76 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.589 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 8.8 mmm180 -70.24 152.33 44.34 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.675 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.05 106.12 1.53 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.788 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 124.74 -18.96 7.08 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.618 -0.801 . . . . 10.0 113.884 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.649 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 10.2 mm-40 -58.82 -41.47 86.92 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 117.112 0.456 . . . . 10.0 112.095 -178.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.48 85.87 1.28 Allowed Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.523 -0.846 . . . . 10.0 112.324 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -65.43 -47.76 75.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.7 0.286 . . . . 10.0 111.551 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 55.7 m -63.55 -29.27 70.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.914 0.387 . . . . 10.0 111.559 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.2 tp -87.4 6.92 31.39 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.956 0.408 . . . . 10.0 111.154 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 40.8 m -120.83 -43.09 2.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.877 0.37 . . . . 10.0 110.597 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.67 -15.63 63.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.405 0.521 . . . . 10.0 112.405 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.6 -21.83 61.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.821 0.343 . . . . 10.0 111.921 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 11.6 mt -74.43 -57.57 2.09 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.58 -28.22 69.82 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 122.005 1.803 . . . . 10.0 112.156 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -64.96 -50.28 67.02 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.505 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.403 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 58.6 t80 -61.87 -44.37 96.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.952 0.405 . . . . 10.0 110.797 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.46 ' O ' HD11 ' A' ' 60' ' ' LEU . 49.6 tp -59.47 -54.31 48.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.83 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -71.0 -22.8 62.12 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.024 -0.27 . . . . 10.0 111.629 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.485 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -67.43 -27.71 67.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.817 0.342 . . . . 10.0 111.121 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 73.7 mt -60.17 -25.16 65.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.605 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.3 p -71.66 -20.46 61.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.018 0.437 . . . . 10.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.47 6.39 76.0 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.161 -0.542 . . . . 10.0 112.986 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 46.2 mmtt -79.2 -24.22 43.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.921 0.36 . . . . 10.0 110.778 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 106.05 117.01 4.24 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.629 -0.796 . . . . 10.0 113.559 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 74.1 t -87.82 115.05 27.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.1 m170 -94.03 101.39 13.43 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.084 0.468 . . . . 10.0 111.17 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 40.7 t -89.94 122.75 41.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.924 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.2 t -101.84 119.98 50.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.669 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.05 158.0 18.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.674 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.4 m -72.3 -31.12 37.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.977 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -145.79 172.04 13.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.584 0.231 . . . . 10.0 110.922 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -73.96 -26.81 60.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.198 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -58.67 -58.68 7.52 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.665 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.28 -35.6 80.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.912 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.58 -50.07 74.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.107 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.64 -25.3 49.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.879 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -66.22 -60.29 2.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.754 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.58 -29.63 69.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.057 -0.519 . . . . 10.0 111.475 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.52 -49.77 76.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.82 0.343 . . . . 10.0 111.237 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -79.36 -27.86 41.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.151 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ASN . . . . . 0.432 ' O ' ' HD2' ' A' ' 145' ' ' PRO . 8.2 t30 -71.55 -45.42 62.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.298 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -86.68 -3.26 59.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.209 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.515 ' HA ' HG21 ' A' ' 154' ' ' VAL . 59.6 ttm-85 -59.81 -50.08 88.42 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' PRO . . . . . 0.496 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 24.5 Cg_exo -64.56 -5.22 9.7 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 122.201 1.934 . . . . 10.0 112.701 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 23.9 tp -96.7 -54.65 3.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.955 0.407 . . . . 10.0 110.224 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -67.81 -44.34 77.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.265 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.462 ' HA ' ' O ' ' A' ' 152' ' ' LEU . 3.7 mt-10 -70.69 -16.7 62.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.918 0.389 . . . . 10.0 111.135 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.468 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 73.3 t80 -73.03 -27.43 61.76 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.422 0.629 . . . . 10.0 109.588 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 30.5 mt -95.55 -8.03 36.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.206 -0.907 . . . . 10.0 110.94 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 112.96 -14.85 23.8 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.559 -0.829 . . . . 10.0 113.454 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 148' ' ' GLU . 85.3 mt -71.41 156.27 39.67 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.951 0.405 . . . . 10.0 111.021 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 16.2 p -107.51 136.41 47.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.336 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.515 HG21 ' HA ' ' A' ' 144' ' ' ARG . 45.1 t -110.27 122.4 64.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.135 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -117.31 139.34 14.91 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 121.119 -0.562 . . . . 10.0 112.002 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 5.5 tp -112.89 130.45 66.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.05 0.452 . . . . 10.0 110.688 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -115.57 107.35 15.03 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.003 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 94.0 mt -102.36 145.44 30.52 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.495 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' PRO . . . . . 0.428 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 19.7 Cg_endo -59.02 113.94 1.79 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.612 2.208 . . . . 10.0 112.049 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 105.81 0.45 39.35 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.801 -0.714 . . . . 10.0 112.433 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' MET . . . . . 0.599 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 39.4 ttm -66.22 137.87 95.79 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 110.396 -0.224 . . . . 10.0 110.396 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.97 152.38 71.43 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.491 2.128 . . . . 10.0 112.371 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 163' ' ' ALA . . . . . 0.415 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.45 -47.39 96.45 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.862 0.69 . . . . 10.0 112.862 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.415 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 77.6 Cg_exo -52.26 -49.42 17.46 Favored 'Trans proline' 0 C--N 1.361 1.218 0 C-N-CA 121.831 1.687 . . . . 10.0 112.645 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.59 -38.06 86.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.088 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 161' ' ' MET . 59.1 mttm -59.92 -45.09 93.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.48 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -59.62 -35.32 74.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.845 -0.616 . . . . 10.0 111.124 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -70.15 -39.0 75.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.052 0.453 . . . . 10.0 110.422 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -73.6 -38.43 65.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.74 -0.663 . . . . 10.0 111.551 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -74.9 -25.2 58.76 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.524 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -84.34 -1.84 56.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.114 0.483 . . . . 10.0 110.712 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -79.9 168.35 19.35 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.45 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 173' ' ' ASP . . . . . 0.485 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 18.3 m-20 -71.04 -40.59 71.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.16 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.2 mp -127.01 127.23 69.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.168 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 5.2 m -117.33 125.37 50.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.884 0.373 . . . . 10.0 111.244 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -103.28 129.57 50.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -165.95 172.15 41.27 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.103 -1.046 . . . . 10.0 113.171 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.95 151.84 19.69 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.466 -0.198 . . . . 10.0 110.466 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -61.57 -36.42 80.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.755 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -58.26 -54.91 41.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.255 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.428 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 3.7 tp10 -67.72 -35.71 79.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.959 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -55.03 -40.99 70.8 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.385 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -74.68 -40.97 36.32 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.008 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -63.92 -39.28 93.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.75 0.31 . . . . 10.0 110.573 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 185' ' ' ASP . . . . . 0.411 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 19.6 m-20 -60.86 -41.98 96.97 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.98 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -62.73 -39.62 94.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.197 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 75.3 mt -66.86 -45.95 76.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.883 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 68.5 mtm-85 -63.82 -38.54 91.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.888 0.375 . . . . 10.0 110.969 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -64.45 -46.39 83.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.616 -0.72 . . . . 10.0 111.087 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -73.24 -20.98 60.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.622 -0.717 . . . . 10.0 112.064 -178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 22.9 ttp -99.87 26.57 6.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.112 0.482 . . . . 10.0 110.9 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -87.89 161.53 17.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.537 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -102.56 -29.06 11.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.083 0.468 . . . . 10.0 110.484 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.09 140.56 31.24 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.02 -26.28 81.98 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.693 2.262 . . . . 10.0 112.638 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -75.62 -11.09 59.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.542 -0.299 . . . . 10.0 111.305 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.78 -13.81 58.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.629 -0.26 . . . . 10.0 110.672 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -53.45 155.23 3.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.951 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 14.7 m -130.93 -20.81 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.374 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -89.31 -179.09 5.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.753 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -133.44 -79.87 0.48 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.534 -0.303 . . . . 10.0 110.974 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 19.5 ttmm -151.93 142.27 22.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.8 0.334 . . . . 10.0 110.562 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 9.9 mt -93.04 60.41 3.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.343 0.592 . . . . 10.0 109.752 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -81.01 -56.71 3.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.623 -0.717 . . . . 10.0 112.285 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -132.69 137.36 46.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.033 0.445 . . . . 10.0 111.623 -178.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.497 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -134.01 129.43 36.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.427 -0.806 . . . . 10.0 109.741 178.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 55.0 tp -124.07 108.49 12.4 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.176 -0.465 . . . . 10.0 109.808 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -96.82 132.1 42.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.184 0.516 . . . . 10.0 111.254 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -60.98 -53.84 52.29 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.368 -0.833 . . . . 10.0 112.352 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 210' ' ' GLU . . . . . 0.55 ' HB2' HH21 ' A' ' 509' ' ' ARG . 34.4 tt0 -123.97 108.3 12.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.005 0.431 . . . . 10.0 111.027 -179.147 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.513 HG11 HD12 ' A' ' 99' ' ' ILE . 32.9 m -84.47 -21.11 8.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.6 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 212' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.0 OUTLIER -53.77 -34.56 59.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.703 -0.68 . . . . 10.0 111.379 -179.703 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 8.9 p -107.2 -57.16 2.11 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.923 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.66 -37.91 68.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 113.485 0.92 . . . . 10.0 113.485 -177.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 215' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 219' ' ' ALA . 10.9 mt -94.19 -28.79 15.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.773 0.657 . . . . 10.0 112.773 -178.346 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 216' ' ' ILE . . . . . 0.404 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 40.3 mm -92.1 -63.05 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 112.406 0.521 . . . . 10.0 112.406 -178.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -69.65 -47.47 63.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.857 0.317 . . . . 10.0 111.857 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 218' ' ' GLU . . . . . 0.439 ' HA ' ' OG1' ' A' ' 221' ' ' THR . 6.1 mm-40 -80.3 12.31 3.02 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.682 0.623 . . . . 10.0 112.682 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 219' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 215' ' ' LEU . . . -63.92 -42.83 97.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.773 0.32 . . . . 10.0 111.515 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 7.1 mtp-105 -102.39 28.24 6.11 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 221' ' ' THR . . . . . 0.439 ' OG1' ' HA ' ' A' ' 218' ' ' GLU . 4.5 m -96.44 110.29 52.0 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 120.712 0.291 . . . . 10.0 110.232 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -90.54 125.53 1.15 Allowed 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.901 2.401 . . . . 10.0 112.795 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 223' ' ' LEU . . . . . 0.603 ' O ' ' HA ' ' A' ' 374' ' ' SER . 80.8 mt -78.79 90.65 4.67 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.343 -0.614 . . . . 10.0 109.343 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 90.1 mt -88.95 117.49 32.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.801 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 58.7 mt . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 177.9 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.342 0 N-CA-C 108.136 -1.061 . . . . 10.0 108.136 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 374' ' ' SER . . . . . 0.603 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 24.3 m -152.4 148.16 27.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.051 0.453 . . . . 10.0 111.769 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 16.7 tt -155.41 139.53 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.504 -0.771 . . . . 10.0 109.977 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.1 143.98 26.76 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -57.21 -41.37 79.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.672 0.272 . . . . 10.0 110.983 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 378' ' ' GLN . . . . . 0.429 ' HA ' ' CE1' ' A' ' 405' ' ' TYR . 1.5 tm0? -59.89 -39.92 86.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.174 0.511 . . . . 10.0 110.359 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -81.71 -0.85 44.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.311 -179.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -102.59 -48.04 4.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.173 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -71.04 -21.58 62.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.123 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -72.43 -12.17 60.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.882 0.372 . . . . 10.0 110.999 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 42.7 mt -84.91 -18.38 34.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.798 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 384' ' ' TYR . . . . . 0.497 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 39.0 m-85 -77.03 142.41 39.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.169 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -73.96 -64.31 1.04 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.95 0.405 . . . . 10.0 110.347 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -95.5 98.24 10.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.669 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 52.0 tp -107.41 110.03 21.9 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.072 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -130.21 163.99 25.49 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.206 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.35 168.89 41.97 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.422 -0.894 . . . . 10.0 112.398 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 35.9 mtm -105.75 140.01 39.44 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.211 -0.292 . . . . 10.0 110.211 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 3.4 t -124.27 156.5 36.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -91.22 174.76 38.93 Favored Glycine 0 N--CA 1.441 -0.988 0 C-N-CA 120.622 -0.799 . . . . 10.0 111.599 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 393' ' ' THR . . . . . 0.589 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 1.3 m -74.49 62.95 1.04 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.289 0.566 . . . . 10.0 110.499 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 394' ' ' ALA . . . . . 0.535 ' HB1' ' HG2' ' A' ' 566' ' ' ARG . . . -113.81 -43.18 3.31 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.474 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 395' ' ' ASP . . . . . 0.427 ' CG ' ' H ' ' A' ' 396' ' ' THR . 35.9 t70 59.66 -126.76 1.19 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 396' ' ' THR . . . . . 0.594 ' HB ' ' OE1' ' A' ' 397' ' ' GLU . 1.8 m 59.07 -93.78 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.77 0.428 . . . . 10.0 112.069 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 397' ' ' GLU . . . . . 0.594 ' OE1' ' HB ' ' A' ' 396' ' ' THR . 3.5 mp0 -75.77 2.28 12.59 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.943 0.401 . . . . 10.0 111.206 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -59.17 -26.09 64.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.65 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 399' ' ' PHE . . . . . 0.418 ' HD1' ' O ' ' A' ' 396' ' ' THR . 16.7 p90 -69.16 -23.06 63.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.969 0.414 . . . . 10.0 110.76 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.44 -13.38 60.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.5 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -59.37 -35.99 74.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.846 0.355 . . . . 10.0 110.558 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 402' ' ' SER . . . . . 0.481 ' O ' ' HA ' ' A' ' 406' ' ' LYS . 2.3 m -78.28 -18.23 55.58 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.656 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.2 m -100.36 -32.2 10.96 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.39 0.515 . . . . 10.0 112.39 -178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 55.4 mt -87.82 -49.58 14.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 111.736 0.273 . . . . 10.0 111.736 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 405' ' ' TYR . . . . . 0.429 ' CE1' ' HA ' ' A' ' 378' ' ' GLN . 96.6 m-85 -112.14 -5.73 14.21 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.994 -0.282 . . . . 10.0 111.654 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 406' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 402' ' ' SER . 3.9 mtpp 62.71 48.64 4.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.825 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 407' ' ' LEU . . . . . 0.418 HD13 HD11 ' A' ' 99' ' ' ILE . 16.6 mt -109.76 152.21 25.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.071 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 408' ' ' ASP . . . . . 0.494 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 22.3 t0 -93.52 135.22 34.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.506 -0.315 . . . . 10.0 110.318 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.83 118.65 27.5 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.31 -0.405 . . . . 10.0 111.373 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.26 137.43 57.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.294 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 5.1 m -102.32 140.18 21.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.592 0.235 . . . . 10.0 110.619 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 91.2 t -108.44 131.77 21.55 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.63 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.5 152.56 80.57 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.63 2.22 . . . . 10.0 112.278 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 1.5 p -78.71 157.03 28.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.491 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -64.92 -39.27 93.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.359 0.599 . . . . 10.0 109.835 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 -124.45 157.84 63.64 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.563 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.49 122.24 10.08 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.403 2.069 . . . . 10.0 111.793 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 27.6 mtm -72.47 112.02 8.16 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.851 0.358 . . . . 10.0 111.16 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 4.0 mt -103.84 54.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.562 0.696 . . . . 10.0 109.695 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 420' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 420' ' ' ARG . 33.5 ttp180 -98.38 104.2 16.21 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.358 -0.837 . . . . 10.0 109.905 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.86 98.89 2.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.933 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 422' ' ' ASP . . . . . 0.411 ' OD2' ' HD2' ' A' ' 572' ' ' ARG . 26.4 m-20 -84.02 114.66 21.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.765 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 39.5 mt -98.41 155.73 36.53 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.468 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -66.86 176.73 4.11 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.929 2.419 . . . . 10.0 112.878 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -93.03 130.02 38.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.559 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 64.2 mt -101.19 93.64 5.56 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.01 0.433 . . . . 10.0 109.956 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 427' ' ' VAL . . . . . 0.507 HG22 ' HB3' ' A' ' 588' ' ' LEU . 61.8 t -84.31 125.1 40.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.71 -0.677 . . . . 10.0 111.003 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 428' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 4.6 m-85 -114.45 176.73 4.92 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.85 -0.613 . . . . 10.0 109.942 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.2 mmm -78.55 -75.44 0.23 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.13 -0.228 . . . . 10.0 111.195 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 58.3 p -90.63 162.12 15.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.845 0.355 . . . . 10.0 111.353 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -61.95 -32.93 73.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.527 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 432' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 436' ' ' GLN . . . -57.32 -42.64 82.25 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.728 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -65.37 -46.94 78.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.277 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 434' ' ' LYS . . . . . 0.505 ' O ' HG13 ' A' ' 438' ' ' ILE . 4.7 ttpt -58.95 -54.14 50.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.314 -0.857 . . . . 10.0 111.129 -179.47 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 435' ' ' ILE . . . . . 0.558 ' O ' HG12 ' A' ' 439' ' ' ILE . 40.3 mm -60.09 -45.64 95.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.388 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 436' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 432' ' ' ALA . 0.2 OUTLIER -60.96 -37.22 81.65 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.218 -179.438 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.98 -36.66 83.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.087 0.47 . . . . 10.0 109.847 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 438' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 434' ' ' LYS . 79.9 mt -65.25 -46.48 90.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.753 178.711 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 439' ' ' ILE . . . . . 0.558 HG12 ' O ' ' A' ' 435' ' ' ILE . 42.1 mm -57.51 -41.16 78.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.497 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -66.24 -45.07 81.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.174 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.77 -39.14 87.68 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.13 0.491 . . . . 10.0 110.117 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.557 HG12 HG11 ' A' ' 452' ' ' VAL . 71.2 mt -70.83 -49.68 48.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.565 -0.743 . . . . 10.0 111.068 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -54.08 -42.6 69.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.791 -0.641 . . . . 10.0 112.081 -178.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.99 -34.6 78.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.303 0.573 . . . . 10.0 110.684 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.469 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 66.5 mtt-85 -82.19 -17.48 46.06 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.825 -179.086 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 1.8 m -69.25 -28.35 66.25 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -84.71 -23.66 29.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.656 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -87.36 -14.06 41.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.938 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 79.14 36.78 26.73 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.762 -0.733 . . . . 10.0 112.619 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 450' ' ' GLN . . . . . 0.469 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 63.7 tt0 -105.44 126.42 30.91 Favored Pre-proline 0 C--N 1.324 -0.531 0 O-C-N 122.712 -0.287 . . . . 10.0 110.542 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.87 136.17 44.12 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.535 2.157 . . . . 10.0 111.421 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 452' ' ' VAL . . . . . 0.557 HG11 HG12 ' A' ' 442' ' ' ILE . 91.8 t -119.16 124.76 73.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.356 -0.384 . . . . 10.0 111.392 -178.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 52.5 tp -112.21 108.25 17.42 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.965 -0.562 . . . . 10.0 109.544 178.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 12.2 t -90.92 115.27 29.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.169 -0.468 . . . . 10.0 110.418 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -96.46 79.59 0.74 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.867 -0.682 . . . . 10.0 112.294 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 6.4 p -82.43 120.43 25.45 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.386 -0.227 . . . . 10.0 110.386 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 41.9 pt -89.93 -10.28 10.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.086 0.47 . . . . 10.0 110.638 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 458' ' ' SER . . . . . 0.499 ' OG ' ' HB2' ' A' ' 461' ' ' LYS . 25.8 p -116.57 127.01 54.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.506 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 24.2 mt -62.68 -32.95 57.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-O 120.897 0.38 . . . . 10.0 111.02 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -62.88 -33.03 74.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.977 0.418 . . . . 10.0 110.568 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.499 ' HB2' ' OG ' ' A' ' 458' ' ' SER . 0.0 OUTLIER -83.37 -30.66 27.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.769 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 17.5 m -59.32 -46.94 87.22 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.875 0.369 . . . . 10.0 110.697 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.74 -33.61 66.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.858 0.361 . . . . 10.0 110.376 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 46.7 tp -63.39 -53.05 58.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.69 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 8.1 p -63.56 -33.69 63.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.695 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 75.6 m -64.43 -42.22 96.15 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 120.744 0.307 . . . . 10.0 110.442 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -67.54 -40.3 85.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.13 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 468' ' ' GLU . . . . . 0.499 ' HG3' HG21 ' A' ' 435' ' ' ILE . 8.4 mm-40 -65.57 -41.66 92.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.851 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 51.8 mt -61.75 -36.69 81.75 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.9 0.381 . . . . 10.0 110.477 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.4 m -71.01 -33.45 70.38 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.294 0.569 . . . . 10.0 109.873 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -66.28 -40.36 90.03 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.483 -0.781 . . . . 10.0 110.576 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.94 -21.27 37.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.584 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 89.79 52.82 2.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.709 -0.758 . . . . 10.0 112.489 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 50.0 mt -124.82 127.28 72.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.722 0.296 . . . . 10.0 110.566 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' A' ' 500' ' ' VAL . 50.6 mttm -62.16 138.76 58.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.136 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 45.4 p-80 -156.88 147.54 21.56 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.882 0.372 . . . . 10.0 111.231 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -130.54 119.59 22.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.304 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.7 t -89.59 133.87 30.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.006 0.431 . . . . 10.0 111.408 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 86.4 mt -84.81 83.83 7.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.263 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -78.28 113.45 16.27 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.812 -0.44 . . . . 10.0 109.812 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -62.68 -10.11 11.42 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.897 0.703 . . . . 10.0 112.897 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -81.36 -10.17 59.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.985 0.422 . . . . 10.0 109.992 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -135.47 85.23 2.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.537 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' HIS . . . . . 0.406 ' HA ' ' OE1' ' A' ' 487' ' ' GLU . 45.3 m-70 -61.57 -32.96 73.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.259 -178.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.51 -36.03 82.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.025 0.441 . . . . 10.0 110.086 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.93 -44.06 73.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.462 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 487' ' ' GLU . . . . . 0.406 ' OE1' ' HA ' ' A' ' 484' ' ' HIS . 37.5 mt-10 -59.73 -47.83 84.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.433 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -60.26 -33.96 73.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.63 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -70.52 -38.56 74.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.808 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 50.8 mt -74.84 -45.68 43.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.799 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.0 t -55.36 -34.62 34.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.138 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -57.4 -31.49 65.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.542 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -124.62 26.59 7.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.734 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -69.02 -21.25 64.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.132 0.492 . . . . 10.0 110.902 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -100.08 14.12 60.04 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.771 -0.728 . . . . 10.0 111.671 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -75.52 140.44 71.94 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.208 -0.293 . . . . 10.0 110.208 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -52.59 125.98 19.54 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.689 2.26 . . . . 10.0 113.356 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 70.78 16.52 6.69 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.449 -0.796 . . . . 10.0 112.8 178.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.23 115.29 26.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.897 0.379 . . . . 10.0 110.105 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 500' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' A' ' 475' ' ' LYS . 53.8 t -96.1 108.03 20.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.247 0.546 . . . . 10.0 110.205 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 7.4 m -106.11 130.18 54.05 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.601 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 49.0 mt -109.41 119.28 58.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.2 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -109.19 130.29 55.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.87 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 7.0 m -100.72 93.58 5.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.816 0.341 . . . . 10.0 110.75 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 55.51 78.41 0.19 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.456 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 8.6 ttt -83.87 142.88 30.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.421 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -70.8 173.01 7.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.007 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -61.69 156.82 35.18 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 116.144 -0.48 . . . . 10.0 113.172 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.55 HH21 ' HB2' ' A' ' 210' ' ' GLU . 75.5 mtt180 70.77 -82.05 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.463 0.705 . . . . 10.0 111.302 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 79.73 170.65 40.72 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.53 -0.628 . . . . 10.0 111.53 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.28 148.47 49.72 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.585 0.231 . . . . 10.0 110.584 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.53 90.68 4.51 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.822 -0.436 . . . . 10.0 109.822 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 70.8 mt -70.7 114.74 9.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.692 -0.685 . . . . 10.0 111.235 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 3.9 t -89.71 133.84 30.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.663 -0.698 . . . . 10.0 110.182 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 53.7 mt -64.9 131.57 47.05 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.515 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 98.13 -17.17 59.06 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 121.079 -0.582 . . . . 10.0 111.743 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 115.66 -164.38 12.2 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.0 p -135.05 101.79 4.99 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 117.061 0.431 . . . . 10.0 110.624 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 53.3 p-90 -56.28 -28.15 57.75 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.315 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -61.0 -43.32 99.05 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.055 0.455 . . . . 10.0 110.662 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -73.09 -23.03 60.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.873 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -79.49 -47.06 16.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.042 -0.527 . . . . 10.0 110.574 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 523' ' ' VAL . . . . . 0.449 HG12 HD12 ' A' ' 537' ' ' ILE . 34.0 m -69.4 -23.45 26.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.927 0.394 . . . . 10.0 110.848 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -78.89 -10.85 59.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.009 0.433 . . . . 10.0 110.916 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -94.25 -3.1 51.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.665 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 58.5 mt -97.19 152.28 18.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.317 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -64.64 -61.22 2.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.554 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -131.1 97.28 20.34 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 529' ' ' PRO . . . . . 0.446 ' HA ' ' OE1' ' A' ' 533' ' ' GLN . 60.7 Cg_endo -81.17 93.18 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.613 2.209 . . . . 10.0 112.057 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 17.5 p -71.04 168.84 16.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.448 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.92 -41.42 70.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.936 0.398 . . . . 10.0 111.025 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -61.01 -43.58 98.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.053 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 533' ' ' GLN . . . . . 0.446 ' OE1' ' HA ' ' A' ' 529' ' ' PRO . 75.0 mt-30 -65.3 -46.64 79.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.731 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.421 HG22 ' HE2' ' A' ' 538' ' ' LYS . 75.1 mt -58.85 -49.24 83.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.314 -179.46 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -61.98 -41.88 98.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.036 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 20.1 tptp -61.08 -49.05 78.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.801 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 537' ' ' ILE . . . . . 0.449 HD12 HG12 ' A' ' 523' ' ' VAL . 74.6 mt -63.79 -39.29 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.706 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 538' ' ' LYS . . . . . 0.421 ' HE2' HG22 ' A' ' 534' ' ' ILE . 25.1 mtmt -62.11 -39.62 93.12 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.865 0.364 . . . . 10.0 110.277 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -62.92 -44.41 96.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.225 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -67.26 -41.95 84.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.115 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 70.9 t90 -60.46 -39.63 88.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.568 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -57.5 -46.03 84.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.469 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.61 -42.06 94.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.883 179.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 544' ' ' ARG . . . . . 0.465 ' O ' HG23 ' A' ' 548' ' ' VAL . 31.6 mtp180 -62.41 -38.54 90.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.824 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -66.77 -47.39 72.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.469 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -33.4 75.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.859 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.7 99.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.926 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 548' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 544' ' ' ARG . 67.7 t -65.82 -35.14 74.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.386 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 84.0 mt -62.26 -43.64 98.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.315 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.18 -18.15 61.29 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.913 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 551' ' ' ALA . . . . . 0.458 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -80.19 -30.49 38.76 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.398 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 125.82 19.14 2.29 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.571 -0.823 . . . . 10.0 112.973 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 72.21 -163.76 54.52 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.938 -0.649 . . . . 10.0 112.505 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 51.8 tp -77.91 119.68 21.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.918 0.389 . . . . 10.0 110.336 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.4 t60 -92.51 115.54 28.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.163 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 14.8 mm -98.83 132.8 43.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.929 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 557' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.8 mt -124.21 122.72 64.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.918 0.39 . . . . 10.0 110.517 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.89 116.71 5.24 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.897 -0.668 . . . . 10.0 111.437 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 19.0 p -74.37 -43.19 57.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.125 0.488 . . . . 10.0 110.656 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 560' ' ' GLU . . . . . 0.43 ' OE2' ' HG2' ' A' ' 461' ' ' LYS . 19.8 mp0 -136.72 145.21 44.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.631 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 561' ' ' ARG . . . . . 0.475 ' HB2' HD22 ' A' ' 594' ' ' LEU . 88.1 mtt-85 -95.36 166.85 11.68 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.854 -0.424 . . . . 10.0 109.854 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 562' ' ' HIS . . . . . 0.42 ' CE1' HD12 ' A' ' 567' ' ' ILE . 46.2 t-80 -107.39 149.85 27.41 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -57.02 -64.98 0.7 Allowed 'General case' 0 N--CA 1.462 0.148 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.75 117.45 10.48 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 108.937 -0.764 . . . . 10.0 108.937 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 565' ' ' ARG . . . . . 0.409 ' HB3' ' OG1' ' A' ' 396' ' ' THR . 14.2 tpt180 -61.66 -14.36 30.53 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.891 -178.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 566' ' ' ARG . . . . . 0.535 ' HG2' ' HB1' ' A' ' 394' ' ' ALA . 5.4 ttm180 -55.06 -45.41 75.32 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 121.002 0.43 . . . . 10.0 110.939 179.505 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 567' ' ' ILE . . . . . 0.42 HD12 ' CE1' ' A' ' 562' ' ' HIS . 61.3 mt -81.1 -31.75 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.458 . . . . 10.0 110.401 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -61.41 -51.48 68.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.135 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 569' ' ' ASN . . . . . 0.533 ' HB3' ' O ' ' A' ' 393' ' ' THR . 31.3 m-20 -65.27 -28.95 69.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.634 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -62.13 -36.75 82.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.214 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 40.3 tp -76.65 -35.72 57.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.377 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 572' ' ' ARG . . . . . 0.411 ' HD2' ' OD2' ' A' ' 422' ' ' ASP . 14.4 ttp180 -69.32 -30.8 68.94 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.16 0.505 . . . . 10.0 110.497 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -85.37 13.82 53.4 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 121.035 -0.602 . . . . 10.0 113.76 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 574' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 574' ' ' ARG . 3.9 mmt180 -75.46 -32.38 60.6 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 117.231 0.515 . . . . 10.0 110.279 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 4.7 t -91.03 166.63 12.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.471 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 67.16 54.02 23.01 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.724 -0.75 . . . . 10.0 112.571 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 15.2 mmt180 -69.02 117.23 10.41 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 578' ' ' GLN . . . . . 0.649 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 3.5 tt0 61.45 26.79 16.49 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.968 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 86.4 55.97 2.36 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.867 -0.683 . . . . 10.0 112.679 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -108.36 -169.3 1.48 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.94 -0.393 . . . . 10.0 109.94 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -95.25 150.3 20.39 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.962 0.41 . . . . 10.0 111.596 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.59 -179.18 48.37 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.135 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.6 p -155.31 128.57 8.3 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.144 -0.317 . . . . 10.0 110.144 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.11 125.45 52.16 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.785 0.326 . . . . 10.0 111.147 -179.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 585' ' ' ARG . . . . . 0.43 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 2.0 tpm_? -129.69 122.51 29.11 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -113.48 149.8 33.76 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.046 0.451 . . . . 10.0 110.777 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 587' ' ' TYR . . . . . 0.494 ' CD1' HG12 ' A' ' 438' ' ' ILE . 59.9 m-85 -129.0 162.06 28.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.988 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 588' ' ' LEU . . . . . 0.507 ' HB3' HG22 ' A' ' 427' ' ' VAL . 44.6 tp -162.51 149.41 13.32 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.104 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 92.5 p -123.3 169.94 10.8 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.808 -0.442 . . . . 10.0 109.808 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 71.4 mmm -83.61 0.22 47.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.144 0.497 . . . . 10.0 110.075 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -100.91 -17.37 16.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.005 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -70.71 147.48 49.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.13 0.49 . . . . 10.0 111.451 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -65.12 -15.88 62.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.558 -0.746 . . . . 10.0 112.735 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 594' ' ' LEU . . . . . 0.546 ' O ' HG12 ' A' ' 597' ' ' ILE . 14.5 tp -64.81 -23.15 67.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.703 0.287 . . . . 10.0 111.406 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 7.0 mmt -75.49 -2.42 28.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.725 0.298 . . . . 10.0 111.442 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -95.17 -7.66 38.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.514 -0.312 . . . . 10.0 111.37 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 597' ' ' ILE . . . . . 0.546 HG12 ' O ' ' A' ' 594' ' ' LEU . 20.2 pt -79.51 -13.09 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-O 120.945 0.402 . . . . 10.0 111.298 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -84.75 50.48 1.92 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.409 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 70.6 -55.83 0.62 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.812 0.845 . . . . 10.0 111.167 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 59.4 m -155.0 137.74 15.27 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -62.88 -17.2 61.28 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 602' ' ' ARG . . . . . 0.416 ' HD2' ' O ' ' A' ' 602' ' ' ARG . 1.8 tmm_? -64.32 -35.46 80.93 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.116 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 48.5 t -71.2 -46.37 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.91 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -20.03 63.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.522 -0.763 . . . . 10.0 111.213 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -62.93 -15.08 55.15 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 116.018 -0.537 . . . . 10.0 113.088 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 46.2 tpp -67.37 -21.56 65.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.095 0.474 . . . . 10.0 110.431 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 66.6 mtt -78.32 -11.24 59.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.569 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 608' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 608' ' ' ARG . 59.8 mtt-85 -69.17 -17.64 63.83 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.089 0.471 . . . . 10.0 110.298 179.494 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -102.74 28.37 6.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.766 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 22.6 tp -88.17 -14.59 38.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.23 0.538 . . . . 10.0 110.099 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 111.26 -48.07 0.98 Allowed Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.803 -0.635 . . . . 10.0 112.193 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 66.98 -77.54 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.368 0.667 . . . . 10.0 111.836 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 59.86 83.98 0.2 Allowed Pre-proline 0 N--CA 1.464 0.229 0 O-C-N 123.613 0.571 . . . . 10.0 110.992 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 614' ' ' PRO . . . . . 0.453 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 31.8 Cg_exo -58.13 105.03 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.833 2.355 . . . . 10.0 112.278 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 125.0 -14.68 7.46 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 121.023 -0.608 . . . . 10.0 111.71 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -110.57 129.56 55.77 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.061 -0.348 . . . . 10.0 110.061 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -83.3 100.65 10.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.542 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 4.7 tp -66.93 -28.53 43.3 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.758 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 40.01 82.64 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.611 0.967 . . . . 10.0 113.611 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 40.8 m170 -119.71 100.57 48.94 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -57.48 -30.17 87.3 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 123.368 2.712 . . . . 10.0 113.752 -178.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 65.9 p-90 -63.59 -22.08 66.7 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 121.12 -0.232 . . . . 10.0 111.583 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 70.1 t -66.84 -48.7 79.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 109.704 -0.48 . . . . 10.0 109.704 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 43.8 m -60.56 -40.39 91.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.38 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -67.13 -32.34 73.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.661 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -70.8 -43.81 67.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.959 0.409 . . . . 10.0 110.126 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.67 -45.25 92.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.289 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.36 -34.9 74.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.808 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -65.21 -48.8 72.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.817 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 630' ' ' ALA . . . . . 0.47 ' O ' HG23 ' A' ' 634' ' ' VAL . . . -65.99 -36.87 84.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.832 179.57 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -58.11 -44.93 87.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.066 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 632' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 632' ' ' ARG . 9.5 mtp180 -74.05 -25.46 59.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.294 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -68.62 -37.13 79.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.32 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 634' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 630' ' ' ALA . 88.5 t -57.46 -48.06 83.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 109.786 -0.45 . . . . 10.0 109.786 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -70.18 -28.18 65.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.818 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.8 m -63.48 -35.25 79.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.181 -0.674 . . . . 10.0 109.181 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -70.25 -40.96 74.11 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.359 -0.837 . . . . 10.0 109.084 178.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -66.77 -35.6 80.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.257 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -58.13 -43.88 87.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.093 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.22 -40.63 90.84 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 641' ' ' ILE . . . . . 0.444 ' O ' ' HG ' ' A' ' 645' ' ' LEU . 61.3 mt -67.77 -46.22 82.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.3 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 64.8 mtm-85 -58.16 -42.79 86.73 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.038 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -61.65 -45.52 93.68 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.73 179.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -60.9 -39.74 90.43 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.862 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 641' ' ' ILE . 85.0 mt -71.03 -40.45 71.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.675 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 646' ' ' LEU . . . . . 0.433 ' HA ' ' HB2' ' A' ' 649' ' ' ASP . 82.4 mt -67.46 -24.43 65.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.578 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 647' ' ' GLU . . . . . 0.519 ' O ' HG23 ' A' ' 651' ' ' VAL . 2.6 mm-40 -58.33 -44.68 88.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.043 178.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -77.63 -31.17 52.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.333 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 649' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 646' ' ' LEU . 88.1 m-20 -65.9 -45.43 82.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.428 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 650' ' ' ASP . . . . . 0.459 ' HA ' ' HB3' ' A' ' 653' ' ' ASN . 15.9 t70 -63.46 -28.75 70.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.51 -0.313 . . . . 10.0 111.469 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 651' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 647' ' ' GLU . 53.7 t -61.25 -50.46 80.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.444 -0.576 . . . . 10.0 109.444 178.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -70.48 -27.61 64.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.991 179.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 653' ' ' ASN . . . . . 0.459 ' HB3' ' HA ' ' A' ' 650' ' ' ASP . 20.5 t30 -63.13 -52.14 63.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.395 -0.821 . . . . 10.0 111.11 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -62.03 -44.56 96.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.808 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -60.73 -42.1 96.63 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.871 0.367 . . . . 10.0 110.083 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 6.6 ttp-105 -63.75 -45.99 87.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.02 178.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 657' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 657' ' ' ARG . 13.2 ttp180 -60.09 -43.16 95.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.694 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.71 -53.84 44.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.719 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.8 tp -65.31 -32.17 57.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-O 120.655 0.264 . . . . 10.0 111.419 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -69.78 -32.41 70.89 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 110.39 -0.226 . . . . 10.0 110.39 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 49.1 m -65.62 -46.29 79.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -63.77 -43.78 95.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.371 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 28.3 ttt-85 -63.26 -36.73 84.63 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.521 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -66.1 -40.71 90.98 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.776 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 665' ' ' GLU . . . . . 0.405 ' O ' HG22 ' A' ' 669' ' ' VAL . 1.6 tp10 -60.67 -49.74 76.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.054 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 61.7 mt -67.32 -17.19 64.66 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.066 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 44.2 tp -83.18 -44.13 15.38 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.385 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -71.63 -47.96 51.09 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 665' ' ' GLU . 20.0 m -68.59 149.36 11.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.073 0.463 . . . . 10.0 111.566 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -42.54 9.92 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.917 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -94.99 140.86 29.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.386 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 8.6 p -135.2 11.8 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.918 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 8.1 m -55.18 -38.61 68.57 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.587 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -59.17 -51.74 68.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 10.0 111.219 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 675' ' ' THR . . . . . 0.504 ' O ' HG12 ' A' ' 679' ' ' ILE . 0.2 OUTLIER -63.99 -46.12 86.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.051 -179.76 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 676' ' ' ILE . . . . . 0.408 ' O ' ' HB2' ' A' ' 680' ' ' ARG . 34.0 mm -58.47 -44.2 88.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.874 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -72.52 -40.5 66.76 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.949 -0.3 . . . . 10.0 111.613 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 60.6 m -61.92 -39.43 92.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.659 -0.246 . . . . 10.0 111.464 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 679' ' ' ILE . . . . . 0.504 HG12 ' O ' ' A' ' 675' ' ' THR . 45.9 pt -83.49 -21.07 8.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 120.835 -0.346 . . . . 10.0 111.011 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 680' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 676' ' ' ILE . 30.3 ttm-85 -59.66 -51.13 71.11 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.917 0.389 . . . . 10.0 110.702 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 681' ' ' GLU . . . . . 0.425 ' HG2' ' H ' ' A' ' 681' ' ' GLU . 2.8 pt-20 -63.76 -36.38 83.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.057 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -66.95 -46.5 74.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.836 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 683' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 679' ' ' ILE . 72.1 t -60.09 -45.1 96.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.361 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -62.98 -45.55 91.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.308 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 34.3 tttm -58.81 -49.2 78.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.694 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -60.4 -41.04 93.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.402 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 25.6 m -67.87 -40.08 83.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.39 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 92.1 mt -68.61 -43.4 83.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.213 -0.448 . . . . 10.0 110.377 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -60.92 -19.09 60.1 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.866 0.365 . . . . 10.0 111.721 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -79.59 -21.06 45.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.736 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -117.4 -29.28 5.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.995 0.426 . . . . 10.0 110.995 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 692' ' ' ILE . . . . . 0.56 HG23 ' CD1' ' A' ' 701' ' ' TRP . 55.6 mt -124.79 106.16 29.4 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.386 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -72.72 138.74 29.61 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.701 2.267 . . . . 10.0 111.389 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 694' ' ' PRO . . . . . 0.444 ' HA ' ' OE1' ' A' ' 732' ' ' GLU . 37.4 Cg_endo -67.21 131.37 24.9 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.344 2.029 . . . . 10.0 112.891 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 64.11 41.33 6.37 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.708 -0.678 . . . . 10.0 112.03 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 40.4 p -107.86 -150.98 0.46 Allowed 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 96.8 mt -113.55 158.71 20.42 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.174 -0.306 . . . . 10.0 110.174 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -58.99 -36.73 75.39 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.237 0.458 . . . . 10.0 112.237 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -78.29 1.39 21.89 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.032 0.444 . . . . 10.0 111.294 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 60.9 mtt -104.38 7.05 35.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.145 0.498 . . . . 10.0 110.071 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 701' ' ' TRP . . . . . 0.56 ' CD1' HG23 ' A' ' 692' ' ' ILE . 48.7 m0 -104.5 121.49 43.58 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.437 -178.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -86.05 82.74 7.98 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 703' ' ' ILE . . . . . 0.477 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 39.2 mm -61.74 -48.99 88.22 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.34 -0.846 . . . . 10.0 112.009 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 704' ' ' PRO . . . . . 0.477 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 42.9 Cg_exo -58.15 -43.69 45.47 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.008 1.805 . . . . 10.0 112.425 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -62.82 -42.93 99.59 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.954 -0.641 . . . . 10.0 112.299 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 35.2 tp -69.16 -42.49 75.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.659 0.266 . . . . 10.0 110.472 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -60.97 -44.91 96.64 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.706 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.83 -41.86 99.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.785 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -64.16 -41.98 96.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.888 0.375 . . . . 10.0 110.567 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 89.9 mt -62.64 -38.96 92.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.237 0.541 . . . . 10.0 110.011 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 21.1 mtpp -86.49 13.13 8.87 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.588 -0.733 . . . . 10.0 111.349 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -125.8 -51.95 1.57 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.767 0.318 . . . . 10.0 111.511 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -98.03 -23.64 15.68 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.353 0.871 . . . . 10.0 113.353 -177.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -108.63 -6.46 15.99 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.363 -0.535 . . . . 10.0 112.204 -178.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 39.1 t70 57.01 32.92 22.51 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.596 0.713 . . . . 10.0 110.7 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 12.5 tp -120.69 117.65 28.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.171 0.51 . . . . 10.0 111.06 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -90.96 99.24 12.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.459 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 77.7 mt -121.97 123.06 27.46 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.832 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -85.16 73.69 4.09 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.816 2.344 . . . . 10.0 111.653 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 46.7 mt -57.81 -37.67 61.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.115 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -62.34 -29.69 70.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.799 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -81.67 -37.61 27.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.003 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 42.5 m0 -60.92 -56.72 17.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.645 -0.707 . . . . 10.0 111.233 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 18.2 tp -65.07 -24.44 67.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.041 0.448 . . . . 10.0 111.244 -179.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -66.81 -39.93 87.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.042 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 726' ' ' LYS . . . . . 0.444 ' O ' ' HD3' ' A' ' 728' ' ' PRO . 8.8 mttp -99.84 -29.51 12.56 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.446 0.536 . . . . 10.0 112.446 -178.532 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -114.97 87.41 15.15 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 120.719 0.295 . . . . 10.0 111.049 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 728' ' ' PRO . . . . . 0.504 ' HD2' ' OE1' ' A' ' 729' ' ' GLU . 10.6 Cg_exo -72.27 -22.23 22.31 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.683 2.255 . . . . 10.0 112.346 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 729' ' ' GLU . . . . . 0.504 ' OE1' ' HD2' ' A' ' 728' ' ' PRO . 4.0 mp0 -74.59 1.95 10.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.75 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 730' ' ' LEU . . . . . 0.421 HD21 ' NH1' ' A' ' 738' ' ' ARG . 16.4 mt -66.12 -27.34 67.97 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 56.42 -101.41 0.13 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.801 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 732' ' ' GLU . . . . . 0.444 ' OE1' ' HA ' ' A' ' 694' ' ' PRO . 8.4 tt0 -148.99 -54.31 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.924 -0.31 . . . . 10.0 111.428 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.78 -50.51 73.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.454 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.59 -35.61 74.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.559 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 4.5 tt -65.0 -43.47 92.44 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.164 -0.471 . . . . 10.0 109.898 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 736' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 736' ' ' ARG . 52.8 mtt180 -62.67 -46.75 86.72 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.115 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -63.13 -38.1 89.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.198 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 738' ' ' ARG . . . . . 0.421 ' NH1' HD21 ' A' ' 730' ' ' LEU . 21.9 mmm-85 -57.47 -49.83 75.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.853 0.359 . . . . 10.0 110.089 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 79.8 mt -57.31 -46.34 85.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.218 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 740' ' ' LEU . . . . . 0.434 ' O ' HG13 ' A' ' 744' ' ' ILE . 53.6 tp -62.0 -47.2 85.86 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.11 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -59.44 -46.71 87.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.382 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -60.9 -35.73 77.42 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.199 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 20.4 m -66.66 -44.84 80.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.435 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 744' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 740' ' ' LEU . 73.1 mt -64.49 -37.65 80.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.458 . . . . 10.0 110.614 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.47 -55.66 25.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.363 -0.381 . . . . 10.0 110.611 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 85.0 t -62.23 -35.47 69.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.758 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -58.67 -49.48 77.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.463 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 748' ' ' GLN . . . . . 0.588 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 57.2 mt-30 -64.52 -35.99 82.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.493 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 64.8 mtp180 -64.68 -36.77 85.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.147 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -71.08 -37.72 72.45 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.45 -45.43 91.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.877 -1.056 . . . . 10.0 112.269 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 752' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 56.2 mt-10 -58.61 -28.7 65.86 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -178.636 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 17.8 t -78.74 -32.6 15.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.992 0.425 . . . . 10.0 111.147 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.9 t -86.59 -46.04 16.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.082 0.468 . . . . 10.0 110.946 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 130.78 137.78 4.17 Favored Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 111.137 -0.785 . . . . 10.0 111.137 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 756' ' ' ALA . . . . . 0.441 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -57.64 -59.26 5.47 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 757' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 757' ' ' GLU . 27.1 mp0 -63.09 -36.03 82.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.762 0.315 . . . . 10.0 111.032 -179.236 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 17.5 tpt -65.85 -43.86 87.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.82 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 40.3 mmm -63.03 -42.51 99.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.516 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.441 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.7 mmp_? -60.12 -39.25 85.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.249 0.547 . . . . 10.0 109.834 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -69.45 -38.11 77.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.711 178.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -64.07 -49.96 70.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.158 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -59.08 -46.12 89.1 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.213 -0.448 . . . . 10.0 110.31 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -57.44 -46.2 83.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.24 178.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -66.68 -46.04 79.19 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.832 -0.622 . . . . 10.0 112.351 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 61.6 t -59.66 -42.01 87.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.408 0.147 . . . . 10.0 110.822 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 22.7 mtp -59.94 -48.82 80.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.726 0.298 . . . . 10.0 110.427 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.99 -43.3 96.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.644 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -62.5 -48.3 80.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.312 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 8.4 m -63.0 -40.17 96.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.85 0.357 . . . . 10.0 110.292 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.6 tt -61.61 -46.92 87.78 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.433 -0.581 . . . . 10.0 109.433 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 772' ' ' ASP . . . . . 0.593 ' O ' ' HG2' ' A' ' 776' ' ' LYS . 0.3 OUTLIER -63.99 -43.6 95.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.796 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 42.1 m -55.86 -45.98 78.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.896 0.379 . . . . 10.0 110.844 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.24 -24.96 59.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.723 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -67.62 -38.84 84.48 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.996 -0.372 . . . . 10.0 109.996 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.593 ' HG2' ' O ' ' A' ' 772' ' ' ASP . 3.8 mmtt -62.38 -40.84 97.79 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 108.816 -0.809 . . . . 10.0 108.816 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -63.4 -53.29 54.65 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.912 -1.04 . . . . 10.0 109.374 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 778' ' ' HIS . . . . . 0.537 ' O ' ' HG2' ' A' ' 782' ' ' MET . 16.0 t60 -54.77 -37.27 65.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.31 -0.859 . . . . 10.0 111.86 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.16 -44.31 97.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.999 0.428 . . . . 10.0 110.361 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -75.43 -38.14 59.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.433 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.97 -42.06 93.33 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.9 -0.591 . . . . 10.0 111.281 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 782' ' ' MET . . . . . 0.537 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 97.5 mmm -60.0 -37.67 80.38 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.171 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 783' ' ' ASP . . . . . 0.424 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 9.1 t70 -71.79 -45.82 60.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.421 179.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -54.48 -42.52 70.82 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.531 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 21.9 tp -78.93 -30.97 44.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.858 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -58.5 -45.15 89.36 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.956 0.407 . . . . 10.0 110.984 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 787' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 6.9 pt20 . . . . . 0 C--N 1.322 -0.598 0 C-N-CA 120.749 -0.38 . . . . 10.0 110.627 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo . . . . . 0 CA--C 1.529 0.239 0 N-CA-C 113.807 0.657 . . . . 10.0 113.807 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 25.7 mtmm -82.45 -45.48 14.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.001 0.429 . . . . 10.0 109.95 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -62.95 -44.19 96.74 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.695 -0.684 . . . . 10.0 111.418 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -65.66 -36.55 83.99 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -61.36 -47.52 85.48 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.003 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -58.3 -40.46 82.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.114 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -60.39 -53.5 56.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.33 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -60.77 -37.49 82.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.692 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 28.4 m -65.97 -36.77 84.23 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.904 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -67.37 -41.46 85.03 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 6.6 m -65.47 -38.25 89.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.204 0.526 . . . . 10.0 109.827 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 32.7 ttm -63.52 -41.85 98.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.327 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -65.83 -42.49 90.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.57 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.42 -46.53 89.73 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.008 0.432 . . . . 10.0 110.32 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.75 85.03 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.463 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 22.4 ttp -63.61 -40.72 97.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.098 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.5 -40.59 95.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.523 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -65.05 -40.88 95.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.149 0.5 . . . . 10.0 110.173 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 14.4 m -68.93 -30.84 69.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.256 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 61.5 tp -63.55 -57.43 10.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.608 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt -61.13 -34.52 75.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.691 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -60.45 -61.44 2.6 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.582 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.79 -31.57 72.29 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.554 0.576 . . . . 10.0 112.554 -178.168 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 822' ' ' VAL . . . . . 0.442 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 14.6 t -60.22 -54.58 32.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.851 -0.34 . . . . 10.0 110.282 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 34.3 mm -66.6 -40.63 86.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.934 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 50.7 m -60.65 -50.9 71.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.005 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 93.3 m -59.6 -38.72 82.0 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.749 0.309 . . . . 10.0 111.593 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 826' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 94.6 mt -66.65 -18.27 65.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.823 0.344 . . . . 10.0 111.347 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 5.4 m -102.51 -34.1 9.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.913 0.387 . . . . 10.0 110.309 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -63.35 -23.89 67.61 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.624 -0.717 . . . . 10.0 111.722 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.82 122.33 4.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 121.586 0.708 . . . . 10.0 111.323 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -86.38 93.13 9.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.549 -0.751 . . . . 10.0 110.161 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 62.1 t . . . . . 0 C--N 1.319 -0.743 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.606 179.664 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 74.0 t80 . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 120.887 0.375 . . . . 10.0 110.84 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 136.62 150.0 5.76 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.908 -0.663 . . . . 10.0 112.444 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' HB3' ' A' ' 16' ' ' ARG . 6.0 m -63.31 148.16 49.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.906 0.384 . . . . 10.0 110.421 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.665 ' HD2' ' OD1' ' A' ' 408' ' ' ASP . 2.3 mmp_? -66.94 143.9 56.55 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.53 0.567 . . . . 10.0 112.53 -178.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.9 t30 68.33 -82.96 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 114.76 -1.109 . . . . 10.0 112.801 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -51.63 -59.64 4.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.509 0.929 . . . . 10.0 113.509 -177.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 16' ' ' ARG . 8.1 tpt180 -72.13 -41.73 66.84 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.76 0.652 . . . . 10.0 112.76 -177.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.6 p -59.44 -50.55 73.51 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.9 mt -64.06 -37.88 89.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.762 0.315 . . . . 10.0 111.041 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 23.6 ttp-105 -65.62 -45.12 84.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.469 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -63.58 -41.74 98.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.124 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.419 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 52.1 mtt -65.81 -34.81 79.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.618 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -61.96 -33.4 74.23 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.012 0.434 . . . . 10.0 110.135 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 19' ' ' ARG . 25.0 mtpp -66.88 -35.61 80.42 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.33 -0.618 . . . . 10.0 109.33 179.037 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 56.9 t -71.87 -38.83 66.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.504 -0.771 . . . . 10.0 109.476 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.574 HG13 HD12 ' A' ' 88' ' ' LEU . 59.5 t -58.49 -36.18 57.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.683 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -60.66 -38.66 85.62 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.069 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.7 mt -65.72 -43.97 93.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 65.9 mt -62.65 -36.44 75.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.503 -0.772 . . . . 10.0 110.233 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -63.35 -36.27 83.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.478 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.2 -25.28 36.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.71 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 46.8 mtt -80.35 -19.05 47.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.064 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.487 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 5.8 tt0 -59.65 -55.87 41.46 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-O 119.356 -0.355 . . . . 10.0 110.973 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.487 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 27.5 Cg_exo -63.7 -19.34 67.1 Favored 'Trans proline' 0 C--N 1.359 1.09 0 C-N-CA 121.97 1.78 . . . . 10.0 111.712 179.319 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -74.3 -45.09 49.72 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.4 mmt -68.96 -24.02 64.21 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.357 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 96.5 mt-10 -65.06 -22.77 67.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.76 179.228 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.9 mttt -86.35 -6.61 58.9 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.386 0.613 . . . . 10.0 109.915 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.2 mp -98.38 141.21 31.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.383 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.8 p -74.48 170.15 16.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.241 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -60.23 -38.05 82.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.959 0.409 . . . . 10.0 110.846 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -68.12 -32.89 73.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.721 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.71 -34.34 73.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.764 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.88 -43.65 98.42 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -67.04 -32.48 73.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.093 -0.958 . . . . 10.0 109.761 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.5 -34.91 90.86 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.351 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -66.74 -36.88 83.49 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.3 m -60.78 -44.83 96.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.136 178.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.15 -33.85 76.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.284 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -65.16 -40.51 94.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.65 179.443 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.413 ' CD1' HD22 ' A' ' 63' ' ' LEU . 23.2 m-30 -61.01 -42.66 98.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.777 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -59.02 -43.12 91.53 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.016 0.436 . . . . 10.0 110.372 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.37 -41.37 76.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.891 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -61.44 -38.11 86.0 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.153 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 55.3 mt -63.22 -40.16 96.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.801 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -70.14 -31.96 69.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.539 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -69.65 -61.79 1.64 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.785 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 168.95 27.27 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.204 -0.998 . . . . 10.0 113.27 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -94.02 140.92 29.13 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.1 t -87.09 139.43 17.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.572 HD11 ' O ' ' A' ' 118' ' ' LEU . 20.6 tp -56.26 -40.75 74.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.967 0.413 . . . . 10.0 111.107 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -63.43 -21.55 66.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.626 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -82.31 -20.73 36.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.076 0.465 . . . . 10.0 110.358 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.413 HD22 ' CD1' ' A' ' 50' ' ' PHE . 90.6 mt -82.15 -9.32 59.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.625 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.538 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 76.8 mt -49.43 -53.4 40.72 Favored Pre-proline 0 CA--C 1.542 0.645 0 N-CA-C 113.013 0.746 . . . . 10.0 113.013 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.538 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 33.5 Cg_exo -58.95 -49.83 10.4 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.963 1.776 . . . . 10.0 113.204 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.442 ' O ' HG23 ' A' ' 70' ' ' VAL . 48.6 mt-10 -69.61 -43.8 72.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.335 -0.393 . . . . 10.0 111.955 -178.446 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.42 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -64.9 -47.56 77.36 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.002 0.371 . . . . 10.0 112.002 -178.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -61.5 -34.03 74.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.7 -0.227 . . . . 10.0 110.663 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.58 -43.98 88.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.372 179.025 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 66' ' ' GLU . 95.5 t -61.59 -47.44 93.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.024 -0.534 . . . . 10.0 110.265 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 67' ' ' ALA . 48.2 t -61.58 -42.52 94.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.442 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -59.82 -46.22 89.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.488 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -64.17 -44.25 92.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.383 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.46 -33.39 72.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.374 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.5 m -63.76 -37.11 86.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.38 179.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.6 mtmm -72.33 -12.51 61.17 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.83 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -110.89 -39.32 4.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -178.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 62.0 t -82.07 -45.09 20.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.957 0.408 . . . . 10.0 111.702 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -101.21 -27.88 12.96 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.854 0.359 . . . . 10.0 111.212 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.11 4.63 81.35 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.017 -0.611 . . . . 10.0 111.784 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 18.0 mtt -117.27 139.94 50.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.587 -0.523 . . . . 10.0 109.587 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.434 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 8.5 ttp180 -85.66 138.05 32.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.815 0.34 . . . . 10.0 110.711 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.41 114.31 5.33 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -55.56 152.52 8.98 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 123.596 0.56 . . . . 10.0 112.022 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.75 -40.17 96.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.975 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.9 m -68.29 -27.33 36.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 10.0 111.084 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.463 HE22 HD23 ' A' ' 110' ' ' LEU . 96.7 mt-30 -70.96 -30.29 66.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.221 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.574 HD12 HG13 ' A' ' 25' ' ' VAL . 86.9 mt -65.22 -36.21 83.45 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.466 ' O ' HG23 ' A' ' 93' ' ' VAL . 82.2 mt -65.19 -50.57 65.41 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.835 -0.621 . . . . 10.0 109.719 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.09 99.5 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.666 -0.697 . . . . 10.0 112.089 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -66.44 -32.2 81.1 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.886 -0.673 . . . . 10.0 112.079 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.419 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 13.9 ttm -71.27 -36.09 71.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.846 0.355 . . . . 10.0 110.424 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 89' ' ' LEU . 76.5 t -65.82 -33.78 65.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.223 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.76 -2.27 22.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.702 -0.681 . . . . 10.0 112.13 -179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -80.5 -28.03 37.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.207 0.527 . . . . 10.0 109.988 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -103.73 175.43 5.48 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.167 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 43.1 ttt85 -78.49 77.83 4.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.888 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 408' ' ' ASP . 0.4 OUTLIER -152.0 159.85 43.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.099 0.476 . . . . 10.0 111.582 -179.676 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.577 HD12 HG11 ' A' ' 211' ' ' VAL . 49.9 mm -100.12 134.64 39.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.713 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.84 111.95 23.69 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.851 0.358 . . . . 10.0 111.287 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -86.99 117.11 25.49 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.7 mtt -111.59 177.67 4.58 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.281 0.562 . . . . 10.0 111.495 -178.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.466 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 9.2 mmm180 -108.73 142.71 38.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.312 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.63 110.0 2.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.771 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.445 ' O ' ' HG2' ' A' ' 578' ' ' GLN . . . 127.17 -23.36 5.51 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.856 -0.687 . . . . 10.0 112.535 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -75.85 -41.06 53.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.939 0.4 . . . . 10.0 110.834 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 155.27 150.38 5.56 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.971 -0.633 . . . . 10.0 111.63 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.416 ' HE2' ' HA ' ' A' ' 108' ' ' LYS . 0.3 OUTLIER -121.55 -80.43 0.62 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.777 0.289 . . . . 10.0 110.687 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.74 -24.64 38.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.061 0.457 . . . . 10.0 110.675 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.463 HD23 HE22 ' A' ' 87' ' ' GLN . 45.9 tp -63.14 -25.29 68.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.323 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.96 -20.99 26.5 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.23 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -83.06 -8.84 59.49 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.435 0.531 . . . . 10.0 112.435 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 11.5 p -67.1 -33.36 75.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.768 0.318 . . . . 10.0 111.793 -179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.403 ' HB2' ' CD ' ' A' ' 115' ' ' PRO . 26.3 mt -65.71 -57.6 13.74 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.929 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.403 ' CD ' ' HB2' ' A' ' 114' ' ' LEU . 33.2 Cg_endo -63.13 -32.28 74.83 Favored 'Trans proline' 0 C--N 1.357 0.977 0 C-N-CA 121.935 1.757 . . . . 10.0 111.959 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.98 -52.88 45.57 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.689 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.413 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 63.6 t80 -59.92 -44.55 94.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.865 0.364 . . . . 10.0 110.633 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.572 ' O ' HD11 ' A' ' 60' ' ' LEU . 36.6 tp -59.44 -54.74 43.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.462 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -69.94 -23.29 63.18 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.876 0.324 . . . . 10.0 111.876 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.48 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -67.28 -26.19 66.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.019 0.438 . . . . 10.0 110.882 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 63.5 mt -60.81 -25.55 66.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.382 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.7 p -70.17 -19.32 63.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.864 0.364 . . . . 10.0 111.089 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 72.45 12.09 76.84 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 121.048 -0.596 . . . . 10.0 112.711 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.1 mmpp? -85.28 -21.99 28.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.688 0.28 . . . . 10.0 111.034 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.39 115.23 3.78 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.554 -0.831 . . . . 10.0 112.962 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.408 HG13 ' CD2' ' A' ' 205' ' ' TYR . 96.4 t -83.78 112.18 20.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 19.0 m170 -86.87 96.43 10.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.799 0.333 . . . . 10.0 110.387 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.5 t -86.1 120.34 35.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.127 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 26.0 t -98.88 113.58 34.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.326 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.36 151.8 21.84 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.99 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.412 ' H ' HG22 ' A' ' 131' ' ' VAL . 0.6 OUTLIER -69.06 -49.15 65.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.353 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -126.96 157.6 39.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.421 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.08 -17.77 63.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.703 -178.428 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -68.51 -55.44 11.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.837 0.351 . . . . 10.0 110.559 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.68 -31.94 73.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.69 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.05 -44.62 74.9 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.866 -0.607 . . . . 10.0 111.118 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -80.7 -40.45 25.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.792 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -52.55 -61.37 2.32 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.922 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -70.11 -27.3 64.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.259 -0.428 . . . . 10.0 112.073 -178.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.61 -50.49 64.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.949 0.404 . . . . 10.0 110.494 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -71.17 -33.21 69.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.052 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -70.88 -36.69 72.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.569 -0.287 . . . . 10.0 111.658 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -92.69 -3.12 55.4 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.027 -0.269 . . . . 10.0 111.559 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.486 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 63.2 ttm-85 -59.77 -49.16 93.05 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-O 119.293 -0.384 . . . . 10.0 111.877 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' PRO . . . . . 0.559 ' O ' ' HB2' ' A' ' 149' ' ' PHE . 29.2 Cg_exo -63.15 -9.12 16.03 Favored 'Trans proline' 0 C--N 1.361 1.204 0 C-N-CA 122.228 1.952 . . . . 10.0 112.692 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.5 tp -93.09 -52.39 4.59 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.018 0.437 . . . . 10.0 110.245 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -72.24 -45.5 59.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.888 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -67.0 -23.29 65.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.764 0.316 . . . . 10.0 110.971 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.559 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 29.7 t80 -68.29 -26.11 65.48 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.751 -0.463 . . . . 10.0 109.751 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 54.2 mt -94.5 -1.0 54.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.637 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 97.62 1.8 58.83 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.819 -0.705 . . . . 10.0 113.447 178.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 28.8 mt -80.9 140.79 35.12 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.057 0.429 . . . . 10.0 110.794 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.86 123.95 34.26 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.754 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 56.7 t -104.95 119.78 54.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.574 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -115.51 146.87 18.89 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.652 -0.785 . . . . 10.0 112.201 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.5 tp -119.99 127.4 75.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.038 0.447 . . . . 10.0 110.45 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -108.46 105.83 15.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.137 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 161' ' ' MET . 86.1 mt -96.65 146.68 31.73 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.897 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 159' ' ' PRO . . . . . 0.494 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 27.5 Cg_endo -62.37 116.96 3.84 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.856 2.371 . . . . 10.0 112.355 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 96.21 6.19 59.01 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.749 -0.739 . . . . 10.0 112.825 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' MET . . . . . 0.449 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.5 OUTLIER -67.97 150.09 97.92 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.539 0.17 . . . . 10.0 110.612 179.679 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -63.52 152.53 79.75 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.628 2.219 . . . . 10.0 112.14 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' ALA . . . . . 0.527 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.46 -50.92 80.29 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 113.12 0.785 . . . . 10.0 113.12 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.527 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 52.7 Cg_exo -57.03 -44.59 42.92 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 122.029 1.819 . . . . 10.0 112.416 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.12 -41.89 97.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.848 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.44 ' HZ2' ' CG ' ' A' ' 185' ' ' ASP . 54.4 mttm -63.91 -41.38 97.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.955 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 167' ' ' ARG . . . . . 0.43 ' HG2' ' HA ' ' A' ' 199' ' ' VAL . 64.3 mtt180 -58.35 -36.8 74.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.285 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -70.5 -38.79 74.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.962 0.41 . . . . 10.0 110.26 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.02 -44.19 85.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.524 -0.762 . . . . 10.0 111.11 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 41.7 m-85 -73.76 -28.2 61.55 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.307 -0.406 . . . . 10.0 111.036 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -76.27 -10.3 59.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.753 0.311 . . . . 10.0 111.274 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -75.12 174.67 9.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.615 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 173' ' ' ASP . . . . . 0.48 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 9.4 m-20 -75.44 -38.55 59.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.12 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 66.4 mt -130.84 125.95 59.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.006 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.9 m -115.5 117.21 29.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.917 0.389 . . . . 10.0 111.626 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -96.06 131.21 42.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.998 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -166.43 173.66 41.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.284 -0.96 . . . . 10.0 112.768 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.17 153.54 20.87 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 122.214 0.205 . . . . 10.0 111.074 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -61.48 -36.59 80.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.684 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -63.23 -56.44 16.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.44 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.494 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.5 tp10 -62.81 -37.85 88.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.238 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.67 -34.69 71.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.767 0.318 . . . . 10.0 110.993 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -81.21 -40.3 11.58 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.92 -0.657 . . . . 10.0 111.835 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -64.38 -36.09 83.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.826 0.346 . . . . 10.0 110.75 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 185' ' ' ASP . . . . . 0.44 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 29.8 m-20 -61.42 -40.74 95.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.333 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -61.53 -38.12 86.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.418 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 54.8 mt -67.24 -41.68 85.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.554 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 72.9 mtm-85 -67.61 -41.71 83.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.951 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.39 -23.79 67.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.19 0.519 . . . . 10.0 111.264 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -90.95 1.66 56.86 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.966 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 66.6 mtp -108.88 -7.11 15.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.736 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -62.42 160.52 13.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.621 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -110.8 -14.9 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.281 0.563 . . . . 10.0 109.932 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -129.24 138.15 32.54 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.481 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -58.3 -29.97 89.57 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.639 2.226 . . . . 10.0 112.743 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -70.77 -16.09 62.73 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.662 0.245 . . . . 10.0 111.662 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -76.36 -15.96 59.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.668 -0.242 . . . . 10.0 111.549 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 75.1 mtt180 -57.88 134.82 56.65 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.959 0.409 . . . . 10.0 111.521 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 199' ' ' VAL . . . . . 0.43 ' HA ' ' HG2' ' A' ' 167' ' ' ARG . 20.5 m -108.07 -20.49 6.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.496 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -89.47 -178.61 5.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.209 0.528 . . . . 10.0 111.729 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -137.73 -179.02 5.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.588 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -52.91 133.56 37.8 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.432 0.635 . . . . 10.0 112.351 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 17.3 mt -87.55 61.99 6.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.473 -0.785 . . . . 10.0 110.034 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -80.06 -50.08 10.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.337 0.495 . . . . 10.0 112.337 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 205' ' ' TYR . . . . . 0.408 ' CD2' HG13 ' A' ' 126' ' ' VAL . 33.3 t80 -131.22 138.02 49.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.993 0.425 . . . . 10.0 111.701 -178.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.608 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -134.53 125.28 27.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.697 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 30.5 tp -122.68 108.57 13.23 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.877 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.4 p -96.04 129.87 45.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.207 0.527 . . . . 10.0 110.836 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -58.81 -55.9 29.16 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.377 -0.829 . . . . 10.0 111.981 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 210' ' ' GLU . . . . . 0.468 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 23.0 tt0 -126.27 114.72 18.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.867 0.365 . . . . 10.0 110.924 -179.08 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.577 HG11 HD12 ' A' ' 99' ' ' ILE . 25.5 m -85.22 -9.56 11.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.792 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 212' ' ' ASP . . . . . 0.424 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 10.0 t70 -52.97 -68.07 0.2 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.363 -0.835 . . . . 10.0 110.99 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 7.8 p -82.4 -50.8 8.49 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.996 -0.547 . . . . 10.0 112.119 -179.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 69.2 mt -55.52 -41.71 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 114.37 1.248 . . . . 10.0 114.37 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 10.8 mt -97.76 -51.95 3.91 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.614 0.968 . . . . 10.0 113.614 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 216' ' ' ILE . . . . . 0.424 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 47.0 mm -70.76 -56.24 11.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 113.387 0.884 . . . . 10.0 113.387 -177.188 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -74.49 -41.24 61.07 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.87 0.693 . . . . 10.0 112.87 -177.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -91.11 28.21 1.67 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 111.88 0.326 . . . . 10.0 111.88 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -66.78 -52.61 42.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.015 0.436 . . . . 10.0 111.907 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 220' ' ' ARG . . . . . 0.431 ' O ' ' HD3' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -94.74 16.73 15.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.325 -178.419 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 90.1 m -79.82 116.92 64.51 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 120.819 0.342 . . . . 10.0 110.298 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -92.33 141.49 2.29 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.022 2.481 . . . . 10.0 113.065 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 223' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.71 112.95 25.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.528 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 53.3 mt -115.16 124.43 71.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.405 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 6.5 pt . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.974 179.968 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.227 0 CA-C-O 120.65 0.262 . . . . 10.0 111.074 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 374' ' ' SER . . . . . . . . . . . . . 18.9 m -153.82 153.21 31.71 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.42 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.5 tt -146.45 146.22 19.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.754 0.311 . . . . 10.0 110.534 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.71 142.03 28.17 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -56.39 -52.3 65.13 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -56.05 -41.84 75.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.462 . . . . 10.0 110.62 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -69.68 -21.19 63.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.693 -0.685 . . . . 10.0 111.577 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -82.04 -42.71 18.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.857 0.36 . . . . 10.0 110.268 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -70.24 -17.77 63.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.312 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -78.26 -7.48 57.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.835 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 25.5 mt -89.25 -2.86 58.64 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.548 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 384' ' ' TYR . . . . . 0.608 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 43.9 m-85 -96.48 137.79 35.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.793 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -70.64 -74.04 0.15 Allowed 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.169 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -88.86 98.51 11.77 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.432 HD23 HD21 ' A' ' 407' ' ' LEU . 56.2 tp -109.08 111.48 23.14 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.019 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -124.57 154.78 40.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.987 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -156.02 158.49 28.64 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.21 -0.995 . . . . 10.0 112.573 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 24.5 mtm -115.71 160.88 19.5 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.684 0.278 . . . . 10.0 110.419 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 391' ' ' THR . . . . . 0.576 ' HB ' HG22 ' A' ' 211' ' ' VAL . 6.6 t -164.31 169.79 17.01 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.111 178.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -93.71 166.21 27.58 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.832 -0.907 . . . . 10.0 110.832 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 393' ' ' THR . . . . . 0.466 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 0.2 OUTLIER -60.77 102.55 0.2 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.558 0.218 . . . . 10.0 110.594 179.719 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -141.79 -29.26 0.62 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.546 0.572 . . . . 10.0 112.546 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 38.8 t70 55.76 -119.63 1.41 Allowed 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 110.12 -0.326 . . . . 10.0 110.12 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 396' ' ' THR . . . . . 0.48 ' HB ' ' OE1' ' A' ' 397' ' ' GLU . 2.3 m 51.99 -100.9 0.1 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.97 0.73 . . . . 10.0 112.97 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 397' ' ' GLU . . . . . 0.48 ' OE1' ' HB ' ' A' ' 396' ' ' THR . 3.7 mp0 -76.91 9.8 2.68 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.246 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -58.8 -30.5 67.65 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.247 0.462 . . . . 10.0 112.247 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -72.2 -17.0 61.96 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.103 0.409 . . . . 10.0 112.103 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -81.59 -13.43 58.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.657 0.265 . . . . 10.0 111.277 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -61.16 -44.98 96.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.619 -0.264 . . . . 10.0 111.487 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 11.9 m -74.64 -4.44 37.22 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 48.9 m -111.15 -54.89 2.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.037 0.384 . . . . 10.0 112.037 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 49.3 mt -71.31 -47.95 56.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -106.3 -5.77 18.86 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm 60.5 47.5 8.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.37 0.605 . . . . 10.0 110.288 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 407' ' ' LEU . . . . . 0.525 HD13 HD11 ' A' ' 99' ' ' ILE . 42.0 mt -117.04 135.81 53.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.626 -0.715 . . . . 10.0 109.866 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 408' ' ' ASP . . . . . 0.665 ' OD1' ' HD2' ' A' ' 13' ' ' ARG . 1.1 t0 -75.69 175.87 8.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 10.2 m -138.78 125.61 21.0 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.947 -0.47 . . . . 10.0 111.881 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 47.2 t -130.97 137.39 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.851 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.9 t -92.74 134.67 29.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 110.195 -0.298 . . . . 10.0 110.195 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 412' ' ' VAL . . . . . 0.414 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 38.8 t -95.16 127.71 41.53 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.125 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 413' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 412' ' ' VAL . 24.6 Cg_exo -64.19 154.26 71.81 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.843 2.362 . . . . 10.0 112.055 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.3 p -84.11 154.42 23.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.196 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -66.85 -36.66 82.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.284 0.564 . . . . 10.0 109.588 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 41.2 mtm180 -129.45 154.19 80.72 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.001 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.48 115.3 2.94 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.429 2.086 . . . . 10.0 111.973 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 51.1 ttp -75.71 105.37 6.71 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.959 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -97.58 62.06 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.212 0.53 . . . . 10.0 110.936 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 36.2 ttp180 -98.42 115.57 28.78 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 47.0 mtpt -82.95 100.84 10.67 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.495 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 422' ' ' ASP . . . . . 0.47 ' HA ' ' OG ' ' A' ' 584' ' ' SER . 8.2 m-20 -89.0 102.35 14.99 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.385 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 68.1 mt -82.82 153.31 67.27 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.295 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.49 168.26 6.87 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.12 2.547 . . . . 10.0 113.444 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -88.17 124.31 33.69 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.312 -0.858 . . . . 10.0 110.706 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 58.3 mt -98.49 86.89 3.7 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.5 -0.556 . . . . 10.0 109.5 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 22.6 t -81.18 129.45 37.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.394 -179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 428' ' ' TYR . . . . . 0.505 ' CE2' ' HA ' ' A' ' 614' ' ' PRO . 6.9 m-85 -112.42 -178.17 3.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.358 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 62.9 mtm -80.99 -74.22 0.33 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.909 -0.317 . . . . 10.0 111.166 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 67.8 p -89.5 162.56 15.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.912 0.387 . . . . 10.0 111.415 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 431' ' ' GLU . . . . . 0.41 ' O ' HG12 ' A' ' 435' ' ' ILE . 3.9 tt0 -63.09 -29.8 71.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.175 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -59.43 -46.01 89.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.768 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -61.2 -44.46 97.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.23 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 434' ' ' LYS . . . . . 0.423 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 37.4 ttpt -58.69 -50.3 74.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.544 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 435' ' ' ILE . . . . . 0.46 ' O ' HG12 ' A' ' 439' ' ' ILE . 45.7 mm -61.25 -46.0 97.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.904 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 55.9 tp60 -58.13 -43.5 87.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.876 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.52 86.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.811 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 438' ' ' ILE . . . . . 0.431 HD13 HG22 ' A' ' 559' ' ' THR . 92.0 mt -62.42 -49.64 83.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.051 178.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 439' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 435' ' ' ILE . 45.6 mm -60.24 -38.76 78.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.253 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -61.83 -44.52 96.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.675 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 441' ' ' ASP . . . . . 0.604 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 14.8 t70 -63.98 -45.15 90.36 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.161 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 86.6 mt -58.65 -39.62 76.71 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.692 -0.686 . . . . 10.0 110.964 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -58.29 -40.62 82.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.676 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 444' ' ' GLU . . . . . 0.419 ' O ' ' HE2' ' A' ' 448' ' ' LYS . 63.2 mm-40 -69.18 -40.14 78.28 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.765 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.604 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 17.7 mmt180 -65.66 -45.52 82.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.548 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 7.6 m -63.04 -38.48 91.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.593 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.7 -31.61 72.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.252 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 448' ' ' LYS . . . . . 0.419 ' HE2' ' O ' ' A' ' 444' ' ' GLU . 0.2 OUTLIER -86.86 -23.15 25.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.233 -179.491 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 95.93 29.25 8.71 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.838 -0.696 . . . . 10.0 111.825 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 450' ' ' GLN . . . . . 0.561 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 64.2 tt0 -101.43 130.99 23.61 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 120.451 0.167 . . . . 10.0 111.046 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.96 140.58 50.63 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.676 2.251 . . . . 10.0 111.282 178.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 23.9 t -121.61 133.69 67.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.692 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 60.4 tp -120.68 106.27 11.57 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 22.5 t -95.09 127.77 46.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.752 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -115.5 115.17 3.34 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.958 -0.639 . . . . 10.0 111.911 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 21.8 p -103.72 148.58 25.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.633 0.254 . . . . 10.0 110.839 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 457' ' ' ILE . . . . . 0.426 HG12 ' OE1' ' A' ' 560' ' ' GLU . 21.1 pt -92.36 -4.54 10.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.853 0.358 . . . . 10.0 111.107 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 7.5 m -148.82 146.98 28.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.082 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 47.6 mt -63.09 -36.68 76.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.396 -0.366 . . . . 10.0 111.127 -179.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.86 -37.23 71.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.036 0.446 . . . . 10.0 110.326 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -67.48 -40.03 85.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.04 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.87 -43.75 91.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.481 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -61.99 -43.05 99.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.637 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 40.6 tp -65.13 -50.17 67.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.901 -0.591 . . . . 10.0 111.546 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 9.3 p -64.88 -33.93 66.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 121.048 -0.261 . . . . 10.0 111.393 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 71.1 m -65.44 -38.91 91.27 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 120.84 0.352 . . . . 10.0 110.363 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -63.32 -48.27 78.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.261 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.94 -39.7 95.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.76 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 18.8 mt -63.49 -37.24 86.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.891 0.377 . . . . 10.0 110.432 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 20.7 m -68.92 -39.93 79.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.43 0.633 . . . . 10.0 109.807 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt -64.7 -32.11 73.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.215 -0.902 . . . . 10.0 110.493 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -87.41 -4.61 59.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.293 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 68.31 31.55 74.53 Favored Glycine 0 C--N 1.329 0.169 0 CA-C-N 116.116 -0.493 . . . . 10.0 112.963 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 57.5 mt -101.06 136.68 31.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.731 0.301 . . . . 10.0 110.62 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.483 ' O ' ' HB ' ' A' ' 500' ' ' VAL . 52.8 mttm -61.0 134.63 57.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.135 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 476' ' ' HIS . . . . . 0.405 ' HA ' ' O ' ' A' ' 500' ' ' VAL . 45.5 p-80 -152.84 125.4 8.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.066 0.46 . . . . 10.0 111.289 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -110.13 124.25 51.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.868 -0.606 . . . . 10.0 109.467 178.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 19.1 t -94.16 122.24 45.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.805 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.469 HD12 ' HB2' ' A' ' 503' ' ' ALA . 21.0 mt -79.5 72.83 6.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.429 0.633 . . . . 10.0 110.412 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -68.8 126.03 28.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.473 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -66.95 -18.57 65.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.618 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -72.51 -29.88 63.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.003 0.43 . . . . 10.0 110.567 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -107.71 74.33 0.95 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.955 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -65.71 -32.55 74.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.921 0.391 . . . . 10.0 110.68 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.36 -38.74 90.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.572 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -80.44 -29.88 37.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.098 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 487' ' ' GLU . . . . . 0.43 ' HG3' HD22 ' A' ' 479' ' ' LEU . 26.4 tt0 -54.49 -47.41 73.07 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.516 -0.766 . . . . 10.0 110.864 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -56.82 -41.45 77.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.288 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -68.64 -41.33 79.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.956 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.2 mt -64.35 -47.82 87.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.911 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 97.4 t -63.58 -36.96 78.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.918 0.389 . . . . 10.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -62.9 -33.95 76.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.672 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -113.0 23.16 13.67 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.972 0.415 . . . . 10.0 111.106 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -73.18 -18.81 61.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.107 0.48 . . . . 10.0 110.928 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -94.38 15.0 64.21 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.867 -0.682 . . . . 10.0 111.744 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 496' ' ' TYR . . . . . 0.402 ' HA ' ' HD3' ' A' ' 497' ' ' PRO . 5.5 t80 -71.27 140.63 85.3 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 110.365 -0.235 . . . . 10.0 110.365 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 497' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 496' ' ' TYR . 52.4 Cg_exo -56.54 128.11 28.69 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.398 2.065 . . . . 10.0 112.371 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 64.6 32.94 11.14 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.031 179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -111.52 121.6 45.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.566 -0.288 . . . . 10.0 110.274 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 500' ' ' VAL . . . . . 0.483 ' HB ' ' O ' ' A' ' 475' ' ' LYS . 44.5 t -101.92 117.75 47.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.035 0.445 . . . . 10.0 110.927 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.6 m -109.47 135.88 49.77 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.282 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 25.9 mt -115.99 123.47 71.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.706 0.289 . . . . 10.0 110.548 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 503' ' ' ALA . . . . . 0.469 ' HB2' HD12 ' A' ' 479' ' ' LEU . . . -122.51 136.89 54.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.777 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 10.3 m -107.48 122.23 46.22 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.702 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 16.7 m120 53.37 68.04 0.9 Allowed 'General case' 0 N--CA 1.465 0.294 0 O-C-N 123.682 0.614 . . . . 10.0 110.743 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.03 135.04 57.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.176 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.9 172.59 12.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.712 -0.677 . . . . 10.0 110.848 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -68.9 167.1 46.17 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 121.009 -0.615 . . . . 10.0 112.422 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.468 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 74.8 mtt180 64.96 -86.71 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.023 0.529 . . . . 10.0 111.179 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.2 133.23 5.68 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.835 -0.697 . . . . 10.0 112.376 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.35 153.88 39.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.714 0.292 . . . . 10.0 111.046 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -76.96 112.98 14.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.806 0.336 . . . . 10.0 110.462 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 82.5 mt -84.56 125.0 40.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.186 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 2.0 t -85.84 125.47 40.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.788 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.4 HD21 ' HB2' ' A' ' 554' ' ' LEU . 72.4 mt -74.99 132.07 41.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.585 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 91.94 -4.31 78.24 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.505 -0.638 . . . . 10.0 111.505 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 113.0 -175.32 16.55 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.608 -0.997 . . . . 10.0 110.608 -179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 1.6 p -123.26 93.83 4.07 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.304 0.552 . . . . 10.0 111.018 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 34.8 p-90 -59.22 -32.99 70.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.009 0.433 . . . . 10.0 110.405 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -66.54 -23.58 66.25 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.32 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -92.96 -33.22 14.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.095 0.474 . . . . 10.0 109.864 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -68.2 -39.83 82.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.748 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 523' ' ' VAL . . . . . 0.544 HG12 HD12 ' A' ' 537' ' ' ILE . 26.8 m -73.53 -23.1 19.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.973 0.416 . . . . 10.0 110.318 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -81.94 -27.67 33.18 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.716 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -66.26 -27.77 68.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.442 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 25.2 mt -75.98 136.5 40.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.979 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -69.33 -32.21 71.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.987 0.422 . . . . 10.0 110.027 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -134.36 88.11 31.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.312 179.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -84.34 103.01 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.462 2.108 . . . . 10.0 112.06 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 20.8 p -75.83 162.7 27.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.52 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -60.37 -34.42 73.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.937 0.398 . . . . 10.0 110.364 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.38 -47.39 76.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.107 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -64.26 -43.08 95.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.826 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 72.4 mt -59.46 -42.78 88.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.609 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.64 -36.84 68.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.541 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 9.5 tptt -64.18 -50.27 68.78 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.327 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 537' ' ' ILE . . . . . 0.544 HD12 HG12 ' A' ' 523' ' ' VAL . 81.4 mt -63.6 -36.05 74.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 110.114 -0.328 . . . . 10.0 110.114 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -62.3 -45.79 91.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.064 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -68.32 -40.5 81.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.449 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.56 -45.16 94.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.574 -0.739 . . . . 10.0 109.454 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 50.0 t90 -61.68 -37.63 84.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.842 -1.072 . . . . 10.0 110.877 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 40.2 tp60 -57.39 -44.9 84.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.778 0.323 . . . . 10.0 110.879 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 42.2 t -64.03 -42.74 96.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.083 0.468 . . . . 10.0 110.314 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -68.83 -38.14 79.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.588 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -62.27 -45.21 94.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.963 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.08 -34.22 77.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.271 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -60.22 -39.39 86.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.732 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 99.6 t -69.69 -39.05 77.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.526 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.88 -45.94 90.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.598 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -69.51 -15.52 63.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.503 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 551' ' ' ALA . . . . . 0.561 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -86.02 -25.86 25.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.974 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 123.89 22.75 2.14 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.567 -0.825 . . . . 10.0 112.896 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 71.12 -162.51 54.14 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.007 -0.616 . . . . 10.0 112.636 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.4 ' HB2' HD21 ' A' ' 515' ' ' LEU . 50.7 tp -74.36 126.71 31.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.089 -0.337 . . . . 10.0 110.089 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 555' ' ' HIS . . . . . 0.421 ' HA ' ' O ' ' A' ' 583' ' ' SER . 65.9 t60 -97.86 110.97 23.44 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.328 -179.005 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 16.7 mm -92.8 132.88 35.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.427 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 26.4 mt -127.5 124.51 63.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.909 0.385 . . . . 10.0 110.239 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -110.13 129.92 9.62 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 111.32 -0.712 . . . . 10.0 111.32 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 559' ' ' THR . . . . . 0.431 HG22 HD13 ' A' ' 438' ' ' ILE . 16.1 p -79.58 -34.31 40.96 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.155 0.502 . . . . 10.0 110.62 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 560' ' ' GLU . . . . . 0.426 ' OE1' HG12 ' A' ' 457' ' ' ILE . 25.8 mp0 -142.04 160.19 40.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.074 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 561' ' ' ARG . . . . . 0.508 ' HB2' HD22 ' A' ' 594' ' ' LEU . 24.7 mmt180 -98.11 150.35 21.53 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.257 -0.645 . . . . 10.0 109.257 178.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -93.91 145.35 24.69 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -62.33 -57.54 10.96 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.2 107.96 6.7 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.064 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 41.8 ttt85 -60.53 -16.96 42.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.952 -0.567 . . . . 10.0 112.275 -178.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -55.85 -41.96 75.1 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 121.236 0.541 . . . . 10.0 110.299 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 58.9 mt -84.59 -28.99 6.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.367 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -61.52 -48.08 82.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.415 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -64.13 -36.27 83.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.667 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -70.89 -28.79 64.8 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.196 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.429 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 25.5 tp -66.44 -39.84 89.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.994 0.426 . . . . 10.0 110.467 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 32.5 mtm105 -82.4 -16.03 50.51 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.19 0.519 . . . . 10.0 110.009 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.26 4.2 34.7 Favored Glycine 0 CA--C 1.52 0.355 0 CA-C-N 115.731 -0.668 . . . . 10.0 113.225 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 574' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 2.4 mmt180 -77.08 -24.29 51.85 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 3.8 t -106.97 162.39 13.88 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.915 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 66.67 40.91 94.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.224 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -87.43 143.81 27.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.178 -0.305 . . . . 10.0 110.178 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 578' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 105' ' ' GLY . 60.4 mt-30 64.75 23.56 12.74 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.637 0.586 . . . . 10.0 110.371 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 69.85 45.14 59.22 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.524 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -107.52 -167.27 1.24 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.296 -0.261 . . . . 10.0 110.296 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -88.82 167.82 12.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.22 0.533 . . . . 10.0 111.877 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 168.86 166.06 27.29 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.512 -0.635 . . . . 10.0 111.512 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.421 ' O ' ' HA ' ' A' ' 555' ' ' HIS . 4.8 p -152.51 142.38 22.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.919 0.359 . . . . 10.0 110.52 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 584' ' ' SER . . . . . 0.47 ' OG ' ' HA ' ' A' ' 422' ' ' ASP . 84.6 p -126.61 139.67 53.01 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.07 0.462 . . . . 10.0 110.554 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 4.3 tpm_? -135.83 109.42 7.98 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.909 -0.775 . . . . 10.0 108.909 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -102.34 145.31 29.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.269 0.557 . . . . 10.0 111.671 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 587' ' ' TYR . . . . . 0.423 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 68.6 m-85 -127.5 164.45 21.91 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.193 -0.912 . . . . 10.0 109.39 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 588' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 587' ' ' TYR . 5.5 mt -163.57 166.89 22.01 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.194 -0.299 . . . . 10.0 110.194 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 589' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 428' ' ' TYR . 0.3 OUTLIER -139.01 150.43 45.81 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 178.262 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 590' ' ' MET . . . . . 0.437 ' HA ' ' HG3' ' A' ' 595' ' ' MET . 75.3 mmm -68.47 -8.51 41.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.563 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -93.66 2.12 56.41 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.875 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -80.58 154.46 27.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.849 0.357 . . . . 10.0 110.864 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -68.15 -17.86 64.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.746 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 594' ' ' LEU . . . . . 0.546 ' O ' HG12 ' A' ' 597' ' ' ILE . 9.1 tp -65.61 -24.01 66.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.992 0.425 . . . . 10.0 110.998 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.437 ' HG3' ' HA ' ' A' ' 590' ' ' MET . 13.6 mmt -73.89 1.63 10.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.652 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -96.84 -3.11 42.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.24 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 597' ' ' ILE . . . . . 0.546 HG12 ' O ' ' A' ' 594' ' ' LEU . 24.0 pt -84.9 -3.22 7.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.07 0.462 . . . . 10.0 110.971 -179.645 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -89.78 1.55 55.99 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.696 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.84 -66.03 0.23 Allowed 'General case' 0 N--CA 1.466 0.35 0 O-C-N 124.001 0.813 . . . . 10.0 111.827 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.7 m -86.74 120.53 28.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.011 0.434 . . . . 10.0 110.918 -179.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.16 -19.39 64.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.656 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -61.26 -34.57 75.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.69 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 49.4 t -65.13 -49.36 79.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.067 0.46 . . . . 10.0 109.885 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.0 -35.63 81.08 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.378 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -64.94 -38.02 94.99 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 116.076 -0.511 . . . . 10.0 112.237 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 37.8 tpp -68.16 -28.36 67.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.905 0.383 . . . . 10.0 110.543 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 58.0 mtt -68.28 -24.61 64.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.809 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 80.1 mtt-85 -69.59 -17.99 63.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.866 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -82.39 9.21 9.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.072 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 4.2 tp -78.79 -11.01 59.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.056 0.455 . . . . 10.0 110.461 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 611' ' ' GLY . . . . . 0.443 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 87.79 -45.64 3.36 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.575 -0.821 . . . . 10.0 111.776 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 612' ' ' MET . . . . . 0.443 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.6 OUTLIER 73.36 -56.8 0.65 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.625 0.77 . . . . 10.0 111.912 179.154 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 18.2 mtpp 61.21 80.79 0.25 Allowed Pre-proline 0 N--CA 1.463 0.204 0 O-C-N 123.523 0.515 . . . . 10.0 111.153 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 614' ' ' PRO . . . . . 0.505 ' HA ' ' CE2' ' A' ' 428' ' ' TYR . 32.5 Cg_exo -58.93 106.86 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.018 2.479 . . . . 10.0 112.451 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 120.0 -22.29 8.61 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.921 -0.657 . . . . 10.0 112.009 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -106.1 116.65 32.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.814 0.34 . . . . 10.0 110.1 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -69.14 102.01 1.57 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.873 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 10.5 tp -71.99 -33.09 46.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.174 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 48.14 86.29 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.428 0.691 . . . . 10.0 112.853 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -120.51 96.75 48.95 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.245 179.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.59 -29.49 85.35 Favored 'Trans proline' 0 N--CA 1.476 0.446 0 C-N-CA 123.49 2.793 . . . . 10.0 114.456 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 56.0 p-90 -63.21 -24.44 67.88 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.638 -0.425 . . . . 10.0 111.374 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 95.9 t -65.71 -48.24 83.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 91.3 m -61.1 -38.86 87.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.463 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -35.22 79.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.27 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -68.7 -45.04 72.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.196 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 77.9 mt -66.28 -41.48 89.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.706 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.03 -41.49 92.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.976 0.417 . . . . 10.0 110.75 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -70.07 -38.77 75.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.125 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 630' ' ' ALA . . . . . 0.403 ' O ' HG23 ' A' ' 634' ' ' VAL . . . -61.36 -42.09 98.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.943 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -58.93 -42.21 89.22 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.299 0.571 . . . . 10.0 110.022 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -70.48 -34.81 72.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.563 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -59.47 -38.05 79.77 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.786 0.327 . . . . 10.0 110.327 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 634' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 630' ' ' ALA . 95.1 t -57.09 -52.64 53.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.423 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -73.07 -25.7 61.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.353 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 56.9 m -64.19 -38.27 90.44 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -77.44 -34.93 54.45 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.21 -0.663 . . . . 10.0 109.21 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 28.6 t30 -64.67 -40.51 95.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.088 -0.96 . . . . 10.0 110.606 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.09 -37.7 83.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.75 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 640' ' ' ASP . . . . . 0.502 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 3.4 t70 -62.09 -27.6 69.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.084 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 58.0 mt -81.6 -37.24 15.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.408 -0.589 . . . . 10.0 109.408 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 53.9 mtm-85 -62.02 -38.49 88.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.33 179.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 643' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 14.6 pttm -65.56 -27.16 68.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.958 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -65.44 -41.7 93.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.159 0.504 . . . . 10.0 109.734 179.331 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.98 -41.61 77.67 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.043 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 646' ' ' LEU . . . . . 0.409 ' O ' ' HB2' ' A' ' 650' ' ' ASP . 96.1 mt -61.07 -40.7 94.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.696 -0.683 . . . . 10.0 110.939 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -56.46 -36.37 68.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.101 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -83.8 -41.47 17.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.673 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -70.95 -32.09 68.88 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 650' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 653' ' ' ASN . 0.3 OUTLIER -63.59 -32.58 74.09 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.892 0.377 . . . . 10.0 110.731 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 651' ' ' VAL . . . . . 0.474 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 44.8 t -63.53 -44.08 98.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.382 0.61 . . . . 10.0 109.435 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -73.6 -24.42 60.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.412 -0.813 . . . . 10.0 110.34 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 653' ' ' ASN . . . . . 0.411 ' HB3' ' O ' ' A' ' 650' ' ' ASP . 18.1 t30 -61.83 -51.57 67.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.584 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.84 -43.93 97.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.798 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 655' ' ' GLN . . . . . 0.474 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 29.7 mt-30 -61.89 -44.57 96.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.368 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 16.6 ttp-105 -61.79 -42.89 99.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.124 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 45.3 ttp180 -66.39 -43.19 86.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.656 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.7 -47.11 79.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.125 -0.489 . . . . 10.0 112.014 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.8 tp -67.79 -39.84 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 120.935 -0.306 . . . . 10.0 111.389 -179.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -70.55 -31.19 68.14 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.672 -0.411 . . . . 10.0 110.088 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 27.6 t -61.34 -51.0 70.65 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -59.29 -46.52 88.34 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.34 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -60.11 -43.28 95.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.085 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -74.6 -35.19 62.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.756 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -64.57 -43.01 95.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.874 0.369 . . . . 10.0 110.038 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 79.7 mt -76.42 -17.08 59.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.343 0.592 . . . . 10.0 109.98 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 24.4 tp -76.54 -37.44 56.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.247 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -54.38 28.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.584 -0.735 . . . . 10.0 111.288 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 26.8 m -76.39 149.05 6.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.079 -0.509 . . . . 10.0 111.603 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.61 -24.0 16.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.334 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -83.37 108.63 16.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.273 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 672' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 676' ' ' ILE . 7.9 p -113.59 -3.94 11.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.221 0.534 . . . . 10.0 109.863 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -42.16 72.63 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.338 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.85 -46.74 88.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.916 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 675' ' ' THR . . . . . 0.414 ' O ' HG12 ' A' ' 679' ' ' ILE . 3.8 m -64.26 -48.03 77.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.297 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 676' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 672' ' ' VAL . 48.2 mm -57.29 -43.86 82.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.45 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.81 -40.34 75.99 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.045 -0.262 . . . . 10.0 111.372 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 69.6 m -61.43 -44.07 97.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.573 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 679' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 675' ' ' THR . 45.0 pt -77.26 -23.62 14.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 120.839 -0.344 . . . . 10.0 111.285 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 36.2 ttm-85 -60.4 -46.07 91.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.951 0.405 . . . . 10.0 110.61 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -63.84 -37.84 88.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.744 -0.662 . . . . 10.0 111.014 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -70.29 -47.56 60.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.205 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 683' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 679' ' ' ILE . 75.8 t -59.79 -46.81 93.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.969 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -63.44 -42.72 98.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.482 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.4 tttm -60.54 -50.87 71.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.457 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.81 89.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.908 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 95.5 m -62.84 -46.27 88.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.727 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 95.8 mt -66.29 -41.29 88.79 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 116.58 -0.282 . . . . 10.0 110.381 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -56.61 -29.73 62.46 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.677 0.391 . . . . 10.0 111.921 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -72.97 -23.25 60.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 10.0 112.033 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -111.71 -30.41 7.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.894 0.378 . . . . 10.0 111.184 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 692' ' ' ILE . . . . . 0.617 HG23 ' CD1' ' A' ' 701' ' ' TRP . 86.1 mt -127.84 108.03 20.34 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.454 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.14 132.1 20.52 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.352 2.035 . . . . 10.0 111.001 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -52.04 116.21 2.64 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.633 2.222 . . . . 10.0 112.69 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 63.57 74.06 0.43 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.801 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 17.1 p -135.25 -162.2 1.23 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.557 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 88.9 mt -98.41 159.29 15.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.598 -0.273 . . . . 10.0 110.585 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.41 -38.63 71.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.883 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -67.24 -16.19 64.14 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.96 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 43.0 mtt -92.49 -6.1 50.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.983 0.42 . . . . 10.0 110.482 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 701' ' ' TRP . . . . . 0.617 ' CD1' HG23 ' A' ' 692' ' ' ILE . 46.5 m0 -90.75 103.67 16.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.431 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -80.81 77.96 7.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.364 0.602 . . . . 10.0 110.006 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 703' ' ' ILE . . . . . 0.492 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.5 mm -61.65 -48.09 90.86 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.304 -0.862 . . . . 10.0 111.197 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 704' ' ' PRO . . . . . 0.492 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.2 Cg_exo -55.85 -47.27 25.94 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 121.889 1.726 . . . . 10.0 112.134 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -65.03 -43.01 96.41 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.033 -0.603 . . . . 10.0 112.293 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 61.9 tp -61.63 -46.58 89.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.767 0.318 . . . . 10.0 110.466 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -63.64 -40.46 96.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.788 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -56.52 -41.62 77.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.994 0.426 . . . . 10.0 110.862 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 709' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 709' ' ' ARG . 1.2 tpt180 -75.77 -47.62 25.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.176 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 66.6 mt -60.67 -45.68 93.23 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 44.8 mttt -75.38 -5.88 47.16 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -178.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -116.6 -57.37 2.19 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.09 0.774 . . . . 10.0 113.09 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -89.29 -16.76 30.39 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.929 0.715 . . . . 10.0 112.929 -177.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -108.48 -7.22 15.83 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.14 -0.624 . . . . 10.0 111.603 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.16 27.28 17.07 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.068 0.461 . . . . 10.0 110.786 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 1.9 mp -108.53 100.76 9.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.486 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -86.26 77.25 9.57 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.013 -0.539 . . . . 10.0 109.712 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.64 131.52 21.72 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.346 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 719' ' ' PRO . . . . . 0.501 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 85.4 Cg_endo -83.75 65.81 7.33 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.152 2.568 . . . . 10.0 112.23 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 720' ' ' ILE . . . . . 0.401 ' HA ' ' CE3' ' A' ' 723' ' ' TRP . 52.6 mt -59.53 -43.77 91.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.689 -179.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -66.45 -27.27 67.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.022 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 722' ' ' GLU . . . . . 0.501 ' HB2' ' HB2' ' A' ' 719' ' ' PRO . 1.0 OUTLIER -98.58 27.58 4.74 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.776 -179.581 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 723' ' ' TRP . . . . . 0.401 ' CE3' ' HA ' ' A' ' 720' ' ' ILE . 4.7 m0 -115.41 -47.44 2.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.636 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 94.8 mt -63.84 -21.1 66.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.089 -0.505 . . . . 10.0 112.081 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -78.4 -17.32 56.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.039 0.447 . . . . 10.0 110.613 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -107.39 -29.9 9.0 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.784 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 727' ' ' GLU . . . . . 0.545 ' O ' ' HB2' ' A' ' 730' ' ' LEU . 33.7 mt-10 -123.65 87.35 52.44 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.53 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -63.75 -30.73 69.23 Favored 'Trans proline' 0 CA--C 1.528 0.195 0 C-N-CA 122.577 2.185 . . . . 10.0 112.218 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -91.11 20.11 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.411 -0.358 . . . . 10.0 111.258 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 730' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 727' ' ' GLU . 0.5 OUTLIER -66.75 -30.09 70.22 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.829 -0.434 . . . . 10.0 109.829 178.938 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 32.4 m170 62.44 -167.71 0.2 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.54 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.84 -45.0 6.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.164 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -61.22 -55.12 35.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.636 -0.257 . . . . 10.0 111.154 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 734' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 730' ' ' LEU . 1.3 m -58.27 -32.89 68.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.839 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 37.5 tp -63.56 -42.94 98.31 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 51.7 mtt180 -62.84 -44.85 95.04 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.949 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -62.09 -36.18 80.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.91 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 20.8 mmm-85 -61.08 -50.64 72.45 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.943 -0.391 . . . . 10.0 109.943 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 59.7 mt -60.08 -43.36 92.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.381 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 34.1 tp -63.29 -48.12 79.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.767 -0.651 . . . . 10.0 111.029 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.18 -40.21 95.62 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.869 0.366 . . . . 10.0 111.014 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -39.36 93.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.919 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 743' ' ' SER . . . . . 0.41 ' O ' ' HB2' ' A' ' 747' ' ' TYR . 48.3 p -61.27 -38.3 86.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.76 0.314 . . . . 10.0 110.444 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 58.2 mt -70.2 -41.89 78.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.192 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -60.87 -46.59 90.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.553 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 87.6 t -69.49 -37.27 74.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.433 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 747' ' ' TYR . . . . . 0.41 ' HB2' ' O ' ' A' ' 743' ' ' SER . 20.8 t80 -61.04 -51.95 67.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.341 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 748' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 93.1 mt-30 -63.84 -28.05 69.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.438 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -46.03 79.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.847 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -67.13 -33.6 75.79 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.154 -0.476 . . . . 10.0 109.824 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.44 -25.24 67.87 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.367 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 752' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 85.5 mt-10 -62.15 -24.8 67.39 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.895 0.332 . . . . 10.0 111.895 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 1.7 t -102.59 4.93 10.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.266 0.555 . . . . 10.0 110.611 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 47.8 t -113.64 -49.68 5.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.17 145.82 6.96 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.047 -0.821 . . . . 10.0 111.047 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 756' ' ' ALA . . . . . 0.471 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -59.98 -66.25 0.55 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.056 0.428 . . . . 10.0 111.785 -178.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.48 -27.48 66.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.068 0.461 . . . . 10.0 110.742 -179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.5 tpt -66.56 -46.91 74.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.876 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 759' ' ' MET . . . . . 0.404 ' O ' ' HG3' ' A' ' 763' ' ' GLU . 12.4 tpt -62.39 -38.66 90.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.556 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.9 mmp_? -59.13 -35.11 72.9 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.267 0.556 . . . . 10.0 110.41 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -69.96 -38.41 76.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.581 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -65.51 -44.93 85.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.085 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 763' ' ' GLU . . . . . 0.446 ' HA ' HD21 ' A' ' 826' ' ' LEU . 84.9 mt-10 -58.95 -49.29 78.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.857 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -59.74 -42.97 94.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.306 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.89 -46.82 92.79 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.946 -0.645 . . . . 10.0 112.011 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.15 -42.09 91.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-O 120.686 0.279 . . . . 10.0 110.637 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 23.7 mtp -59.09 -48.47 81.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.606 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.7 -44.94 92.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.53 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 -59.35 -46.26 89.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.115 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 9.2 m -65.74 -39.94 91.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.974 0.416 . . . . 10.0 110.416 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.2 tt -61.46 -49.88 75.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.942 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -64.29 -30.98 72.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.934 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 7.8 t -64.69 -52.67 55.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.214 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 71.4 mt -72.79 -26.96 61.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.245 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 9.3 t-105 -60.5 -47.01 88.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.621 -0.263 . . . . 10.0 110.835 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -69.96 -31.34 69.02 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.768 -0.373 . . . . 10.0 110.337 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.24 -47.16 74.66 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 38.1 t60 -60.06 -40.46 89.54 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.69 -1.141 . . . . 10.0 110.64 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 19.7 mt -63.46 -46.77 84.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.537 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -65.69 -43.29 89.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.382 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.57 -46.43 89.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.03 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 50.8 mmm -63.1 -41.58 99.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.762 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.21 -46.95 86.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.828 0.347 . . . . 10.0 110.52 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -65.24 -38.81 91.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.03 0.443 . . . . 10.0 110.458 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 15.8 tp -67.4 -38.89 85.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.468 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -57.06 -42.51 80.73 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.63 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 . . . . . 0 C--N 1.326 -0.418 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.388 -179.402 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo . . . . . 0 CA--C 1.529 0.241 0 N-CA-C 113.314 0.467 . . . . 10.0 113.314 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 22.1 mtmm -90.88 -49.6 6.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.947 0.403 . . . . 10.0 110.022 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -65.07 -39.46 93.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.104 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -65.9 -41.97 90.8 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -59.83 -37.03 78.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.479 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -67.01 -25.7 66.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.466 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 44.9 ttp85 -80.16 -47.95 13.92 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -58.1 -43.46 87.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.644 -0.707 . . . . 10.0 111.048 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 3.9 p -66.86 -37.73 85.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.265 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -66.11 -48.44 70.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.555 -0.293 . . . . 10.0 110.416 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 15.0 m -63.11 -34.78 78.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.092 0.472 . . . . 10.0 110.169 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 35.0 ttm -66.78 -36.48 82.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.86 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -70.55 -44.08 68.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.334 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -59.67 -47.07 87.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.385 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.64 81.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.799 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 23.6 ttp -62.78 -36.25 82.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.447 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 95.7 mt -71.88 -30.02 64.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.479 . . . . 10.0 109.876 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 816' ' ' GLU . . . . . 0.475 ' HA ' ' CE ' ' A' ' 819' ' ' LYS . 74.4 mm-40 -69.8 -45.14 68.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.474 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 1.3 p -70.11 -28.73 65.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.615 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 818' ' ' LEU . . . . . 0.41 ' O ' HG23 ' A' ' 822' ' ' VAL . 58.8 tp -56.7 -63.15 1.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.705 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 819' ' ' LYS . . . . . 0.475 ' CE ' ' HA ' ' A' ' 816' ' ' GLU . 31.0 pttt -62.31 -32.8 73.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.797 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -60.91 -59.22 5.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.271 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -66.42 -32.58 74.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.309 -0.405 . . . . 10.0 111.584 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 822' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 818' ' ' LEU . 20.3 t -60.87 -53.25 51.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-O 120.792 0.33 . . . . 10.0 110.211 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 33.7 mm -65.36 -37.46 80.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.42 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 45.5 t -58.44 -57.88 10.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.229 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 22.1 m -59.19 -42.61 91.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.377 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 826' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 763' ' ' GLU . 68.2 mt -65.39 -43.26 91.26 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -178.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 4.9 m -75.03 -26.06 59.2 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.974 0.416 . . . . 10.0 111.059 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -87.06 11.95 12.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.451 0.538 . . . . 10.0 112.451 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.8 p -64.17 128.98 27.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -101.69 115.26 30.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.035 0.445 . . . . 10.0 111.15 -179.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 4.4 m . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.607 179.59 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.703 0.287 . . . . 10.0 110.773 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 109.76 -168.43 13.18 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.117 -0.563 . . . . 10.0 111.94 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.428 ' H ' ' HD2' ' A' ' 16' ' ' ARG . 0.3 OUTLIER -57.0 140.38 49.16 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.942 0.401 . . . . 10.0 110.452 179.472 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.456 ' HD2' ' OD1' ' A' ' 408' ' ' ASP . 16.9 mmt85 -88.98 164.15 15.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.696 -178.143 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.9 t30 64.84 -88.4 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.167 -0.924 . . . . 10.0 112.652 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -55.52 -60.07 3.94 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.825 0.676 . . . . 10.0 112.825 -177.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.428 ' HD2' ' H ' ' A' ' 12' ' ' SER . 11.7 ttt85 -63.56 -38.13 89.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.668 -0.242 . . . . 10.0 111.437 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -57.85 -51.54 69.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.739 0.304 . . . . 10.0 110.982 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.4 mt -64.72 -35.38 80.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.203 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.7 ttp-105 -66.87 -44.42 80.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.807 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -39.47 90.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.149 0.499 . . . . 10.0 110.133 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.465 ' O ' HG23 ' A' ' 25' ' ' VAL . 55.4 mtt -71.84 -28.28 63.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.644 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -29.96 69.09 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.366 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -71.07 -39.92 71.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.714 -0.675 . . . . 10.0 109.584 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.1 t -65.84 -38.44 82.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.62 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.647 HG13 HD12 ' A' ' 88' ' ' LEU . 98.7 t -58.79 -37.42 66.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.233 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -63.4 -41.34 98.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.431 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.1 mt -62.32 -44.65 99.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.079 0.466 . . . . 10.0 109.885 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' A' ' 65' ' ' PRO . 48.8 mt -62.66 -44.57 99.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.341 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -63.35 -38.77 92.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.787 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.483 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -75.01 -26.06 59.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.477 -0.328 . . . . 10.0 111.531 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 15.9 ttt -84.25 -12.55 54.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.066 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.504 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 7.1 tt0 -57.2 -51.96 77.74 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 116.371 -0.377 . . . . 10.0 111.34 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.504 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 61.1 Cg_exo -54.11 -30.64 61.34 Favored 'Trans proline' 0 C--N 1.363 1.296 0 C-N-CA 122.207 1.938 . . . . 10.0 112.429 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -70.13 -44.24 69.33 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 23.3 mmt -66.92 -31.07 71.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.749 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -63.06 -20.36 65.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.902 0.382 . . . . 10.0 111.0 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.6 mtmt -96.42 1.55 51.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.566 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 mp -100.14 148.85 24.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.095 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.4 p -81.66 166.81 19.82 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -58.58 -38.74 78.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.965 0.412 . . . . 10.0 110.999 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -68.89 -33.14 73.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.977 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -68.55 -35.65 77.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.836 0.35 . . . . 10.0 110.144 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.3 mt -66.58 -46.97 74.24 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -60.64 -33.75 73.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.338 -0.846 . . . . 10.0 110.305 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.64 -33.25 86.72 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 115.538 -0.755 . . . . 10.0 111.873 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -69.09 -36.87 78.06 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.5 m -60.07 -46.25 90.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.946 0.403 . . . . 10.0 110.221 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.37 -34.93 79.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.932 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -62.26 -45.04 95.09 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.995 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -60.36 -42.57 96.03 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.102 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -58.35 -38.23 76.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.872 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.89 -40.38 32.52 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.967 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -60.51 -40.49 91.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.571 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 32.2 mt -63.94 -20.9 66.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.707 0.289 . . . . 10.0 111.62 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -106.34 9.85 31.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.07 0.462 . . . . 10.0 110.857 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -117.52 -50.29 2.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.365 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 168.57 64.51 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.602 -0.809 . . . . 10.0 112.309 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -144.35 149.42 36.12 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.42 ' HB ' ' HB2' ' A' ' 62' ' ' ASN . 4.7 t -97.3 142.53 14.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.52 -179.372 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 39.1 tp -61.3 -47.14 87.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.945 0.403 . . . . 10.0 111.238 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -73.82 1.35 10.74 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.265 -0.425 . . . . 10.0 111.45 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.42 ' HB2' ' HB ' ' A' ' 59' ' ' VAL . 65.6 t30 -105.54 -11.05 16.54 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.311 0.577 . . . . 10.0 109.839 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.6 mt -93.56 -4.64 50.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.798 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.454 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 73.9 mt -49.58 -56.64 15.53 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 115.806 -0.634 . . . . 10.0 112.62 -179.285 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 64' ' ' ILE . 11.3 Cg_endo -54.32 -47.28 27.78 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.34 2.027 . . . . 10.0 113.474 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -71.44 -42.96 67.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.84 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.422 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -65.64 -48.25 72.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.898 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -63.72 -31.55 72.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.512 -0.313 . . . . 10.0 111.11 -179.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.45 -44.73 93.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.832 0.348 . . . . 10.0 110.288 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 81.9 t -62.82 -43.93 99.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.442 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 67' ' ' ALA . 40.4 t -64.06 -44.34 97.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.835 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.497 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 1.1 ttm180 -59.01 -39.73 82.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.843 0.354 . . . . 10.0 110.212 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.8 tp10 -68.45 -49.81 57.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.664 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.28 -30.75 69.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.654 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.6 m -57.79 -40.6 80.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.505 -0.316 . . . . 10.0 111.392 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.0 mtmt -77.65 -17.86 57.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.699 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -95.65 -29.92 14.05 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.938 0.348 . . . . 10.0 111.938 -178.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 64.9 t -94.31 -55.51 6.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.618 0.246 . . . . 10.0 111.458 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -90.95 -40.84 11.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.88 0.371 . . . . 10.0 111.039 -179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.45 9.94 34.71 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.681 -0.771 . . . . 10.0 111.94 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.1 mtt -122.83 151.72 41.41 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.459 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 11.7 ttp180 -98.79 138.48 35.88 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.979 0.418 . . . . 10.0 111.192 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.02 110.89 4.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.584 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -56.9 156.88 6.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.299 0.571 . . . . 10.0 112.003 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.38 -38.17 79.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.229 -0.896 . . . . 10.0 111.182 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.77 -31.64 51.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.839 0.352 . . . . 10.0 111.082 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -67.08 -34.04 76.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.647 HD12 HG13 ' A' ' 25' ' ' VAL . 80.9 mt -65.82 -36.16 82.69 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.415 ' O ' HG23 ' A' ' 93' ' ' VAL . 62.6 mt -66.46 -49.62 66.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.705 178.461 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.449 ' O ' ' HG ' ' A' ' 94' ' ' LEU . . . -60.12 -43.85 97.91 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.842 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.26 -32.75 85.22 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.03 -0.605 . . . . 10.0 112.096 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 8.7 ttm -69.2 -42.11 76.21 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.901 -0.407 . . . . 10.0 109.901 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 89' ' ' LEU . 85.2 t -65.9 -36.42 77.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.656 -0.702 . . . . 10.0 110.071 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 90' ' ' GLY . 79.9 mt -68.14 -8.83 41.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.734 -0.666 . . . . 10.0 111.993 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -81.36 -20.68 40.09 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.499 0.666 . . . . 10.0 109.236 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -102.18 174.56 5.87 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.315 -0.857 . . . . 10.0 110.236 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -83.63 67.88 9.62 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.308 0.575 . . . . 10.0 109.564 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 16.4 m -141.01 161.77 37.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.4 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.651 HD11 HD13 ' A' ' 407' ' ' LEU . 44.0 mm -103.17 131.0 52.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.734 179.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -110.06 122.97 48.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.891 0.377 . . . . 10.0 111.793 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.62 ' CD ' ' HA ' ' A' ' 393' ' ' THR . 42.5 tt0 -94.72 130.08 41.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.134 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 41.6 mtm -145.34 176.94 9.19 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.707 0.289 . . . . 10.0 110.78 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.496 ' HB2' ' HG2' ' A' ' 106' ' ' GLU . 16.9 mmm180 -105.76 175.77 5.39 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.808 -0.442 . . . . 10.0 109.808 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 18.9 p -77.2 -36.65 54.69 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.757 0.313 . . . . 10.0 111.821 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -72.55 -9.4 73.81 Favored Glycine 0 N--CA 1.453 -0.23 0 CA-C-N 116.08 -0.509 . . . . 10.0 113.888 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.496 ' HG2' ' HB2' ' A' ' 103' ' ' ARG . 3.2 mm-40 -90.86 -1.29 57.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.226 0.513 . . . . 10.0 110.6 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.94 62.16 4.44 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.381 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -52.94 -45.54 67.74 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 111.884 0.327 . . . . 10.0 111.884 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -33.97 76.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.707 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 25.5 tp -70.46 -28.98 65.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.936 0.398 . . . . 10.0 110.494 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 64.8 m -70.81 -30.24 66.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.327 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.17 -15.94 63.56 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.3 0.852 . . . . 10.0 113.3 -178.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 41.1 p -72.41 -25.4 61.47 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.403 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 31.1 mt -68.18 -57.26 9.37 Favored Pre-proline 0 CA--C 1.537 0.478 0 N-CA-C 112.411 0.523 . . . . 10.0 112.411 -178.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.403 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 30.1 Cg_endo -62.38 -31.42 81.27 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 121.994 1.796 . . . . 10.0 111.85 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.67 -49.48 68.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.431 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.471 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 59.1 t80 -62.5 -45.74 91.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.961 0.41 . . . . 10.0 110.66 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 62.8 tp -59.77 -49.36 78.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.668 -0.697 . . . . 10.0 111.616 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -72.41 -26.43 61.86 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.433 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -66.13 -26.08 67.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.7 0.286 . . . . 10.0 111.137 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 60.7 mt -60.71 -21.25 62.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.75 -179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.7 p -79.92 -17.31 53.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.704 0.288 . . . . 10.0 111.027 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.53 6.83 59.59 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.099 -0.572 . . . . 10.0 112.802 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.92 -24.08 44.31 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.857 -0.202 . . . . 10.0 111.326 -179.102 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 109.21 123.85 4.81 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.342 -0.932 . . . . 10.0 113.546 179.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 68.9 t -102.15 119.05 49.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -99.73 107.13 19.13 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.894 0.378 . . . . 10.0 110.806 -179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 64.0 t -96.27 122.03 47.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.242 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 26.5 t -102.02 110.0 27.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.527 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.52 162.31 13.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.528 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.429 ' HA ' HD11 ' A' ' 214' ' ' ILE . 4.4 m -67.23 -40.42 84.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 111.876 0.324 . . . . 10.0 111.876 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -145.41 161.07 40.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.359 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -64.68 -24.61 67.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.892 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -59.18 -55.85 29.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.474 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 89.8 mt -73.68 -31.49 63.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.512 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.85 -52.0 67.28 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.696 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -33.8 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.417 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -59.17 -57.15 14.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.488 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.32 -29.65 67.53 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.518 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.533 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -60.24 -41.64 93.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.811 0.339 . . . . 10.0 110.69 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -89.16 -25.33 21.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.337 -0.392 . . . . 10.0 111.329 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -75.56 -43.28 49.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.79 0.329 . . . . 10.0 111.466 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.7 m-20 -90.35 -1.92 57.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.936 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.533 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 59.2 ttm-85 -60.44 -48.83 92.68 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 116.102 -0.499 . . . . 10.0 112.084 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' PRO . . . . . 0.59 ' O ' ' HB2' ' A' ' 149' ' ' PHE . 34.1 Cg_exo -61.86 -12.69 26.82 Favored 'Trans proline' 0 C--N 1.359 1.092 0 C-N-CA 122.083 1.855 . . . . 10.0 112.946 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.3 tp -88.52 -53.96 4.41 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.982 0.42 . . . . 10.0 110.322 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -70.89 -42.79 69.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.868 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.43 -10.13 59.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.803 0.335 . . . . 10.0 111.54 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.59 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 19.1 t80 -83.97 -26.01 29.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.365 0.603 . . . . 10.0 109.714 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 37.4 mt -95.47 -8.19 36.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.434 -0.803 . . . . 10.0 110.805 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 106.28 15.31 18.02 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.619 -0.8 . . . . 10.0 113.634 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 90.0 mt -101.84 136.76 41.12 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.15 0.475 . . . . 10.0 109.903 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.8 p -90.6 130.18 36.66 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.062 0.458 . . . . 10.0 111.298 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.447 HG21 ' HA ' ' A' ' 144' ' ' ARG . 61.4 t -102.46 120.06 51.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.379 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -111.54 139.63 15.68 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.746 -0.74 . . . . 10.0 111.701 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.2 tp -117.28 130.21 72.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.833 0.349 . . . . 10.0 110.125 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -115.26 129.75 56.72 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.11 -0.495 . . . . 10.0 109.913 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 66.0 mt -121.61 147.8 48.83 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.362 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' PRO . . . . . 0.526 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 17.9 Cg_endo -59.92 102.11 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.212 2.608 . . . . 10.0 112.658 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 110.72 4.03 28.33 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.695 -0.764 . . . . 10.0 112.611 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' MET . . . . . 0.481 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 48.1 ttm -64.33 138.97 97.6 Favored Pre-proline 0 C--N 1.327 -0.394 0 C-N-CA 122.254 0.222 . . . . 10.0 110.696 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -52.06 144.32 37.75 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.801 2.334 . . . . 10.0 112.601 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' ALA . . . . . 0.454 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.77 -48.34 93.79 Favored Pre-proline 0 CA--C 1.54 0.586 0 N-CA-C 113.054 0.761 . . . . 10.0 113.054 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.8 Cg_exo -55.51 -41.57 76.58 Favored 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 121.935 1.757 . . . . 10.0 112.39 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -69.16 -39.89 78.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.642 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.481 ' HE2' ' O ' ' A' ' 161' ' ' MET . 58.7 mttm -58.78 -45.12 90.56 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.33 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -59.94 -29.26 68.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.625 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -78.8 -43.63 24.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.919 0.39 . . . . 10.0 110.288 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.7 -38.47 91.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.377 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -78.11 -26.63 48.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.307 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.22 -11.29 59.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.178 0.513 . . . . 10.0 110.424 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -70.84 177.94 3.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.591 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 173' ' ' ASP . . . . . 0.433 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 19.1 m-20 -76.18 -46.31 29.08 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.597 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 49.2 mt -127.49 125.95 66.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.207 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.9 m -111.46 126.87 55.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.408 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -103.33 137.17 41.82 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -179.19 177.19 48.31 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.368 -0.92 . . . . 10.0 112.727 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -93.7 158.86 15.47 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.713 0.292 . . . . 10.0 110.835 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -68.37 -32.65 72.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.816 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -59.68 -53.93 52.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.123 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.526 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.9 tp10 -68.13 -35.6 78.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.768 0.318 . . . . 10.0 110.661 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -54.85 -42.93 72.59 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.286 -0.416 . . . . 10.0 111.005 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -72.84 -41.0 50.95 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.844 -0.694 . . . . 10.0 112.147 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -64.94 -37.39 87.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 10.0 110.464 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 185' ' ' ASP . . . . . 0.457 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 15.1 m-20 -62.3 -41.76 98.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.021 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -62.13 -41.84 98.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.666 -0.697 . . . . 10.0 110.051 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 187' ' ' LEU . . . . . 0.469 ' O ' ' HB2' ' A' ' 191' ' ' MET . 67.8 mt -62.35 -45.19 94.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.828 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 58.3 mtm-85 -67.91 -38.94 83.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.888 0.375 . . . . 10.0 110.885 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -62.82 -50.95 68.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.76 -0.655 . . . . 10.0 111.618 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.22 1.66 20.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.569 0.581 . . . . 10.0 112.569 -178.262 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 191' ' ' MET . . . . . 0.469 ' HB2' ' O ' ' A' ' 187' ' ' LEU . 23.1 ttp -106.52 2.84 26.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.048 0.451 . . . . 10.0 110.568 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 197' ' ' GLU . . . -73.3 167.67 20.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.199 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -105.56 -29.77 9.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.126 0.488 . . . . 10.0 110.004 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.12 144.88 35.7 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.813 179.091 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.77 -24.87 74.66 Favored 'Trans proline' 0 CA--C 1.527 0.163 0 C-N-CA 122.364 2.042 . . . . 10.0 112.629 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 45.1 mp0 -75.29 -10.44 59.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.361 -0.381 . . . . 10.0 111.384 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.465 ' HB2' ' HB1' ' A' ' 192' ' ' ALA . 46.1 mt-10 -89.03 -3.27 58.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.778 0.323 . . . . 10.0 110.544 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 198' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 198' ' ' ARG . 30.5 mtt85 -61.42 158.67 14.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.569 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 4.8 m -136.32 -18.41 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.756 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -88.81 177.87 6.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.15 0.5 . . . . 10.0 111.085 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -137.44 176.6 8.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.462 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.7 tmtm? -60.01 126.95 29.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.277 0.56 . . . . 10.0 111.143 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 203' ' ' LEU . . . . . 0.411 HD22 ' CZ ' ' A' ' 384' ' ' TYR . 14.2 mt -80.47 91.08 5.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.528 -0.76 . . . . 10.0 109.691 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 78.7 t60 -99.91 -63.28 1.14 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.295 -0.412 . . . . 10.0 111.082 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -128.54 138.06 52.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.139 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.497 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -133.37 129.55 37.58 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.476 -0.783 . . . . 10.0 109.659 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 45.7 tp -119.53 110.53 17.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.167 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 2.4 p -92.43 126.22 44.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.521 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -58.26 -65.58 0.62 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.617 -0.72 . . . . 10.0 111.269 -179.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 210' ' ' GLU . . . . . 0.474 ' CD ' HH21 ' A' ' 509' ' ' ARG . 0.5 OUTLIER -112.64 113.91 26.28 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.923 0.392 . . . . 10.0 110.745 -179.83 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.649 HG11 HD12 ' A' ' 99' ' ' ILE . 27.6 m -76.56 -14.13 14.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.041 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 212' ' ' ASP . . . . . 0.535 ' OD2' ' HD3' ' A' ' 566' ' ' ARG . 1.1 m-20 -45.91 -78.17 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 124.061 0.851 . . . . 10.0 112.247 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.34 -47.09 9.68 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.455 -0.793 . . . . 10.0 112.17 -178.294 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 214' ' ' ILE . . . . . 0.433 ' HA ' ' HG3' ' A' ' 218' ' ' GLU . 53.2 mt -53.25 -31.89 18.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 N-CA-C 113.876 1.065 . . . . 10.0 113.876 -177.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 215' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 215' ' ' LEU . 10.6 mt -106.26 -58.46 1.92 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 39.1 mm -68.22 -54.46 21.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 113.207 0.817 . . . . 10.0 113.207 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -73.27 -45.04 58.11 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.798 0.666 . . . . 10.0 112.798 -177.319 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 218' ' ' GLU . . . . . 0.433 ' HG3' ' HA ' ' A' ' 214' ' ' ILE . 5.2 mm-40 -73.45 1.7 9.25 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.36 0.504 . . . . 10.0 112.36 -178.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.47 -25.37 68.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.689 0.281 . . . . 10.0 111.73 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 220' ' ' ARG . . . . . 0.478 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -114.31 19.38 16.33 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.069 -0.253 . . . . 10.0 111.306 -179.241 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 5.6 m -97.45 106.28 31.48 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 120.951 -0.3 . . . . 10.0 110.605 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 222' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 81.7 Cg_endo -92.84 131.46 0.93 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.925 2.417 . . . . 10.0 113.202 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 223' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 374' ' ' SER . 47.6 mt -85.56 124.02 31.64 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 83.3 mt -117.68 130.67 72.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.787 0.327 . . . . 10.0 111.663 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 20.8 pt . . . . . 0 C--N 1.329 -0.285 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 178.452 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 374' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 4.2 t -153.33 152.92 31.66 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.763 0.316 . . . . 10.0 110.519 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 14.4 tt -156.9 140.51 7.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.47 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.91 147.77 22.56 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.424 178.668 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -59.44 -37.97 79.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.478 0.18 . . . . 10.0 111.301 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 378' ' ' GLN . . . . . 0.486 HE21 HG23 ' A' ' 404' ' ' ILE . 1.5 tm0? -59.84 -39.04 83.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.305 0.574 . . . . 10.0 110.12 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -82.96 -2.49 55.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.344 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -101.12 -46.13 5.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.278 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -70.31 -20.66 62.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.169 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 42.8 mtp180 -76.54 -9.05 58.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.805 0.336 . . . . 10.0 111.031 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 80.3 mt -83.25 -19.56 36.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.016 0.436 . . . . 10.0 110.001 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 384' ' ' TYR . . . . . 0.497 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 49.1 m-85 -77.39 141.45 39.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.304 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -71.17 -67.61 0.5 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.154 0.502 . . . . 10.0 110.235 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -100.75 102.32 13.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.169 0.509 . . . . 10.0 110.039 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 50.1 tp -111.05 115.72 29.93 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.879 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -121.3 158.21 28.68 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.104 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -154.52 158.28 28.13 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.198 -1.001 . . . . 10.0 112.61 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 39.6 mtm -115.47 154.79 28.66 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 391' ' ' THR . . . . . 0.465 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 14.7 t -149.94 159.52 44.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.533 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -88.49 157.83 28.13 Favored Glycine 0 N--CA 1.441 -1.016 0 N-CA-C 109.99 -1.244 . . . . 10.0 109.99 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 393' ' ' THR . . . . . 0.62 ' HA ' ' CD ' ' A' ' 101' ' ' GLU . 9.5 m -56.69 99.99 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.11 0.455 . . . . 10.0 111.218 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 394' ' ' ALA . . . . . 0.519 ' HA ' HD22 ' A' ' 569' ' ' ASN . . . -160.11 -27.96 0.06 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.816 -0.629 . . . . 10.0 112.037 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 6.7 t70 59.26 -95.27 0.05 Allowed 'General case' 0 N--CA 1.474 0.729 0 O-C-N 123.326 0.391 . . . . 10.0 110.499 -179.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 5.7 m 55.97 -105.6 0.28 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.045 0.757 . . . . 10.0 113.045 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -84.24 25.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.118 0.414 . . . . 10.0 112.118 -177.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 398' ' ' ALA . . . . . 0.523 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -67.69 -31.02 70.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.9 0.381 . . . . 10.0 110.858 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -65.99 -18.61 65.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.587 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -83.41 -19.67 35.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.682 -0.235 . . . . 10.0 111.235 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 401' ' ' PHE . . . . . 0.523 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 17.5 m-85 -60.56 -42.02 95.74 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.909 0.337 . . . . 10.0 111.909 -179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 6.8 m -70.39 -19.87 62.98 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.423 0.527 . . . . 10.0 112.423 -178.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 26.7 m -98.82 -43.68 6.67 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.998 0.37 . . . . 10.0 111.998 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 404' ' ' ILE . . . . . 0.486 HG23 HE21 ' A' ' 378' ' ' GLN . 60.4 mt -77.87 -62.01 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 112.843 0.683 . . . . 10.0 112.843 -178.083 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 405' ' ' TYR . . . . . 0.434 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 81.9 m-85 -97.36 -2.7 41.83 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -177.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt 62.73 48.1 4.37 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.161 0.505 . . . . 10.0 110.427 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 407' ' ' LEU . . . . . 0.651 HD13 HD11 ' A' ' 99' ' ' ILE . 16.2 mt -113.2 142.08 46.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.028 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 408' ' ' ASP . . . . . 0.456 ' OD1' ' HD2' ' A' ' 13' ' ' ARG . 9.5 t0 -80.79 166.09 21.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.599 0.238 . . . . 10.0 110.602 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 2.0 m -118.42 109.18 15.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.717 0.294 . . . . 10.0 110.953 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 42.1 t -121.6 115.91 47.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.966 0.412 . . . . 10.0 110.918 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 53.3 t -83.99 108.67 16.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.017 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 58.6 t -79.15 130.47 69.28 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.927 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.21 146.46 81.43 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.49 2.127 . . . . 10.0 111.507 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 74.3 p -89.14 149.34 23.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.809 0.337 . . . . 10.0 111.136 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -83.65 -28.16 28.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 178.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -97.87 128.26 34.57 Favored Pre-proline 0 N--CA 1.448 -0.573 0 CA-C-N 114.765 -1.107 . . . . 10.0 109.13 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.36 124.91 12.19 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.62 2.213 . . . . 10.0 113.451 -178.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 48.9 mtm -90.26 82.1 6.03 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.527 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 419' ' ' ILE . . . . . 0.444 HG13 ' HA ' ' A' ' 581' ' ' ALA . 5.9 pt -92.31 42.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.118 -179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 420' ' ' ARG . . . . . 0.558 ' HA ' ' O ' ' A' ' 581' ' ' ALA . 38.5 ttp180 -73.83 137.46 43.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.413 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 583' ' ' SER . 83.0 mttt -93.38 95.65 9.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.248 0.547 . . . . 10.0 110.398 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -80.26 125.33 29.74 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.51 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 89.9 mt -109.43 152.08 42.5 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.259 -0.428 . . . . 10.0 109.951 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.77 160.14 42.1 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.586 2.19 . . . . 10.0 112.895 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -81.72 119.6 24.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.568 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 426' ' ' LEU . 12.6 mt -99.87 102.75 14.25 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.241 0.543 . . . . 10.0 110.661 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 427' ' ' VAL . . . . . 0.534 HG23 HG11 ' A' ' 623' ' ' VAL . 6.0 t -94.65 125.49 47.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.817 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 428' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' A' ' 590' ' ' MET . 2.7 m-85 -104.29 179.86 4.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.636 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 28.4 mmm -73.54 -76.78 0.12 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.682 0.277 . . . . 10.0 111.383 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 64.4 p -88.26 159.75 17.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.971 0.415 . . . . 10.0 111.389 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.79 -31.5 70.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.624 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -61.63 -38.05 86.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.93 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 433' ' ' GLU . . . . . 0.443 ' HG2' ' HG3' ' A' ' 614' ' ' PRO . 31.8 mt-10 -65.58 -39.42 91.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.039 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -59.53 -48.5 81.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.948 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 435' ' ' ILE . . . . . 0.529 ' O ' HG12 ' A' ' 439' ' ' ILE . 41.1 mm -61.81 -43.38 97.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.458 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -56.67 -44.7 81.66 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.709 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.36 -38.91 91.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.732 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 438' ' ' ILE . . . . . 0.441 ' O ' HG13 ' A' ' 442' ' ' ILE . 92.4 mt -62.47 -49.91 81.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.658 179.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 439' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 435' ' ' ILE . 47.9 mm -58.45 -43.25 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.268 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -63.13 -44.81 94.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.717 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 441' ' ' ASP . . . . . 0.612 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 14.1 t70 -63.56 -44.88 92.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.775 0.321 . . . . 10.0 110.326 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.487 HG12 HG11 ' A' ' 452' ' ' VAL . 54.8 mt -59.9 -42.17 88.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.378 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -57.3 -42.8 82.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.5 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -41.71 98.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.408 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.612 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 15.7 mmt180 -68.25 -39.63 82.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.485 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 13.3 m -62.94 -37.15 85.88 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.773 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.12 71.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.035 -0.529 . . . . 10.0 111.363 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 47.7 mttp -85.48 -19.4 31.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.215 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 89.41 33.55 9.29 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.67 -0.776 . . . . 10.0 111.321 -178.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 450' ' ' GLN . . . . . 0.54 ' OE1' ' HD2' ' A' ' 445' ' ' ARG . 60.2 tt0 -105.37 129.58 24.51 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 120.432 0.158 . . . . 10.0 110.836 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.28 141.71 63.66 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.683 2.255 . . . . 10.0 111.462 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 452' ' ' VAL . . . . . 0.487 HG11 HG12 ' A' ' 442' ' ' ILE . 51.7 t -121.94 128.11 75.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.396 -178.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 57.1 tp -115.07 109.1 17.55 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 18.9 t -95.93 127.93 47.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.358 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -110.26 109.86 2.74 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.887 -0.673 . . . . 10.0 112.391 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 456' ' ' THR . . . . . 0.402 ' HG1' ' HA ' ' A' ' 504' ' ' THR . 15.9 p -105.06 146.84 28.56 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.397 -0.223 . . . . 10.0 110.397 179.72 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 24.3 pt -94.13 -17.66 7.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.829 0.347 . . . . 10.0 111.294 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 23.2 m -130.75 137.85 49.68 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.339 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 39.4 mt -60.4 -32.24 50.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.091 0.472 . . . . 10.0 110.886 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.67 -33.74 71.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.712 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 -33.8 47.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.512 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.3 m -61.33 -43.74 98.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.545 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -68.62 -36.79 79.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.16 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.48 -53.71 50.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.81 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 10.2 p -65.04 -32.7 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 120.775 0.321 . . . . 10.0 110.322 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 47.0 t -65.0 -43.49 92.37 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.464 -0.569 . . . . 10.0 109.464 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -60.4 -49.38 77.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.661 -0.699 . . . . 10.0 110.294 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 468' ' ' GLU . . . . . 0.51 ' HG3' HG21 ' A' ' 435' ' ' ILE . 10.7 mm-40 -62.16 -38.89 90.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.706 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 24.0 mt -63.16 -38.15 90.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.078 0.466 . . . . 10.0 110.279 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.1 m -72.09 -34.38 68.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.762 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -63.57 -36.91 85.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.437 -0.801 . . . . 10.0 110.004 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -79.45 -30.78 42.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.743 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 97.91 34.31 5.49 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.955 -0.641 . . . . 10.0 112.281 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 70.6 mt -102.71 127.98 55.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.641 0.258 . . . . 10.0 110.849 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -63.63 129.31 39.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.141 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -155.38 153.74 30.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.832 0.349 . . . . 10.0 111.195 -179.224 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -130.48 132.87 45.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.033 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 478' ' ' VAL . . . . . 0.456 HG22 HD12 ' A' ' 502' ' ' ILE . 19.2 t -100.03 130.0 49.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.356 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 36.6 mt -75.76 94.17 3.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.856 0.36 . . . . 10.0 110.574 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -78.66 108.13 11.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.636 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -65.2 -7.69 13.98 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.888 0.699 . . . . 10.0 112.888 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -88.05 -11.44 47.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.988 0.423 . . . . 10.0 110.254 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -126.66 90.95 3.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.036 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -60.72 -30.67 70.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.3 -179.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.97 -37.25 87.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.069 0.461 . . . . 10.0 109.939 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.66 -38.71 64.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.431 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -52.32 -60.91 2.65 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.692 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -59.63 -36.67 76.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.243 -0.89 . . . . 10.0 111.953 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.41 86.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.876 0.37 . . . . 10.0 111.529 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 83.1 mt -70.91 -45.99 70.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.241 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 71.6 t -58.88 -35.26 55.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 120.836 0.351 . . . . 10.0 111.305 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -59.29 -33.21 70.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.998 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -121.11 24.37 10.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.642 0.258 . . . . 10.0 111.165 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.77 -19.38 62.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.042 0.449 . . . . 10.0 111.198 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -97.88 14.44 62.81 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.858 -0.687 . . . . 10.0 112.023 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -73.4 143.04 82.23 Favored Pre-proline 0 C--N 1.327 -0.407 0 N-CA-C 110.07 -0.345 . . . . 10.0 110.07 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.98 123.8 14.01 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.591 2.194 . . . . 10.0 113.167 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.8 17.65 7.59 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -91.8 113.71 26.05 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.017 0.437 . . . . 10.0 110.315 179.065 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 33.0 t -92.3 112.05 25.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.598 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 12.0 m -108.35 131.62 54.56 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.526 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 502' ' ' ILE . . . . . 0.456 HD12 HG22 ' A' ' 478' ' ' VAL . 55.5 mt -109.84 117.6 55.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 120.827 0.346 . . . . 10.0 110.311 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -111.95 122.84 48.89 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.811 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 504' ' ' THR . . . . . 0.402 ' HA ' ' HG1' ' A' ' 456' ' ' THR . 8.8 m -103.28 124.15 48.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.19 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 52.88 68.71 0.79 Allowed 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.864 0.728 . . . . 10.0 110.763 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.0 132.87 36.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.838 -179.346 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.57 177.02 7.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.066 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -67.09 163.19 45.45 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.125 -0.56 . . . . 10.0 112.486 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.474 HH21 ' CD ' ' A' ' 210' ' ' GLU . 98.5 mtt180 64.83 -92.98 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 122.849 0.46 . . . . 10.0 111.016 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 86.43 141.16 6.22 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.941 -0.647 . . . . 10.0 112.252 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.84 137.06 58.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.762 0.315 . . . . 10.0 110.835 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.17 116.48 8.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.641 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 59.2 mt -80.32 123.12 36.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.557 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 3.4 t -83.31 133.51 28.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.601 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 52.0 mt -70.8 130.49 41.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.566 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 84.65 10.15 79.91 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.103 -0.799 . . . . 10.0 111.103 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 93.55 -175.15 35.57 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 110.432 -1.067 . . . . 10.0 110.432 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 13.0 p -124.68 111.44 15.58 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 117.517 0.659 . . . . 10.0 110.539 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 519' ' ' TRP . . . . . 0.411 ' O ' HG22 ' A' ' 523' ' ' VAL . 41.7 p-90 -61.51 -20.2 62.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.049 0.452 . . . . 10.0 110.096 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -59.63 -40.95 89.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.421 -0.809 . . . . 10.0 110.277 178.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -74.63 -32.44 62.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.755 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -70.43 -45.19 66.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.91 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 523' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 519' ' ' TRP . 27.7 m -69.3 -28.36 38.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.966 0.412 . . . . 10.0 110.265 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -75.11 -22.96 57.88 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.498 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -78.29 -24.13 46.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.009 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 63.0 mt -75.7 145.56 40.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.741 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -75.7 -46.0 33.62 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.018 0.437 . . . . 10.0 110.295 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -138.15 84.39 20.61 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.263 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 529' ' ' PRO . . . . . 0.443 ' HA ' ' OE1' ' A' ' 533' ' ' GLN . 64.6 Cg_endo -78.88 104.15 1.76 Allowed 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.758 2.305 . . . . 10.0 112.66 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 72.2 p -82.4 175.07 10.53 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.309 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.11 -39.88 72.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.545 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 57.9 mp0 -60.89 -43.01 99.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.142 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 533' ' ' GLN . . . . . 0.443 ' OE1' ' HA ' ' A' ' 529' ' ' PRO . 52.4 mt-30 -69.72 -51.14 37.0 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.169 -0.468 . . . . 10.0 110.727 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.04 -42.8 87.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 10.0 111.024 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -64.13 -40.61 96.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.036 0.446 . . . . 10.0 110.45 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.449 ' HG3' ' N ' ' A' ' 537' ' ' ILE . 0.0 OUTLIER -67.1 -43.22 83.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.478 179.804 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 537' ' ' ILE . . . . . 0.449 ' N ' ' HG3' ' A' ' 536' ' ' LYS . 77.2 mt -64.21 -41.83 93.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-N 116.398 -0.365 . . . . 10.0 110.755 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -59.84 -41.15 90.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.799 0.333 . . . . 10.0 110.547 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -67.36 -45.63 75.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.384 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -42.31 99.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.348 0.594 . . . . 10.0 110.028 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 66.4 t90 -63.81 -38.72 92.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.274 -0.875 . . . . 10.0 110.59 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 31.7 tp60 -56.37 -44.41 80.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.551 -0.295 . . . . 10.0 110.591 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 16.9 t -59.77 -46.7 93.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.033 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -65.49 -44.6 86.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.572 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -57.88 -52.72 64.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.147 -0.933 . . . . 10.0 111.922 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.11 -27.12 63.36 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.657 -178.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.7 91.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.994 0.426 . . . . 10.0 110.065 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 64.7 t -65.5 -43.74 94.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.072 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 24.9 mt -62.29 -41.32 98.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.191 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.85 -36.06 81.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.808 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 551' ' ' ALA . . . . . 0.404 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -68.16 -38.38 82.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.963 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 148.26 6.74 0.24 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.379 -0.915 . . . . 10.0 113.584 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 553' ' ' GLY . . . . . 0.402 ' HA3' ' H ' ' A' ' 582' ' ' GLY . . . 82.75 -164.24 42.85 Favored Glycine 0 CA--C 1.516 0.103 0 C-N-CA 120.762 -0.732 . . . . 10.0 112.062 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 36.0 tp -74.06 118.09 16.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.27 0.557 . . . . 10.0 110.864 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -91.45 119.6 31.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.807 0.337 . . . . 10.0 110.808 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 29.9 mm -104.19 132.07 51.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.554 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 557' ' ' ILE . . . . . 0.455 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.1 mt -128.19 123.04 59.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.972 0.415 . . . . 10.0 110.052 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -106.02 129.72 9.88 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.741 -0.742 . . . . 10.0 111.667 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 23.7 p -86.13 -34.13 20.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.233 0.54 . . . . 10.0 110.584 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -134.14 162.28 32.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.335 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -109.46 138.68 45.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.511 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 562' ' ' HIS . . . . . 0.406 ' HB3' ' HB2' ' A' ' 568' ' ' ASP . 46.0 t-80 -86.58 141.15 29.22 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -52.21 -63.85 1.01 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.607 0.567 . . . . 10.0 111.037 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.64 131.9 41.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.112 178.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 565' ' ' ARG . . . . . 0.489 ' HA ' ' HB3' ' A' ' 568' ' ' ASP . 9.3 tpt180 -64.1 -19.58 65.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.381 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 566' ' ' ARG . . . . . 0.535 ' HD3' ' OD2' ' A' ' 212' ' ' ASP . 9.9 ttm180 -52.08 -64.64 0.75 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.528 -179.412 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 25.8 mt -75.59 -28.28 19.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.965 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 568' ' ' ASP . . . . . 0.489 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 20.5 t70 -61.73 -49.28 77.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.245 0.545 . . . . 10.0 111.005 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 569' ' ' ASN . . . . . 0.519 HD22 ' HA ' ' A' ' 394' ' ' ALA . 40.2 t30 -73.12 -31.6 64.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.473 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -67.94 -29.45 68.51 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.773 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.495 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 32.1 tp -66.89 -34.08 77.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.443 0.639 . . . . 10.0 109.474 178.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 26.5 ttp180 -83.3 -22.82 32.84 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.15 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -71.88 12.94 2.66 Favored Glycine 0 CA--C 1.522 0.5 0 CA-C-N 115.862 -0.608 . . . . 10.0 113.972 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 574' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 1.5 mmt180 -77.15 -35.48 56.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 117.277 0.538 . . . . 10.0 109.806 179.121 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.593 ' OG ' ' HA3' ' A' ' 582' ' ' GLY . 41.2 t -94.96 165.29 12.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.422 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 576' ' ' GLY . . . . . 0.578 ' HA2' ' O ' ' A' ' 580' ' ' ASP . . . 76.64 39.07 30.53 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.718 -0.753 . . . . 10.0 111.281 -179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -111.07 136.71 49.69 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.56 0.219 . . . . 10.0 110.488 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 59.93 21.65 10.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.905 -0.589 . . . . 10.0 112.423 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 105.31 1.75 41.17 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.404 -0.903 . . . . 10.0 113.338 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 580' ' ' ASP . . . . . 0.578 ' O ' ' HA2' ' A' ' 576' ' ' GLY . 2.8 t70 -66.06 148.01 52.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.726 0.298 . . . . 10.0 110.316 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 581' ' ' ALA . . . . . 0.558 ' O ' ' HA ' ' A' ' 420' ' ' ARG . . . -84.3 -85.54 0.13 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.79 -0.819 . . . . 10.0 108.79 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 582' ' ' GLY . . . . . 0.593 ' HA3' ' OG ' ' A' ' 575' ' ' SER . . . 83.77 174.71 50.54 Favored Glycine 0 N--CA 1.439 -1.133 0 C-N-CA 120.59 -0.814 . . . . 10.0 113.396 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 421' ' ' LYS . 0.1 OUTLIER -153.64 121.44 6.0 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 -179.68 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -97.97 110.34 22.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.872 0.367 . . . . 10.0 110.985 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 585' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 3.3 tpm_? -119.36 112.96 20.08 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.714 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -106.9 137.68 44.49 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.975 0.417 . . . . 10.0 111.012 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -124.75 141.93 51.76 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 588' ' ' LEU . . . . . 0.448 ' HB2' HG22 ' A' ' 427' ' ' VAL . 8.6 mt -142.71 171.32 14.21 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.923 0.392 . . . . 10.0 110.863 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.39 155.56 48.23 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.988 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 590' ' ' MET . . . . . 0.499 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 90.7 mmm -71.18 -5.37 31.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.771 0.32 . . . . 10.0 111.131 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -99.33 -4.39 31.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.408 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -73.13 149.73 42.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.369 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -60.25 -17.25 40.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.525 -0.761 . . . . 10.0 112.224 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 594' ' ' LEU . . . . . 0.518 ' O ' HG12 ' A' ' 597' ' ' ILE . 20.4 tp -64.2 -28.35 69.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.831 0.348 . . . . 10.0 110.842 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.464 ' SD ' ' HB3' ' A' ' 604' ' ' SER . 14.8 mmt -81.75 5.37 18.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.984 0.421 . . . . 10.0 111.297 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -97.9 -15.92 19.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.439 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 597' ' ' ILE . . . . . 0.518 HG12 ' O ' ' A' ' 594' ' ' LEU . 42.6 pt -86.41 11.34 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.188 0.518 . . . . 10.0 110.764 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -90.25 22.56 3.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.799 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.1 -58.42 0.57 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.684 0.794 . . . . 10.0 111.842 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.2 m -127.53 136.62 51.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.746 0.307 . . . . 10.0 110.567 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.11 -20.3 63.9 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.249 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 602' ' ' ARG . . . . . 0.423 ' O ' ' HD3' ' A' ' 602' ' ' ARG . 0.9 OUTLIER -64.64 -33.7 76.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.75 -179.793 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 16.2 t -67.57 -50.19 63.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.177 0.513 . . . . 10.0 109.752 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 604' ' ' SER . . . . . 0.464 ' HB3' ' SD ' ' A' ' 595' ' ' MET . 0.0 OUTLIER -65.93 -35.8 81.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.08 179.173 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -61.25 -28.73 69.68 Favored Glycine 0 N--CA 1.45 -0.433 0 CA-C-N 115.788 -0.642 . . . . 10.0 112.637 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 14.9 tpt -66.6 -32.21 73.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.191 0.52 . . . . 10.0 110.253 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 67.5 mtt -74.12 -11.27 60.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.698 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -77.39 -0.61 26.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.08 0.467 . . . . 10.0 110.686 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -108.31 22.7 15.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.527 179.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.68 -12.29 57.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.436 -0.802 . . . . 10.0 111.235 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 93.67 -57.16 2.27 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.949 -0.643 . . . . 10.0 112.339 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 66.85 -79.34 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.27 0.628 . . . . 10.0 112.219 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? 67.62 95.4 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.34 0 O-C-N 123.67 0.606 . . . . 10.0 110.172 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 614' ' ' PRO . . . . . 0.443 ' HG3' ' HG2' ' A' ' 433' ' ' GLU . 53.6 Cg_exo -51.79 110.62 0.45 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.211 2.607 . . . . 10.0 113.412 -178.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 117.98 -22.21 9.92 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.012 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -92.79 98.44 11.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.189 0.518 . . . . 10.0 110.449 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -95.06 88.11 5.12 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.489 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -86.45 -12.2 11.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.777 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 69.62 142.41 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.66 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -144.13 93.25 6.04 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.337 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -62.73 -29.92 77.76 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.15 2.567 . . . . 10.0 113.805 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 64.8 p-90 -68.82 -17.72 64.05 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.055 0.391 . . . . 10.0 112.055 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.534 HG11 HG23 ' A' ' 427' ' ' VAL . 44.2 t -66.07 -51.25 62.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.779 0.323 . . . . 10.0 110.3 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 27.9 m -59.03 -34.65 72.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.233 0.54 . . . . 10.0 110.437 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -68.04 -41.93 81.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.988 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -65.45 -43.65 89.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.523 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 92.1 mt -63.34 -45.11 99.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.686 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -59.49 -42.68 92.71 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.914 0.388 . . . . 10.0 110.721 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -68.5 -39.41 81.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.351 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -62.11 -39.68 93.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.969 0.414 . . . . 10.0 110.154 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -61.46 -46.39 90.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.626 178.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.7 -34.09 69.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.432 -0.803 . . . . 10.0 110.915 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -62.75 -48.15 80.45 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.95 0.405 . . . . 10.0 110.519 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 48.1 t -62.97 -43.29 98.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.477 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -64.54 -43.23 94.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.676 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 49.9 m -62.91 -32.89 74.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.991 0.424 . . . . 10.0 110.161 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -67.89 -42.81 80.62 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -65.59 -40.29 92.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.302 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -59.38 -40.57 86.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.255 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 640' ' ' ASP . . . . . 0.566 ' O ' ' HG2' ' A' ' 644' ' ' GLN . 33.1 t70 -60.11 -43.59 95.48 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 179.297 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 58.2 mt -66.11 -43.03 92.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.159 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 642' ' ' ARG . . . . . 0.431 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 7.6 mtm-85 -59.77 -40.71 89.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.731 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 19.7 ttpp -60.85 -41.98 96.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.494 -0.776 . . . . 10.0 110.599 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 644' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 9.8 mm100 -64.07 -43.33 95.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.577 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 87.3 mt -63.97 -44.14 93.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.198 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 646' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 97.1 mt -66.09 -30.24 70.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.277 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.07 -27.79 68.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.24 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -100.61 -32.41 10.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.888 0.375 . . . . 10.0 110.731 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -35.69 80.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.234 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -69.73 -22.98 63.34 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.988 0.423 . . . . 10.0 110.897 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 651' ' ' VAL . . . . . 0.432 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 48.5 t -64.71 -47.18 89.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.163 -0.68 . . . . 10.0 109.163 178.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -70.7 -28.49 64.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.517 -0.765 . . . . 10.0 109.503 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -60.79 -52.31 65.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.617 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -60.04 -45.95 91.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.937 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 655' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 35.5 mt-30 -62.2 -41.73 98.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.626 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 11.4 ttp-105 -63.8 -48.53 76.52 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 52.0 ttp180 -57.54 -44.92 85.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.91 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.19 -53.55 51.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.902 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 8.5 tp -66.21 -33.31 62.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 121.028 -0.269 . . . . 10.0 111.356 -178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -69.86 -33.49 72.33 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 110.257 -0.275 . . . . 10.0 110.257 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 57.1 m -65.08 -39.13 92.78 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -68.78 -44.22 74.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.712 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 44.5 ttt-85 -62.97 -37.84 88.71 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.238 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -68.6 -35.71 77.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.325 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.62 -51.51 64.9 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 52.0 mt -65.91 -18.25 65.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.601 -0.727 . . . . 10.0 110.472 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 47.6 tp -80.42 -44.43 19.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.457 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.49 -43.15 60.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.991 -0.549 . . . . 10.0 112.351 -178.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 34.3 m -67.68 149.31 11.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.203 0.525 . . . . 10.0 111.73 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.47 -31.71 11.85 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.672 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -101.61 146.47 27.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.125 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 672' ' ' VAL . . . . . 0.443 ' O ' HG12 ' A' ' 676' ' ' ILE . 9.5 p -143.47 10.75 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.958 0.409 . . . . 10.0 110.69 -179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.85 -43.61 86.01 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.036 0.446 . . . . 10.0 110.942 -179.008 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -62.33 -50.34 72.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.84 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 675' ' ' THR . . . . . 0.404 ' O ' HG12 ' A' ' 679' ' ' ILE . 1.8 m -56.95 -46.41 82.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.022 -0.536 . . . . 10.0 111.33 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 676' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 672' ' ' VAL . 46.4 mm -61.73 -44.23 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.942 0.401 . . . . 10.0 110.932 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -67.27 -41.41 85.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.459 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 40.2 m -62.35 -44.98 95.21 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 679' ' ' ILE . . . . . 0.459 ' O ' HG23 ' A' ' 683' ' ' VAL . 47.2 pt -74.79 -26.38 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 C-N-CA 120.535 -0.466 . . . . 10.0 110.669 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -59.63 -42.04 91.82 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.209 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -60.88 -47.13 87.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.657 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.75 -47.7 77.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.152 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 683' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 679' ' ' ILE . 81.0 t -58.66 -51.91 66.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.314 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -60.57 -42.84 97.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.126 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.1 tttm -63.39 -49.77 72.49 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 121.16 -0.216 . . . . 10.0 110.554 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.92 -41.85 88.3 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.44 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 23.9 m -65.41 -40.77 93.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.022 0.439 . . . . 10.0 110.597 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 84.1 mt -67.43 -42.2 86.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.487 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -57.23 -24.96 58.14 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 122.755 0.422 . . . . 10.0 111.946 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -75.63 -28.45 58.82 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -108.21 -24.64 11.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.096 0.474 . . . . 10.0 111.161 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 692' ' ' ILE . . . . . 0.5 HG23 ' CD1' ' A' ' 701' ' ' TRP . 84.6 mt -132.91 99.89 14.87 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.41 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -62.14 139.91 80.89 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.427 2.085 . . . . 10.0 111.571 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.82 113.88 1.59 Allowed 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.813 2.342 . . . . 10.0 112.855 -179.278 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 58.13 67.37 0.96 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.215 -0.902 . . . . 10.0 111.942 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 14.3 p -127.35 177.81 6.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.199 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 18.6 mt -75.88 154.54 35.99 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.18 -26.98 65.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.378 . . . . 10.0 111.598 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -67.06 -14.23 62.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.554 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -104.96 7.43 34.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.626 -0.261 . . . . 10.0 111.041 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 701' ' ' TRP . . . . . 0.5 ' CD1' HG23 ' A' ' 692' ' ' ILE . 41.7 m0 -101.23 106.3 17.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.742 0.306 . . . . 10.0 111.099 -179.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 58.7 t0 -82.51 77.58 9.26 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 703' ' ' ILE . . . . . 0.511 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 24.2 mm -57.76 -49.9 91.17 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.652 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 704' ' ' PRO . . . . . 0.511 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 32.2 Cg_exo -60.14 -42.0 46.9 Favored 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 121.894 1.729 . . . . 10.0 111.718 179.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -63.81 -44.8 95.67 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.622 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 55.6 tp -65.06 -40.99 95.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.189 -0.301 . . . . 10.0 110.189 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -62.04 -48.11 81.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.512 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -59.42 -42.23 91.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.02 -0.537 . . . . 10.0 110.235 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -63.46 -43.44 97.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.548 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 49.6 mt -64.07 -42.62 96.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.297 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 14.3 mtpp -76.1 -6.05 49.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.881 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -111.84 -56.54 2.37 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.484 0.55 . . . . 10.0 112.484 -178.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -83.73 -19.22 35.56 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.879 0.696 . . . . 10.0 112.879 -177.076 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -123.02 -8.92 8.27 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.465 -0.494 . . . . 10.0 112.123 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.98 21.79 12.59 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.019 0.438 . . . . 10.0 110.758 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 12.8 tp -97.65 109.88 22.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.407 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -91.47 92.32 8.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.918 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 40.0 mt -123.4 122.7 26.65 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.399 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -82.36 77.99 3.57 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.8 2.334 . . . . 10.0 112.186 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 44.7 mt -61.43 -37.24 77.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.197 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.45 4.35 4.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.883 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -109.18 -0.88 19.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.865 0.364 . . . . 10.0 110.211 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 15.9 m0 -114.44 -44.92 3.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.676 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 11.1 tp -60.33 -16.51 35.47 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.358 0.873 . . . . 10.0 113.358 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -90.27 -32.67 16.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.994 0.426 . . . . 10.0 111.075 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 726' ' ' LYS . . . . . 0.519 ' O ' ' HD3' ' A' ' 728' ' ' PRO . 40.3 mttp -93.34 -23.19 18.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.925 -178.72 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -109.36 94.74 16.54 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-O 120.752 0.311 . . . . 10.0 110.725 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 728' ' ' PRO . . . . . 0.519 ' HD3' ' O ' ' A' ' 726' ' ' LYS . 11.7 Cg_exo -71.66 -16.81 30.06 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.939 2.426 . . . . 10.0 112.41 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.28 21.42 17.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.111 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.73 -28.35 66.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.71 -134.58 0.57 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.44 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.35 -56.25 1.24 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.066 0.46 . . . . 10.0 110.564 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 733' ' ' GLU . . . . . 0.489 ' HG2' ' N ' ' A' ' 734' ' ' THR . 20.2 pm0 -60.67 -38.95 86.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.758 -0.655 . . . . 10.0 111.8 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 734' ' ' THR . . . . . 0.489 ' N ' ' HG2' ' A' ' 733' ' ' GLU . 0.1 OUTLIER -65.68 -27.59 68.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.974 0.416 . . . . 10.0 110.794 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 50.2 tp -69.04 -40.41 78.6 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 -64.38 -41.15 96.84 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.858 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -60.21 -40.82 91.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.701 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 21.6 mmm-85 -61.15 -50.64 72.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.795 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 55.4 mt -60.38 -43.6 94.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.652 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 740' ' ' LEU . . . . . 0.428 ' O ' HG13 ' A' ' 744' ' ' ILE . 16.5 tp -63.93 -50.95 66.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.001 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.83 86.54 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.24 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 742' ' ' GLN . . . . . 0.405 ' O ' HG23 ' A' ' 746' ' ' VAL . 16.6 tp60 -64.95 -39.51 93.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.744 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 24.5 p -63.44 -33.54 75.77 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.062 0.458 . . . . 10.0 110.033 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 744' ' ' ILE . . . . . 0.522 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 66.7 mt -70.41 -43.98 77.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -48.93 79.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.34 -0.846 . . . . 10.0 111.114 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 742' ' ' GLN . 57.9 t -64.32 -36.66 77.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.065 0.46 . . . . 10.0 110.261 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.48 -43.22 99.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.332 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 748' ' ' GLN . . . . . 0.522 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 97.2 mt-30 -58.75 -37.93 77.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.748 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 749' ' ' ARG . . . . . 0.447 ' O ' HG23 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -62.58 -46.01 90.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.477 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -65.5 -37.56 87.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.08 0.467 . . . . 10.0 109.888 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -64.1 -41.89 97.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.222 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -64.52 -29.82 70.85 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 753' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 749' ' ' ARG . 54.9 t -78.74 -48.96 21.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.824 0.345 . . . . 10.0 111.37 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 38.9 t -74.07 -52.04 21.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.961 0.41 . . . . 10.0 111.637 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 139.77 141.61 4.09 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.301 -0.719 . . . . 10.0 111.301 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 756' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -60.94 -63.2 1.38 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.783 0.291 . . . . 10.0 111.458 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -60.19 -37.87 81.54 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.729 0.299 . . . . 10.0 110.701 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 14.6 tpt -61.19 -45.21 95.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.27 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 45.0 mmm -65.23 -41.34 94.48 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.49 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.4 mmp_? -59.35 -41.4 89.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.255 0.55 . . . . 10.0 109.997 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -70.48 -33.86 71.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.829 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -65.24 -52.41 54.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.542 -0.754 . . . . 10.0 109.772 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -58.91 -45.31 90.64 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.175 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 764' ' ' LYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 768' ' ' LEU . 50.9 tttp -56.11 -47.7 77.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.163 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -68.64 -38.88 86.53 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 121.003 -0.617 . . . . 10.0 112.079 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 30.2 t -61.89 -45.41 98.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 110.523 -0.177 . . . . 10.0 110.523 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 37.8 mtp -59.2 -46.13 89.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.73 -0.213 . . . . 10.0 110.516 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 768' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 764' ' ' LYS . 85.1 mt -64.46 -47.92 77.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.494 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -58.42 -46.58 86.19 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.94 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 19.3 m -63.7 -38.77 92.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.925 0.393 . . . . 10.0 110.563 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.65 -50.56 72.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.788 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.46 -29.95 71.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.702 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 69.1 m -68.05 -43.86 77.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.911 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.16 -25.44 34.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.731 0.301 . . . . 10.0 111.109 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 27.2 t-105 -63.68 -49.45 73.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.565 -0.289 . . . . 10.0 111.3 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -59.58 -39.26 83.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.81 0.338 . . . . 10.0 110.547 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -68.42 -39.93 81.4 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.204 0.526 . . . . 10.0 109.985 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 68.0 t60 -62.24 -38.17 88.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.274 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 80.7 mt -65.41 -47.16 77.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.488 179.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -63.81 -46.16 86.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.759 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -60.56 -41.62 94.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.128 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 51.1 mmm -63.16 -42.33 99.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.734 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -68.31 -36.64 79.62 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.099 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -69.69 -32.99 71.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.43 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.55 -37.29 60.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.962 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -60.96 -50.79 71.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.35 -0.841 . . . . 10.0 111.075 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 . . . . . 0 C--N 1.329 -0.285 0 CA-C-O 120.944 0.402 . . . . 10.0 110.986 -179.814 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 CA--C 1.529 0.242 0 CA-C-O 121.04 0.35 . . . . 10.0 112.0 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -81.46 155.39 25.86 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 73.09 -49.43 0.7 Allowed 'General case' 0 N--CA 1.468 0.448 0 O-C-N 123.578 0.549 . . . . 10.0 111.166 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 802' ' ' GLU . . . . . 0.46 ' OE2' ' HD3' ' A' ' 805' ' ' ARG . 3.1 tp10 -65.16 -47.65 76.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.069 0.461 . . . . 10.0 109.83 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -61.8 -34.73 76.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.87 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -63.63 -36.24 83.17 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.922 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 805' ' ' ARG . . . . . 0.46 ' HD3' ' OE2' ' A' ' 802' ' ' GLU . 44.8 mtp180 -58.5 -43.59 89.1 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.153 0.502 . . . . 10.0 109.718 178.659 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.6 -44.79 95.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.964 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 6.2 m -61.02 -39.82 91.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.713 -0.676 . . . . 10.0 110.966 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -71.99 -38.01 69.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.865 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 40.2 m -62.94 -39.66 95.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.06 0.457 . . . . 10.0 109.946 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 18.9 ttm -66.74 -37.21 84.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.086 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 811' ' ' PHE . . . . . 0.43 ' O ' ' HG ' ' A' ' 815' ' ' LEU . 27.4 t80 -65.7 -41.98 91.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.348 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.29 -45.88 92.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.654 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.72 -37.27 85.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.13 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 22.9 ttt -62.83 -44.31 96.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.597 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 815' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 811' ' ' PHE . 94.1 mt -62.06 -41.53 98.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.846 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -64.21 -45.95 86.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.241 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 11.7 m -65.02 -35.8 82.34 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.992 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 63.6 tp -56.07 -51.01 69.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.639 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -62.49 -42.09 99.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.225 0.536 . . . . 10.0 110.399 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -58.88 -57.45 12.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.196 -0.911 . . . . 10.0 111.629 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -59.97 -42.95 95.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.076 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 30.4 t -58.44 -52.55 57.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.561 0.219 . . . . 10.0 110.614 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 35.4 mm -63.77 -41.24 91.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.695 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 37.1 t -56.83 -49.42 75.47 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.736 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 16.7 m -63.16 -37.96 89.28 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.323 -0.398 . . . . 10.0 111.75 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 93.5 mt -75.56 -17.03 60.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.553 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 16.3 m -95.94 -41.75 8.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.997 0.427 . . . . 10.0 110.627 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -77.34 -1.01 27.78 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.867 -0.606 . . . . 10.0 112.453 -178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.0 p -64.59 118.37 6.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.439 0.638 . . . . 10.0 110.065 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -80.44 106.16 12.25 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.237 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 C--N 1.319 -0.726 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.148 179.526 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 . . . . . 0 C--O 1.235 0.317 0 CA-C-O 120.821 0.343 . . . . 10.0 110.864 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 142.58 165.16 10.46 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.842 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.44 ' H ' ' HD3' ' A' ' 16' ' ' ARG . 0.7 OUTLIER -57.28 133.45 55.11 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 122.413 0.285 . . . . 10.0 110.566 179.661 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.517 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 5.1 mmp_? -58.52 137.72 57.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.739 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 68.17 -83.67 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.328 -0.851 . . . . 10.0 112.543 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -41.08 -68.13 0.2 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.497 1.295 . . . . 10.0 114.497 -177.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.44 ' HD3' ' H ' ' A' ' 12' ' ' SER . 44.0 ttt180 -64.32 -43.01 96.01 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.48 0.548 . . . . 10.0 112.48 -177.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.89 -39.34 88.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.15 0.426 . . . . 10.0 112.15 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.5 mt -61.17 -53.94 50.66 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.08 0.4 . . . . 10.0 112.08 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -66.66 -24.22 66.25 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.57 -0.452 . . . . 10.0 110.953 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.07 -42.44 56.89 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 60.5 mtt -68.5 -32.3 72.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.817 -0.628 . . . . 10.0 109.667 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -57.5 -32.96 67.54 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.453 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -63.36 -43.72 96.85 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.182 0.515 . . . . 10.0 109.843 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.64 -41.94 91.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.391 -0.822 . . . . 10.0 109.943 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.455 ' HA ' HD12 ' A' ' 28' ' ' ILE . 97.5 t -60.72 -37.07 74.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.681 -0.69 . . . . 10.0 110.117 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -63.24 -43.12 98.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.66 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 82.3 mt -61.95 -45.57 98.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.986 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.455 HD12 ' HA ' ' A' ' 25' ' ' VAL . 55.8 mt -59.66 -40.29 81.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.346 179.107 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -63.84 -33.55 75.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.862 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.439 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -82.56 -26.94 31.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.479 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 13.4 ttt -83.3 -16.42 46.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.69 0.281 . . . . 10.0 110.814 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.477 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 27.5 tt0 -59.49 -51.93 77.77 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 116.352 -0.385 . . . . 10.0 111.728 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.477 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 51.8 Cg_exo -56.28 -28.3 70.98 Favored 'Trans proline' 0 C--N 1.361 1.214 0 C-N-CA 121.844 1.696 . . . . 10.0 111.949 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -73.1 -42.09 63.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.835 -0.62 . . . . 10.0 109.908 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 25.4 mmt -66.31 -27.83 68.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.435 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 83.7 mt-10 -62.48 -23.48 66.94 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.839 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 mtpt -86.17 -14.32 44.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.069 0.461 . . . . 10.0 110.589 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 7.8 mp -87.48 140.51 29.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.321 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.6 p -76.28 171.67 14.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.649 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.04 -38.24 82.18 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.894 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -70.55 -32.01 69.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.554 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -66.94 -34.74 78.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.276 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.2 mt -62.93 -44.79 95.12 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.896 -0.779 . . . . 10.0 108.896 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -63.4 -28.05 69.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.926 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.65 -34.3 72.65 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 115.421 -0.808 . . . . 10.0 111.449 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -68.89 -39.34 79.82 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.6 m -60.21 -44.24 95.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.103 0.478 . . . . 10.0 109.915 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -38.32 88.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.653 -0.703 . . . . 10.0 110.055 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -60.5 -40.07 90.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.375 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -62.77 -43.42 98.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.321 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -58.48 -46.83 85.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.357 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.571 ' O ' ' HG3' ' A' ' 56' ' ' LYS . . . -68.83 -44.39 73.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.302 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 33.5 mtp180 -58.23 -40.27 81.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.786 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 72.6 mt -62.76 -38.5 90.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 10.0 110.626 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -72.45 -23.93 61.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.301 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 52' ' ' ALA . 20.5 mtpp -83.22 -66.96 0.83 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.77 0.319 . . . . 10.0 110.422 179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 178.22 67.07 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 121.071 -0.585 . . . . 10.0 111.918 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -133.39 150.6 51.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.809 0.338 . . . . 10.0 110.203 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.1 t -100.15 133.66 42.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.892 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.563 HD11 ' O ' ' A' ' 118' ' ' LEU . 17.1 tp -60.35 -41.41 93.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.096 0.474 . . . . 10.0 110.608 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.7 mp0 -68.04 -8.99 42.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.255 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -100.15 -15.18 18.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.38 0.61 . . . . 10.0 109.963 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 55.4 mt -89.1 -5.49 57.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.516 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.498 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 66.6 mt -49.54 -51.01 62.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 113.256 0.835 . . . . 10.0 113.256 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.498 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 32.1 Cg_exo -57.3 -48.19 18.83 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.829 1.686 . . . . 10.0 112.957 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.451 ' O ' HG23 ' A' ' 70' ' ' VAL . 39.4 mt-10 -71.01 -43.47 67.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.719 -178.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.497 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -61.88 -51.44 68.19 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.061 0.393 . . . . 10.0 112.061 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -61.92 -34.17 75.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.325 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.44 -45.01 92.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.415 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 66' ' ' GLU . 85.6 t -60.86 -46.39 96.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.334 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 67' ' ' ALA . 29.1 t -60.87 -46.08 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.677 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.415 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 2.7 ttt180 -59.82 -43.02 94.76 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.682 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.3 tp10 -64.49 -47.56 78.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.83 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.41 72.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.572 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.5 m -58.45 -40.94 83.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.301 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -71.14 -21.21 62.22 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -96.21 -44.38 7.3 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.731 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 67.1 t -74.1 -53.13 18.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.647 0.261 . . . . 10.0 111.628 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -98.87 -47.47 5.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.131 0.491 . . . . 10.0 111.213 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 119.54 -34.24 4.33 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.217 -0.753 . . . . 10.0 111.217 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.6 mpt? -77.99 139.62 39.15 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.01 -0.367 . . . . 10.0 110.01 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -91.13 139.04 31.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.583 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.89 114.96 3.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.079 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -61.31 152.48 29.16 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.056 0.455 . . . . 10.0 111.822 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -41.83 94.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.511 -0.768 . . . . 10.0 111.77 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -63.65 -31.61 53.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.116 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.532 HE22 HD23 ' A' ' 110' ' ' LEU . 97.9 mt-30 -70.19 -31.34 68.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.253 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.22 -31.75 73.07 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.465 ' O ' HG23 ' A' ' 93' ' ' VAL . 39.1 mt -73.77 -48.82 28.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.806 -0.634 . . . . 10.0 109.438 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.88 -40.84 99.38 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.779 -0.646 . . . . 10.0 112.508 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.32 -28.66 73.34 Favored Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 112.026 -0.43 . . . . 10.0 112.026 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 16.4 ttm -74.34 -37.6 63.5 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 89' ' ' LEU . 58.8 t -66.82 -33.78 65.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.03 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.1 mt -74.29 -2.69 26.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.562 -0.745 . . . . 10.0 112.141 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -83.13 -35.05 25.9 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 178.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -96.35 178.02 5.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.194 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -79.07 71.33 5.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.066 0.46 . . . . 10.0 110.443 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 56.2 m -143.74 154.35 43.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.445 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.553 HD12 HG11 ' A' ' 211' ' ' VAL . 41.1 mm -103.29 136.48 35.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -116.18 126.99 54.42 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 111.929 0.344 . . . . 10.0 111.929 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -87.54 121.04 29.46 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.42 ' SD ' ' HG2' ' A' ' 108' ' ' LYS . 45.5 ttm -112.63 158.58 19.82 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.974 0.416 . . . . 10.0 111.271 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 103' ' ' ARG . 9.9 mmm180 -95.02 157.38 15.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.25 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.43 108.04 7.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.39 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 132.31 -28.36 3.47 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.485 -0.864 . . . . 10.0 112.926 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.601 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 4.4 mm-40 -60.47 -51.02 71.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.018 0.437 . . . . 10.0 110.542 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 114.71 99.52 2.28 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.806 -0.711 . . . . 10.0 112.469 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.42 ' HG2' ' SD ' ' A' ' 102' ' ' MET . 40.2 mtmt -69.8 -45.5 67.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.657 0.265 . . . . 10.0 111.054 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 73.4 m -62.07 -34.16 75.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.269 0.556 . . . . 10.0 110.68 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.532 HD23 HE22 ' A' ' 87' ' ' GLN . 13.3 tp -81.14 -1.99 46.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.998 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 42.2 m -110.81 -42.71 3.95 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.895 0.378 . . . . 10.0 110.464 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.52 -13.56 59.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.975 -0.557 . . . . 10.0 112.155 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -24.98 63.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.462 -0.335 . . . . 10.0 111.799 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.416 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 55.5 mt -73.63 -57.16 2.68 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 31.6 Cg_endo -62.11 -32.34 83.31 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.108 1.872 . . . . 10.0 112.118 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.29 77.16 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.385 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.415 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 57.1 t80 -63.47 -46.97 83.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.488 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.563 ' O ' HD11 ' A' ' 60' ' ' LEU . 52.1 tp -58.85 -51.1 71.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.706 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -72.26 -21.78 61.32 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.693 0.257 . . . . 10.0 111.693 -178.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.472 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -70.22 -26.64 63.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.877 0.37 . . . . 10.0 110.861 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 58.8 mt -58.72 -32.32 69.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.218 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 69.0 p -64.23 -35.56 81.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.244 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.06 19.26 59.51 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.914 -0.66 . . . . 10.0 112.303 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 64.1 mmtt -87.36 -26.77 23.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.938 0.399 . . . . 10.0 110.881 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 109.1 105.77 2.99 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.771 -0.728 . . . . 10.0 112.922 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 78.4 t -79.35 115.66 22.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -93.56 99.05 11.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.741 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 40.5 t -92.21 118.9 38.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.957 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 52.4 t -104.8 119.71 54.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.854 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.11 155.7 19.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.275 -0.42 . . . . 10.0 110.764 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 5.1 m -64.71 -36.94 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.899 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -139.0 162.66 34.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.766 0.317 . . . . 10.0 110.631 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.88 -24.12 63.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.406 -178.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -62.68 -55.24 28.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.82 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 83.2 mt -68.71 -33.08 73.34 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.595 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.75 -50.8 69.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.976 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -72.55 -35.63 68.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.725 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -58.92 -57.33 13.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.724 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.76 -32.63 74.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.001 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.7 -49.15 77.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.997 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' GLU . . . . . 0.415 ' O ' ' HD3' ' A' ' 145' ' ' PRO . 54.4 mm-40 -78.53 -28.26 46.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.472 -179.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -71.38 -43.0 67.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.015 0.436 . . . . 10.0 111.08 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -88.77 -1.66 58.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.119 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.499 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 60.6 ttm-85 -64.87 -50.16 64.68 Favored Pre-proline 0 CA--C 1.535 0.404 0 N-CA-C 112.484 0.55 . . . . 10.0 112.484 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' PRO . . . . . 0.499 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 32.4 Cg_exo -60.69 -14.39 31.28 Favored 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 122.102 1.868 . . . . 10.0 112.62 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 14.3 tp -89.07 -56.49 3.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.405 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -65.87 -46.74 77.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 10.0 112.186 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -64.95 -25.57 67.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.781 0.324 . . . . 10.0 111.591 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -77.45 -22.93 50.68 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.071 0.462 . . . . 10.0 110.306 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 81.8 mt -93.17 -6.73 47.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.659 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 103.74 8.16 40.45 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.515 -0.85 . . . . 10.0 113.585 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 91.8 mt -96.91 138.7 34.06 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.1 0.45 . . . . 10.0 110.592 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.35 130.65 34.44 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.279 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.426 HG21 ' HA ' ' A' ' 144' ' ' ARG . 47.2 t -111.45 123.03 66.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.941 0.4 . . . . 10.0 110.689 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -120.57 150.46 17.37 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.993 -0.622 . . . . 10.0 112.278 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 4.3 tp -123.81 133.2 69.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -118.98 116.48 26.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.407 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.505 ' O ' ' HB2' ' A' ' 161' ' ' MET . 94.7 mt -109.06 146.07 33.08 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.482 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 159' ' ' PRO . . . . . 0.567 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 15.2 Cg_endo -58.46 115.08 2.28 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 122.655 2.236 . . . . 10.0 112.22 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.85 5.24 56.6 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.785 -0.722 . . . . 10.0 112.746 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' MET . . . . . 0.505 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.3 OUTLIER -65.87 151.96 94.15 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.555 0.177 . . . . 10.0 110.809 179.496 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -61.33 147.0 96.69 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.496 2.131 . . . . 10.0 111.866 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' ALA . . . . . 0.487 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.82 -49.71 87.79 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 112.384 0.513 . . . . 10.0 112.384 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.487 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 52.2 Cg_exo -56.59 -44.87 41.45 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 121.819 1.68 . . . . 10.0 112.205 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.69 98.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.67 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -62.25 -44.47 96.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.456 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' ARG . . . . . 0.438 ' CG ' ' HA ' ' A' ' 199' ' ' VAL . 74.9 mtt180 -59.68 -40.52 88.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.005 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.99 -35.07 74.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.882 0.373 . . . . 10.0 110.437 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -68.62 -39.11 80.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.746 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -80.94 -12.84 59.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.59 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -85.66 -9.6 56.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.32 0.581 . . . . 10.0 109.463 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -80.13 165.03 22.87 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.285 -0.87 . . . . 10.0 109.895 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 173' ' ' ASP . . . . . 0.472 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 17.2 m-20 -70.54 -37.05 74.0 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.805 0.336 . . . . 10.0 110.76 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.3 mp -126.52 122.59 61.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.061 179.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 5.8 m -115.7 121.01 41.24 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.886 0.374 . . . . 10.0 111.18 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -99.74 141.67 32.23 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -177.83 172.62 45.26 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.34 -0.933 . . . . 10.0 112.895 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.87 153.45 21.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.805 0.336 . . . . 10.0 111.15 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -63.31 -35.92 81.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.899 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -59.49 -52.19 66.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.169 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.567 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.8 tp10 -69.79 -37.53 76.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.102 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -56.8 -36.04 69.43 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.974 0.416 . . . . 10.0 110.834 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -77.88 -40.03 22.66 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.804 -0.713 . . . . 10.0 111.694 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -64.3 -40.03 95.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.581 0.229 . . . . 10.0 110.58 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -60.43 -41.43 93.99 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.104 0.478 . . . . 10.0 109.973 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 186' ' ' TYR . . . . . 0.434 ' HA ' HE22 ' A' ' 200' ' ' GLN . 43.7 t80 -62.25 -39.54 93.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.518 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 187' ' ' LEU . . . . . 0.4 HD22 ' HB1' ' A' ' 373' ' ' ALA . 87.1 mt -67.4 -44.02 79.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.989 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 64.1 mtm-85 -65.48 -43.56 89.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.953 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 189' ' ' ASP . . . . . 0.411 ' OD1' ' HA ' ' A' ' 198' ' ' ARG . 16.3 m-20 -62.93 -32.91 74.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.79 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -85.27 -0.61 55.24 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.484 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 24.8 ttp -121.58 10.6 10.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.819 0.343 . . . . 10.0 110.848 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -69.74 172.18 7.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.07 -0.513 . . . . 10.0 111.111 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -107.09 -30.02 9.04 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.167 0.508 . . . . 10.0 110.394 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 194' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 197' ' ' GLU . 0.1 OUTLIER -115.42 140.07 25.4 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.734 -0.667 . . . . 10.0 109.577 179.136 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.15 -28.61 87.33 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.696 2.264 . . . . 10.0 113.031 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.02 0.63 52.87 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 121.151 -0.219 . . . . 10.0 111.417 -179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 194' ' ' SER . 32.9 mt-10 -80.06 -11.32 59.78 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 121.234 -0.186 . . . . 10.0 110.71 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 198' ' ' ARG . . . . . 0.411 ' HA ' ' OD1' ' A' ' 189' ' ' ASP . 66.2 mtt180 -58.17 142.42 47.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.622 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 199' ' ' VAL . . . . . 0.438 ' HA ' ' CG ' ' A' ' 167' ' ' ARG . 28.9 m -94.77 -26.7 4.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.482 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 200' ' ' GLN . . . . . 0.434 HE22 ' HA ' ' A' ' 186' ' ' TYR . 4.1 pt20 -107.63 159.73 16.23 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.889 0.376 . . . . 10.0 110.705 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 55.3 mtm180 -82.4 -66.18 0.92 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.75 172.82 7.61 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.497 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 203' ' ' LEU . . . . . 0.436 HD22 ' CZ ' ' A' ' 384' ' ' TYR . 19.5 mt -102.68 124.97 49.21 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -140.59 -56.5 0.52 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.916 0.388 . . . . 10.0 110.325 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -127.12 136.37 52.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.64 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.493 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -132.05 127.29 35.84 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.084 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 47.5 tp -125.65 109.89 13.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.702 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.16 132.26 46.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.214 0.53 . . . . 10.0 111.109 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -49.54 77.38 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.237 -0.892 . . . . 10.0 112.243 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.52 103.97 6.44 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.927 0.394 . . . . 10.0 110.362 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.553 HG11 HD12 ' A' ' 99' ' ' ILE . 30.9 m -74.05 -18.35 17.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.754 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 212' ' ' ASP . . . . . 0.437 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.3 m-20 -46.11 -74.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.561 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 66.0 m -86.84 -19.86 28.34 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.78 0.659 . . . . 10.0 112.78 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 50.3 mt -77.7 -38.98 26.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.316 0.488 . . . . 10.0 112.316 -178.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 215' ' ' LEU . . . . . 0.409 ' O ' ' HB2' ' A' ' 219' ' ' ALA . 18.4 mt -98.44 -42.35 7.37 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -178.444 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 216' ' ' ILE . . . . . 0.437 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 49.5 mm -81.83 -59.04 3.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 112.575 0.583 . . . . 10.0 112.575 -178.522 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.6 -34.36 76.85 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.05 0.759 . . . . 10.0 113.05 -177.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 218' ' ' GLU . . . . . 0.436 ' O ' ' HB2' ' A' ' 377' ' ' PHE . 7.5 mm-40 -97.69 15.8 22.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.66 0.267 . . . . 10.0 111.718 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 219' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 215' ' ' LEU . . . -60.14 -49.54 77.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.936 0.398 . . . . 10.0 111.84 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 220' ' ' ARG . . . . . 0.562 ' O ' ' HD3' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -97.59 32.8 2.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.1 0.476 . . . . 10.0 111.511 -178.436 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 10.0 m -105.25 106.69 56.79 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -91.52 125.65 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.918 2.412 . . . . 10.0 113.318 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 223' ' ' LEU . . . . . 0.538 ' O ' ' HA ' ' A' ' 374' ' ' SER . 88.0 mt -79.8 110.43 15.15 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 178.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 55.7 mt -108.48 130.64 60.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.035 0.445 . . . . 10.0 111.715 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 9.4 mt . . . . . 0 C--N 1.327 -0.376 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.537 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 373' ' ' ALA . . . . . 0.4 ' HB1' HD22 ' A' ' 187' ' ' LEU . . . . . . . . 0 C--O 1.234 0.238 0 N-CA-C 109.858 -0.423 . . . . 10.0 109.858 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 374' ' ' SER . . . . . 0.538 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 16.4 m -152.04 136.53 16.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.655 0.264 . . . . 10.0 111.161 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 17.2 tt -155.83 137.17 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.337 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.38 145.64 27.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.398 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 377' ' ' PHE . . . . . 0.436 ' HB2' ' O ' ' A' ' 218' ' ' GLU . 36.2 m-85 -57.53 -37.65 73.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.654 0.264 . . . . 10.0 110.657 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -57.32 -39.94 76.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.404 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -74.38 -39.16 62.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.024 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -63.68 -46.43 85.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.378 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -74.65 -16.78 60.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.831 0.308 . . . . 10.0 111.831 -179.16 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -80.7 -3.29 50.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.856 0.36 . . . . 10.0 110.539 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 60.7 mt -99.37 4.76 46.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.385 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 384' ' ' TYR . . . . . 0.493 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 21.1 m-85 -99.79 143.68 29.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.147 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -79.27 -70.8 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.928 0.394 . . . . 10.0 110.526 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -89.13 91.92 8.99 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.627 -0.508 . . . . 10.0 109.627 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 54.5 tp -103.27 110.03 21.86 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.012 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -128.96 161.68 29.33 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.18 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.83 165.26 37.01 Favored Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.255 -0.974 . . . . 10.0 112.158 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 46.0 mtm -107.65 143.32 36.28 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.119 -0.326 . . . . 10.0 110.119 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 391' ' ' THR . . . . . 0.452 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 7.1 t -129.51 155.57 45.54 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -80.66 163.57 46.23 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.501 -0.856 . . . . 10.0 112.044 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.63 91.58 0.43 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.166 -0.309 . . . . 10.0 110.166 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 394' ' ' ALA . . . . . 0.602 ' HA ' HD22 ' A' ' 569' ' ' ASN . . . -151.58 -28.72 0.18 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.229 0.455 . . . . 10.0 112.229 -178.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 31.9 t70 58.83 -108.94 0.43 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 109.205 -0.665 . . . . 10.0 109.205 -178.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 6.7 m 58.81 -89.8 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.239 0.829 . . . . 10.0 113.239 177.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -88.76 22.75 2.53 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.003 0.371 . . . . 10.0 112.003 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -60.84 -35.19 75.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.044 0.449 . . . . 10.0 110.946 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -66.51 -20.05 65.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.487 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.64 -22.36 46.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.712 -0.222 . . . . 10.0 110.847 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -63.64 -46.69 84.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 10.0 110.556 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.36 -20.74 58.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.599 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 41.7 m -87.6 -42.5 12.66 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.328 0.492 . . . . 10.0 112.328 -178.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 56.4 mt -91.44 -61.56 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 N-CA-C 112.763 0.653 . . . . 10.0 112.763 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -88.11 -4.76 58.72 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt 60.48 44.42 11.95 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.788 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 407' ' ' LEU . . . . . 0.502 HD13 HD11 ' A' ' 99' ' ' ILE . 20.7 mt -109.8 141.4 42.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.828 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 408' ' ' ASP . . . . . 0.517 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 47.7 t0 -76.87 166.87 22.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 6.9 m -134.35 101.49 5.01 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.057 0.456 . . . . 10.0 111.149 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 62.0 t -106.84 133.53 51.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.068 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 23.6 t -87.15 126.08 40.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.509 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 54.2 t -86.69 128.46 56.43 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.385 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.96 146.35 82.38 Favored 'Trans proline' 0 N--CA 1.463 -0.292 0 C-N-CA 122.436 2.091 . . . . 10.0 112.095 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.75 145.4 45.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.873 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 415' ' ' ASN . . . . . 0.424 ' HB3' ' HG2' ' A' ' 578' ' ' GLN . 62.8 t30 -56.89 -38.03 72.21 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.268 0.556 . . . . 10.0 110.514 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 416' ' ' ARG . . . . . 0.437 ' HB2' ' O ' ' A' ' 578' ' ' GLN . 71.1 mtm180 -129.66 151.32 77.86 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.451 179.205 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -61.77 116.26 3.33 Favored 'Trans proline' 0 N--CA 1.465 -0.167 0 C-N-CA 122.6 2.2 . . . . 10.0 111.84 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 48.8 mtm -64.32 118.53 8.81 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.969 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 419' ' ' ILE . . . . . 0.437 HG13 ' HA ' ' A' ' 581' ' ' ALA . 6.4 pt -108.29 30.9 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.359 0.6 . . . . 10.0 110.348 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 420' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 420' ' ' ARG . 36.1 ttp180 -77.2 122.66 25.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.279 -0.873 . . . . 10.0 109.45 179.171 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 27.0 mmtp -88.76 101.47 14.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.996 0.427 . . . . 10.0 111.104 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -88.4 114.99 25.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.01 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 74.5 mt -94.32 156.09 39.14 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.493 -0.322 . . . . 10.0 110.542 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -65.94 170.28 11.88 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.694 2.263 . . . . 10.0 113.006 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -85.67 129.15 34.9 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.461 -0.791 . . . . 10.0 110.596 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.28 92.08 4.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.353 0.596 . . . . 10.0 110.189 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 427' ' ' VAL . . . . . 0.628 HG22 ' HB2' ' A' ' 588' ' ' LEU . 25.6 t -87.75 122.04 38.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.545 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 428' ' ' TYR . . . . . 0.424 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 2.5 m-85 -105.36 -176.71 3.16 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 429' ' ' MET . . . . . 0.426 ' HB2' ' OE2' ' A' ' 433' ' ' GLU . 12.8 mmt -78.09 -74.16 0.28 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.94 0.4 . . . . 10.0 111.342 -178.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 73.2 p -89.53 174.01 8.01 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.869 -178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -71.91 -36.04 69.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.39 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.63 -41.12 85.23 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.571 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 433' ' ' GLU . . . . . 0.426 ' OE2' ' HB2' ' A' ' 429' ' ' MET . 33.1 mt-10 -62.51 -45.38 93.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.143 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 434' ' ' LYS . . . . . 0.539 ' O ' HG13 ' A' ' 438' ' ' ILE . 38.7 ttpt -58.67 -50.46 73.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.706 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 435' ' ' ILE . . . . . 0.479 ' O ' HG12 ' A' ' 439' ' ' ILE . 49.7 mm -62.33 -43.48 98.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.905 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -59.6 -39.92 85.78 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.615 0.245 . . . . 10.0 110.886 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.35 87.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.338 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 438' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 434' ' ' LYS . 70.1 mt -65.53 -45.88 91.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.952 179.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 439' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 435' ' ' ILE . 50.2 mm -58.31 -40.48 78.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.893 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -63.96 -50.42 68.66 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.389 -0.368 . . . . 10.0 110.707 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -58.36 -42.06 86.1 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.127 0.489 . . . . 10.0 110.557 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.442 HG12 HG11 ' A' ' 452' ' ' VAL . 79.2 mt -67.26 -50.7 60.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.637 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -50.01 -49.31 51.21 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.372 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 444' ' ' GLU . . . . . 0.431 ' O ' ' HD3' ' A' ' 448' ' ' LYS . 0.0 OUTLIER -56.74 -47.22 80.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.528 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 47.8 mtt-85 -74.34 -22.24 59.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.016 -0.538 . . . . 10.0 112.19 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 27.4 m -69.4 -39.46 77.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.175 0.512 . . . . 10.0 109.917 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -74.06 -34.17 63.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.943 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 448' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 444' ' ' GLU . 14.0 mptt -70.13 -58.57 3.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.143 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 127.88 35.9 0.5 Allowed Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.667 -0.778 . . . . 10.0 112.267 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -113.43 126.53 28.02 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 110.158 -0.312 . . . . 10.0 110.158 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.44 140.6 58.31 Favored 'Trans proline' 0 C--O 1.237 0.455 0 C-N-CA 122.524 2.149 . . . . 10.0 111.503 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 452' ' ' VAL . . . . . 0.442 HG11 HG12 ' A' ' 442' ' ' ILE . 85.4 t -125.28 126.62 71.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.246 -178.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 37.6 tp -112.99 107.75 16.41 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.781 -0.645 . . . . 10.0 109.352 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 20.8 t -93.72 126.0 46.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.266 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -106.56 109.48 3.11 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.7 -0.762 . . . . 10.0 111.996 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 2.7 p -97.66 142.15 29.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.733 0.302 . . . . 10.0 110.72 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 30.3 pt -84.39 -20.76 8.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.789 0.328 . . . . 10.0 111.229 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 458' ' ' SER . . . . . 0.487 ' HB3' ' OE2' ' A' ' 460' ' ' GLU . 57.7 m -134.38 145.43 48.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.962 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 459' ' ' ILE . . . . . 0.407 HG12 HG21 ' A' ' 504' ' ' THR . 16.8 mt -62.93 -33.86 62.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.249 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.487 ' OE2' ' HB3' ' A' ' 458' ' ' SER . 2.7 mp0 -59.03 -35.73 73.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.343 -0.844 . . . . 10.0 111.143 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.61 -29.11 51.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.751 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 9.8 m -63.45 -41.21 98.63 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.342 0.591 . . . . 10.0 110.067 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -68.46 -30.58 69.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.488 -0.778 . . . . 10.0 110.656 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 57.0 tp -70.64 -53.81 14.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.828 -0.624 . . . . 10.0 111.144 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 14.6 p -63.51 -31.4 52.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 120.884 0.374 . . . . 10.0 110.836 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.9 t -66.3 -38.35 87.53 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.881 0.372 . . . . 10.0 110.021 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -61.67 -49.19 77.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.764 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -65.12 -40.49 94.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.329 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 27.0 mt -61.69 -34.94 76.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.939 0.399 . . . . 10.0 110.329 179.233 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 23.4 m -72.26 -33.55 67.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.162 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -67.39 -37.37 83.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.455 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -77.62 -23.73 49.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.141 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 87.41 33.78 11.26 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.948 -0.644 . . . . 10.0 111.844 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 78.3 mt -100.68 131.19 48.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.669 0.271 . . . . 10.0 110.828 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -63.05 124.64 21.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.116 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 50.2 p-80 -154.85 159.42 40.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.802 0.334 . . . . 10.0 111.216 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -141.37 132.77 26.73 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.166 178.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 478' ' ' VAL . . . . . 0.455 HG22 HD12 ' A' ' 502' ' ' ILE . 40.0 t -97.81 123.69 50.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.751 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.514 HD22 ' HG3' ' A' ' 487' ' ' GLU . 55.5 mt -81.36 146.48 30.31 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.419 -0.585 . . . . 10.0 109.419 179.082 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -157.78 135.78 10.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.124 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -60.04 -25.87 65.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.352 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -62.32 -33.44 74.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.231 0.539 . . . . 10.0 110.305 179.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -116.64 35.27 4.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.629 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -58.0 -24.86 59.94 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.289 -178.545 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -62.92 -42.97 99.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.928 0.395 . . . . 10.0 110.84 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -86.03 -28.24 24.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.956 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 487' ' ' GLU . . . . . 0.514 ' HG3' HD22 ' A' ' 479' ' ' LEU . 19.0 tt0 -55.42 -40.32 71.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.22 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -57.92 -29.11 64.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.942 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -84.03 -36.54 23.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.128 0.49 . . . . 10.0 110.418 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 53.9 mt -69.17 -45.93 78.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.095 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 71.9 t -61.09 -34.21 59.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.085 0.469 . . . . 10.0 110.946 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -65.91 -24.28 66.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.48 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 493' ' ' GLN . . . . . 0.474 ' NE2' ' H ' ' A' ' 518' ' ' SER . 53.7 mm-40 -115.44 16.84 16.63 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.826 0.346 . . . . 10.0 110.753 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.87 -12.97 61.85 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.402 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -89.19 7.69 81.53 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.781 -0.723 . . . . 10.0 112.211 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -69.84 141.53 89.91 Favored Pre-proline 0 C--N 1.328 -0.364 0 C-N-CA 122.319 0.248 . . . . 10.0 110.515 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -52.54 126.22 20.21 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.718 2.279 . . . . 10.0 113.04 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 67.92 24.92 7.88 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.487 -0.778 . . . . 10.0 112.57 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -94.88 110.28 22.18 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 10.0 110.261 178.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 38.6 t -92.16 109.71 21.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.106 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 1.2 m -116.4 130.16 56.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.799 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 502' ' ' ILE . . . . . 0.455 HD12 HG22 ' A' ' 478' ' ' VAL . 28.9 mt -105.6 115.26 47.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.042 -0.526 . . . . 10.0 109.734 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -103.67 111.3 23.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.907 0.384 . . . . 10.0 111.191 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 504' ' ' THR . . . . . 0.407 HG21 HG12 ' A' ' 459' ' ' ILE . 13.1 m -82.32 110.94 17.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.411 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 13.3 t30 62.79 91.61 0.07 Allowed 'General case' 0 N--CA 1.465 0.275 0 O-C-N 123.686 0.616 . . . . 10.0 111.0 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 1.3 mmt -75.05 113.8 12.8 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.762 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -64.95 168.71 6.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.98 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -58.98 142.11 46.63 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 121.165 -0.541 . . . . 10.0 113.026 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 69.26 -80.1 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.354 0.662 . . . . 10.0 111.502 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.17 143.42 11.4 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.732 -0.747 . . . . 10.0 112.165 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.81 147.02 35.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.905 0.383 . . . . 10.0 111.349 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -76.23 93.92 3.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.528 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 55.0 mt -69.55 121.85 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.482 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 7.4 t -90.27 133.52 31.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.671 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 61.2 mt -70.45 135.54 48.76 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.412 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 85.85 0.34 87.57 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.085 -0.579 . . . . 10.0 111.773 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 106.6 -170.0 15.83 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 110.784 -0.927 . . . . 10.0 110.784 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 518' ' ' SER . . . . . 0.474 ' H ' ' NE2' ' A' ' 493' ' ' GLN . 2.8 p -128.07 98.99 5.3 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 117.235 0.517 . . . . 10.0 110.918 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 33.2 p-90 -59.55 -28.47 67.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.076 0.465 . . . . 10.0 110.206 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -62.57 -32.26 73.22 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.646 -0.707 . . . . 10.0 110.681 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -85.12 -35.91 21.46 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.225 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -63.6 -45.56 89.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.899 -0.591 . . . . 10.0 111.013 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 33.8 m -70.74 -22.35 23.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.99 0.424 . . . . 10.0 110.806 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -81.13 -23.26 38.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.64 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -73.32 -21.83 60.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.532 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 91.7 mt -79.44 127.02 31.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.176 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -63.55 -33.76 76.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.299 0.571 . . . . 10.0 109.462 179.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -120.46 93.92 48.54 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 115.307 -0.861 . . . . 10.0 109.258 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -80.72 75.09 5.22 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.114 2.542 . . . . 10.0 111.956 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.97 144.6 55.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.598 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.97 -43.49 60.48 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.328 0.492 . . . . 10.0 112.328 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -59.8 -44.4 94.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.989 0.423 . . . . 10.0 110.949 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.08 -40.77 91.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.717 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 91.4 mt -60.92 -43.55 96.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -66.6 -41.86 87.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.319 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -62.04 -47.37 85.02 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.275 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 85.2 mt -66.29 -33.8 65.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.787 0.327 . . . . 10.0 110.544 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 31.4 ttmt -63.66 -49.81 71.73 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -66.37 -36.14 82.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.317 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 540' ' ' ASP . . . . . 0.6 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 19.7 t70 -62.9 -52.06 64.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.718 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 47.8 t90 -61.87 -37.96 86.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.866 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -50.98 -49.86 59.36 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.297 -0.41 . . . . 10.0 111.107 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 47.4 t -64.58 -45.1 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.994 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 544' ' ' ARG . . . . . 0.6 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 5.8 mtm180 -64.23 -35.79 81.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.936 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -68.94 -48.4 63.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.741 -0.663 . . . . 10.0 111.178 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -69.11 -26.01 64.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.626 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -65.46 -36.79 84.94 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.266 0.555 . . . . 10.0 109.576 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.2 -32.75 55.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.709 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 85.4 mt -61.84 -47.19 86.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.904 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -76.49 -18.9 58.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.737 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -75.4 -33.68 61.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.641 179.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 134.55 10.36 1.65 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.444 -0.884 . . . . 10.0 113.21 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 73.07 -168.28 53.74 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.859 -0.686 . . . . 10.0 112.672 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 40.9 tp -72.78 117.11 14.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.958 0.408 . . . . 10.0 110.078 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -92.7 113.79 26.16 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.011 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 10.9 mm -94.87 137.63 22.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.31 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 557' ' ' ILE . . . . . 0.486 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 23.7 mt -127.74 128.87 69.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.64 0.257 . . . . 10.0 110.343 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -106.8 120.25 6.18 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 111.404 -0.678 . . . . 10.0 111.404 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 17.3 p -74.71 -37.38 62.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.126 0.489 . . . . 10.0 110.907 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -138.61 140.76 39.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.081 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 561' ' ' ARG . . . . . 0.461 ' H ' HD21 ' A' ' 588' ' ' LEU . 23.4 mmt180 -82.81 141.39 32.34 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.335 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.74 151.15 23.64 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.9 -0.32 . . . . 10.0 110.377 -179.461 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -41.99 68.21 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 179.461 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 36.3 t -81.18 115.65 20.7 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.398 -0.819 . . . . 10.0 109.064 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -66.33 -27.87 68.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.657 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 566' ' ' ARG . . . . . 0.494 ' HA ' ' HB1' ' A' ' 394' ' ' ALA . 8.3 ttm180 -62.03 -37.09 83.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.064 0.459 . . . . 10.0 110.37 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 44.1 mt -88.71 -31.23 5.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.324 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -66.02 -44.77 83.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.185 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 569' ' ' ASN . . . . . 0.602 HD22 ' HA ' ' A' ' 394' ' ' ALA . 46.3 t30 -71.25 -23.64 62.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.885 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -63.2 -29.15 70.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.84 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 29.2 tp -72.1 -35.98 69.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.072 0.463 . . . . 10.0 110.167 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 572' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 572' ' ' ARG . 12.7 ttp180 -75.36 -31.09 60.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.256 0.55 . . . . 10.0 110.031 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -76.26 0.68 62.84 Favored Glycine 0 CA--C 1.519 0.303 0 CA-C-N 115.659 -0.701 . . . . 10.0 113.188 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.52 -33.35 72.68 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.794 0.33 . . . . 10.0 110.397 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 2.6 t -98.68 169.93 9.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.165 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 63.96 50.87 57.87 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.693 -0.765 . . . . 10.0 111.47 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 577' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' A' ' 580' ' ' ASP . 27.6 mtt180 -79.6 126.24 30.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.751 0.31 . . . . 10.0 110.996 -179.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 578' ' ' GLN . . . . . 0.601 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 7.4 tt0 56.76 32.6 21.51 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.626 -0.715 . . . . 10.0 110.746 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 78.18 43.08 14.06 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.797 -0.638 . . . . 10.0 112.651 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 580' ' ' ASP . . . . . 0.468 ' HB2' ' O ' ' A' ' 577' ' ' ARG . 0.9 OUTLIER -100.11 -170.3 1.86 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.714 0.292 . . . . 10.0 110.841 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 581' ' ' ALA . . . . . 0.437 ' HA ' HG13 ' A' ' 419' ' ' ILE . . . -83.89 172.37 12.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.114 -179.369 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 146.94 174.13 18.76 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.783 -0.723 . . . . 10.0 112.107 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 2.0 p -157.69 155.48 30.05 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.872 -0.418 . . . . 10.0 109.872 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 79.9 p -131.15 135.85 47.82 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.052 0.453 . . . . 10.0 110.578 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 585' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 1.6 tpm_? -139.29 116.97 11.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -108.47 148.02 30.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.99 0.424 . . . . 10.0 111.147 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 587' ' ' TYR . . . . . 0.535 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 84.4 m-85 -129.16 158.98 37.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.486 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 588' ' ' LEU . . . . . 0.628 ' HB2' HG22 ' A' ' 427' ' ' VAL . 13.2 mt -157.62 169.29 24.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.857 0.361 . . . . 10.0 110.922 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 589' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.7 OUTLIER -123.85 155.92 37.14 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.328 178.703 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 60.9 mmm -72.59 -15.22 61.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.292 0.568 . . . . 10.0 110.73 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 591' ' ' GLU . . . . . 0.41 ' H ' ' HG2' ' A' ' 591' ' ' GLU . 4.1 pt-20 -118.79 29.86 7.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.243 -0.89 . . . . 10.0 109.017 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 592' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 589' ' ' SER . 1.0 OUTLIER -82.25 176.96 9.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.188 -0.914 . . . . 10.0 111.798 -178.874 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.03 77.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.525 -0.761 . . . . 10.0 111.606 -179.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 594' ' ' LEU . . . . . 0.556 ' O ' HG12 ' A' ' 597' ' ' ILE . 5.2 tp -68.69 -21.74 64.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.859 0.361 . . . . 10.0 110.945 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 13.1 mmt -77.27 9.58 3.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.416 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -106.16 -12.69 15.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.642 0.258 . . . . 10.0 110.542 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 597' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 594' ' ' LEU . 18.8 pt -88.33 -1.71 8.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.855 0.36 . . . . 10.0 111.375 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -82.29 -9.15 59.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.964 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 69.84 -59.63 0.5 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.99 0.806 . . . . 10.0 111.908 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.5 m -88.79 115.03 26.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.713 0.292 . . . . 10.0 110.864 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -64.06 -23.3 67.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.197 0.522 . . . . 10.0 110.538 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 3.0 mmt180 -59.01 -24.48 62.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.481 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 76.4 t -68.17 -49.68 65.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 1.4 m -65.27 -36.94 85.66 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.551 -0.75 . . . . 10.0 110.0 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -63.47 -39.11 97.34 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.01 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 61.1 tpp -74.52 -27.92 60.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.121 0.486 . . . . 10.0 110.619 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 39.7 mtt -74.29 -18.94 60.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.347 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 74.5 mtt-85 -77.5 6.11 7.68 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.053 0.454 . . . . 10.0 110.704 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -94.76 2.58 55.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.859 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 77.1 mt -80.93 -9.79 59.79 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.343 -0.389 . . . . 10.0 111.037 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 611' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 83.85 -50.84 4.47 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.914 -0.66 . . . . 10.0 111.934 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 612' ' ' MET . . . . . 0.442 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.7 OUTLIER 73.66 -61.07 0.51 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.834 0.853 . . . . 10.0 111.847 179.145 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? 62.85 93.17 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.301 0 O-C-N 123.536 0.523 . . . . 10.0 110.603 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 614' ' ' PRO . . . . . 0.424 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 38.2 Cg_exo -57.09 94.94 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.136 2.558 . . . . 10.0 112.269 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 142.85 -29.47 2.1 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.831 -0.699 . . . . 10.0 111.916 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.59 140.66 37.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.943 0.402 . . . . 10.0 110.981 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -95.72 114.15 25.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.071 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.08 -37.62 78.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.795 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 51.78 74.67 0.25 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.763 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.97 105.23 20.39 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 120.86 0.362 . . . . 10.0 110.726 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.91 -21.27 25.67 Favored 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.659 2.906 . . . . 10.0 114.585 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 9.5 p-90 -60.43 -29.3 68.91 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 120.662 -0.415 . . . . 10.0 110.493 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 60.3 t -65.54 -48.85 81.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 85.1 m -61.36 -37.97 85.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.408 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -64.67 -42.47 95.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.122 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.09 94.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.641 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.1 -50.44 76.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.447 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -62.76 -35.73 80.76 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.116 0.484 . . . . 10.0 110.797 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 629' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' A' ' 633' ' ' LYS . 63.2 t30 -65.85 -44.56 85.12 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.849 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -67.15 -42.11 84.91 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.08 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -58.64 -40.54 83.68 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.379 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -61.57 -38.45 87.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.377 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 633' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 629' ' ' ASN . 26.1 mmtp -65.37 -37.79 88.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.166 -179.307 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 53.7 t -62.34 -47.1 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.081 0.467 . . . . 10.0 110.36 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -69.24 -35.78 76.48 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.67 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 49.1 m -64.63 -36.51 84.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.019 0.438 . . . . 10.0 110.04 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -67.89 -31.92 72.05 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -66.95 -38.14 85.58 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -65.02 -37.14 86.67 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.006 -0.543 . . . . 10.0 109.735 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 640' ' ' ASP . . . . . 0.633 ' O ' ' HG2' ' A' ' 644' ' ' GLN . 25.6 t0 -60.54 -35.84 76.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.636 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 59.1 mt -80.02 -38.57 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.325 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 642' ' ' ARG . . . . . 0.474 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 14.0 mtm-85 -61.71 -43.14 99.42 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.648 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 643' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 12.1 pttm -66.0 -26.88 67.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.868 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 644' ' ' GLN . . . . . 0.633 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 16.2 mm100 -65.03 -45.75 84.18 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 48.5 mt -65.63 -41.7 92.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.039 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 646' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 90.7 mt -63.5 -29.63 70.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.372 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.69 -28.32 69.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.078 0.465 . . . . 10.0 110.738 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -96.84 -28.28 14.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.621 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -75.38 -34.64 61.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.184 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 650' ' ' ASP . . . . . 0.505 ' O ' ' HB3' ' A' ' 653' ' ' ASN . 2.6 t0 -66.36 -23.51 66.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.13 0.49 . . . . 10.0 110.512 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 36.2 t -67.2 -42.01 87.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.319 0.58 . . . . 10.0 109.466 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -73.71 -22.5 59.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.473 -0.785 . . . . 10.0 109.912 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 653' ' ' ASN . . . . . 0.505 ' HB3' ' O ' ' A' ' 650' ' ' ASP . 18.1 t30 -61.39 -48.95 78.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.441 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -62.09 -46.85 87.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.62 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -62.67 -45.48 92.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.781 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 656' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 656' ' ' ARG . 11.2 ttp-105 -63.57 -40.76 97.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.332 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 30.9 ttp85 -61.74 -50.49 72.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.64 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -62.02 -49.08 77.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.732 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 659' ' ' ILE . . . . . 0.444 ' O ' ' HB2' ' A' ' 663' ' ' ARG . 8.7 tp -66.1 -34.52 70.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 116.628 -0.26 . . . . 10.0 111.6 -178.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -69.84 -34.21 73.33 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.731 0.301 . . . . 10.0 110.266 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.3 m -63.0 -54.26 41.05 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.112 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -62.12 -39.2 91.74 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.688 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 659' ' ' ILE . 2.2 tmt_? -60.44 -34.07 73.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.621 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -83.36 -37.75 22.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.714 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 665' ' ' GLU . . . . . 0.443 ' O ' HG22 ' A' ' 669' ' ' VAL . 35.3 mt-10 -57.86 -48.44 79.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.418 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 45.7 mt -72.21 -14.72 61.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.21 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 34.9 tp -86.16 -44.38 12.25 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.492 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -68.1 -53.94 21.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.898 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 665' ' ' GLU . 29.4 m -59.99 150.9 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 112.26 0.467 . . . . 10.0 112.26 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.57 -50.6 5.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.482 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -83.48 150.37 26.05 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.238 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 672' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 676' ' ' ILE . 6.6 p -141.07 8.74 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.051 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 15.4 m -49.84 -49.28 49.62 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.681 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.94 -51.85 67.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.767 -178.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 675' ' ' THR . . . . . 0.488 ' O ' HG12 ' A' ' 679' ' ' ILE . 2.0 m -60.48 -50.49 73.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.158 -0.474 . . . . 10.0 112.084 -179.209 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 676' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 672' ' ' VAL . 14.1 mm -62.13 -38.59 81.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 121.152 -0.219 . . . . 10.0 111.518 -178.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -68.36 -42.77 78.72 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.167 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 45.0 m -58.09 -44.03 87.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.911 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 679' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 675' ' ' THR . 24.3 pt -79.6 -24.71 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.953 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 18.8 mtm-85 -61.32 -50.45 72.91 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.147 0.499 . . . . 10.0 110.059 178.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.98 -35.4 74.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.377 -0.829 . . . . 10.0 110.692 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -66.03 -47.21 75.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.639 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 44.5 t -61.9 -45.75 98.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.189 -0.459 . . . . 10.0 111.444 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -59.78 -42.68 93.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.585 -0.28 . . . . 10.0 110.618 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -62.47 -46.01 90.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.09 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.59 99.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.472 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 21.0 m -65.22 -45.92 82.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.695 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.98 -39.32 85.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 10.0 110.253 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.31 -28.1 62.76 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.788 -0.642 . . . . 10.0 112.111 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -70.26 -22.9 62.83 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.479 0.548 . . . . 10.0 112.479 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -119.86 -19.33 7.97 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.704 0.288 . . . . 10.0 111.544 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 692' ' ' ILE . . . . . 0.425 HG23 ' CD1' ' A' ' 701' ' ' TRP . 42.8 mt -128.82 103.67 19.0 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.908 179.207 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -67.45 139.39 49.16 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.675 2.25 . . . . 10.0 111.745 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -50.23 106.27 0.12 Allowed 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.05 2.5 . . . . 10.0 113.215 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 61.7 86.99 0.1 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.478 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 2.3 p -142.9 -165.86 2.16 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.193 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 62.4 mt -99.17 161.79 13.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.465 0.174 . . . . 10.0 110.945 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 698' ' ' GLU . . . . . 0.543 ' HA ' ' CE3' ' A' ' 701' ' ' TRP . 15.0 tt0 -58.07 -31.27 66.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.314 -179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -66.13 -24.14 66.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.179 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 54.9 mtp -95.57 4.57 53.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.389 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 701' ' ' TRP . . . . . 0.543 ' CE3' ' HA ' ' A' ' 698' ' ' GLU . 50.2 m0 -103.2 111.88 24.48 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.733 0.301 . . . . 10.0 111.297 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -81.91 78.59 8.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.75 -0.833 . . . . 10.0 108.75 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 703' ' ' ILE . . . . . 0.557 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 44.5 mm -56.39 -51.9 77.35 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.243 -0.889 . . . . 10.0 111.951 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 704' ' ' PRO . . . . . 0.557 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 35.9 Cg_exo -60.65 -44.33 27.14 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.679 1.586 . . . . 10.0 111.836 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -61.1 -39.2 96.79 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.947 -0.644 . . . . 10.0 112.744 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 64.1 tp -78.1 -45.17 24.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.655 0.264 . . . . 10.0 111.392 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -59.67 -49.68 76.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.277 -0.42 . . . . 10.0 111.017 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -65.98 -30.3 70.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.88 0.372 . . . . 10.0 110.291 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 709' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 709' ' ' ARG . 5.2 tpt180 -62.74 -49.69 74.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.164 179.171 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 710' ' ' LEU . . . . . 0.411 HD12 HD11 ' A' ' 720' ' ' ILE . 65.3 mt -67.23 -29.25 68.84 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.007 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 711' ' ' LYS . . . . . 0.408 ' HG2' ' HA ' ' A' ' 717' ' ' ASP . 20.1 mtpp -78.13 -18.15 56.0 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.402 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -108.09 -53.3 2.65 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.1 -35.96 69.34 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.665 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -105.87 -12.57 15.8 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 121.061 -0.256 . . . . 10.0 111.348 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.43 24.08 13.98 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.887 -0.597 . . . . 10.0 112.261 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 23.7 tp -113.7 126.95 55.81 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.689 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 717' ' ' ASP . . . . . 0.408 ' HA ' ' HG2' ' A' ' 711' ' ' LYS . 1.5 t0 -81.03 100.71 9.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.792 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.417 HD13 HG23 ' A' ' 739' ' ' ILE . 95.3 mt -113.57 114.15 47.58 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.432 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.69 66.57 8.05 Favored 'Trans proline' 0 CA--C 1.536 0.575 0 C-N-CA 122.93 2.42 . . . . 10.0 112.665 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 720' ' ' ILE . . . . . 0.411 HD11 HD12 ' A' ' 710' ' ' LEU . 68.0 mt -60.5 -46.83 94.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.65 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -64.0 -31.19 72.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.918 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -69.87 -40.88 75.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.566 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 45.0 m0 -66.86 -54.14 25.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.672 -0.694 . . . . 10.0 111.477 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 16.9 tp -63.01 -18.57 63.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 10.0 112.144 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -77.88 -37.39 48.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.48 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -102.21 -25.97 13.5 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.131 0.419 . . . . 10.0 112.131 -178.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -122.11 78.58 42.73 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 121.01 0.433 . . . . 10.0 110.222 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -72.49 -9.05 23.61 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.845 2.363 . . . . 10.0 112.564 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -78.55 -10.84 59.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.836 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 93.4 mt -69.64 -29.37 66.83 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.222 0.534 . . . . 10.0 109.829 178.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 51.53 -95.64 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.624 -1.171 . . . . 10.0 112.147 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -56.01 0.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.611 0.243 . . . . 10.0 111.526 -178.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -56.38 -54.34 46.78 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.797 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.46 -27.22 68.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.027 0.441 . . . . 10.0 110.756 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 25.3 tp -67.39 -43.49 81.19 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 33.7 mtt180 -61.65 -40.23 94.16 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.996 -0.547 . . . . 10.0 109.642 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -60.28 -45.51 93.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.379 -0.828 . . . . 10.0 110.687 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 23.1 mmm-85 -61.08 -45.43 94.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.807 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 739' ' ' ILE . . . . . 0.417 HG23 HD13 ' A' ' 718' ' ' LEU . 97.0 mt -60.99 -52.78 57.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.707 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 21.1 tp -58.25 -46.33 86.16 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.789 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.61 99.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.376 -0.374 . . . . 10.0 111.181 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -62.98 -42.2 99.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.314 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.14 -41.71 98.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.701 0.286 . . . . 10.0 110.797 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 82.3 mt -67.05 -43.18 89.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.84 0.352 . . . . 10.0 110.232 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.97 -44.9 83.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.868 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 85.0 t -70.4 -40.22 77.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.716 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -59.19 -41.45 88.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.795 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -60.48 -31.54 70.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.439 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 749' ' ' ARG . . . . . 0.479 ' O ' HG23 ' A' ' 753' ' ' VAL . 0.1 OUTLIER -66.23 -45.8 79.41 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 179.16 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -64.77 -37.79 88.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.719 -0.673 . . . . 10.0 109.516 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.516 ' HA ' ' HG3' ' A' ' 759' ' ' MET . 27.1 tt0 -62.57 -41.78 99.15 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.17 -0.923 . . . . 10.0 110.963 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -63.22 -41.08 99.08 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.511 -0.313 . . . . 10.0 111.4 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 753' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 749' ' ' ARG . 39.6 t -67.22 -47.17 82.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.272 -0.422 . . . . 10.0 112.021 -179.078 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 39.7 t -77.26 -42.06 30.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.207 0.527 . . . . 10.0 111.106 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 120.51 122.55 2.96 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 110.527 -1.029 . . . . 10.0 110.527 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 756' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -51.01 -46.03 61.39 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.163 0.431 . . . . 10.0 112.163 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.61 -46.15 91.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.984 0.421 . . . . 10.0 110.949 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 15.6 tpt -66.62 -39.66 88.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.283 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 759' ' ' MET . . . . . 0.516 ' HG3' ' HA ' ' A' ' 751' ' ' GLU . 80.9 mmm -61.79 -41.24 97.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.211 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.9 mmp_? -60.29 -39.0 85.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.236 0.541 . . . . 10.0 110.119 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -73.2 -34.83 66.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.802 -0.635 . . . . 10.0 109.644 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 762' ' ' PHE . . . . . 0.415 ' O ' HG23 ' A' ' 766' ' ' VAL . 45.5 t80 -66.86 -48.21 69.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.318 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -57.19 -46.06 83.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.082 0.467 . . . . 10.0 110.294 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -60.73 -42.57 97.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.082 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -64.72 -43.3 96.5 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 111.408 -0.677 . . . . 10.0 111.408 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 766' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 762' ' ' PHE . 63.8 t -60.74 -43.23 94.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 11.9 mtp -60.96 -48.2 82.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.085 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 80.9 mt -60.55 -46.64 89.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.704 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -60.88 -52.68 64.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.361 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 9.4 m -60.2 -44.26 95.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.847 0.356 . . . . 10.0 111.358 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -64.32 -42.62 96.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.238 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 772' ' ' ASP . . . . . 0.621 ' O ' ' HG2' ' A' ' 776' ' ' LYS . 15.7 t70 -61.97 -51.27 68.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.806 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 68.5 m -59.12 -44.48 92.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.079 -0.51 . . . . 10.0 112.371 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 23.5 mt -66.53 -35.02 79.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.712 0.291 . . . . 10.0 111.113 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -64.38 -37.6 88.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.991 0.424 . . . . 10.0 110.009 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.621 ' HG2' ' O ' ' A' ' 772' ' ' ASP . 26.6 mmtp -66.63 -41.32 88.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.398 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -63.02 -48.25 79.59 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 778' ' ' HIS . . . . . 0.608 ' O ' ' HG2' ' A' ' 782' ' ' MET . 72.0 t60 -58.78 -35.97 73.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.034 -0.984 . . . . 10.0 111.199 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 21.3 mt -59.55 -47.92 83.66 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.872 0.368 . . . . 10.0 110.306 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -69.51 -38.61 77.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.165 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.32 -36.03 74.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.412 -0.813 . . . . 10.0 111.192 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 782' ' ' MET . . . . . 0.608 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 98.6 mmm -60.56 -41.16 94.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.048 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.93 -41.67 70.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 10.0 110.096 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -62.15 -42.01 98.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.286 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 11.6 tp -67.94 -39.34 83.46 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.154 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -55.12 -36.53 65.83 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.721 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.535 179.585 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo . . . . . 0 CA--C 1.528 0.193 0 N-CA-C 113.131 0.396 . . . . 10.0 113.131 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 28.1 mtmm -66.26 -55.23 17.15 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -63.64 -38.6 91.74 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.677 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.7 -48.39 82.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.04 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -59.91 -40.64 89.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.406 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -62.83 -47.81 81.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.792 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 37.0 ttp85 -62.44 -44.55 96.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.68 0.276 . . . . 10.0 111.002 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -58.5 -52.78 64.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.261 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 11.5 p -65.28 -39.56 92.74 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.297 0.481 . . . . 10.0 112.297 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -65.99 -44.68 84.14 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 121.032 -0.267 . . . . 10.0 110.89 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 17.5 m -65.71 -38.26 88.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.167 0.508 . . . . 10.0 110.102 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 35.0 ttm -63.85 -35.32 80.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.197 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -65.97 -38.9 89.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.271 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.88 92.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.353 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.46 73.86 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.468 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 17.7 ttp -64.53 -42.87 95.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.823 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 815' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 818' ' ' LEU . 81.0 mt -66.07 -36.27 82.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.414 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -64.57 -38.05 89.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.227 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 13.0 m -73.51 -30.14 62.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.105 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 818' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 815' ' ' LEU . 14.1 tp -58.77 -61.64 2.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.134 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 819' ' ' LYS . . . . . 0.415 ' O ' HG12 ' A' ' 823' ' ' ILE . 44.0 pttt -60.01 -36.24 76.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.011 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -60.08 -57.41 12.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.196 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -63.74 -37.67 88.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.836 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 41.1 t -57.91 -51.85 65.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.891 0.377 . . . . 10.0 110.71 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 823' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 819' ' ' LYS . 30.4 mm -68.22 -37.92 78.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.647 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 46.4 t -60.01 -48.42 81.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.169 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 24.6 m -60.43 -40.61 91.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.494 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 96.0 mt -69.65 -23.03 63.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.275 -0.421 . . . . 10.0 111.812 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 7.5 m -93.4 -36.42 12.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.801 0.334 . . . . 10.0 110.481 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 51.2 mttm -67.5 -28.3 67.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.783 -0.644 . . . . 10.0 112.133 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 6.6 p -65.51 112.13 1.68 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 121.573 0.701 . . . . 10.0 109.842 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -94.97 117.59 30.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.188 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 12.1 t . . . . . 0 C--N 1.321 -0.644 0 CA-C-N 115.559 -0.746 . . . . 10.0 109.214 179.335 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.2 t80 . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.667 0.27 . . . . 10.0 110.569 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.41 176.0 14.22 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.899 -0.667 . . . . 10.0 112.541 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.5 127.72 32.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.946 0.403 . . . . 10.0 110.506 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.581 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 8.7 mmt180 -70.22 144.52 51.86 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.62 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 73.35 -63.13 0.44 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.097 -0.956 . . . . 10.0 112.059 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.94 -54.47 21.67 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -178.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -86.31 -25.86 25.22 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.966 0.728 . . . . 10.0 112.966 -178.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.0 p -60.61 -46.68 89.37 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.72 -0.392 . . . . 10.0 110.685 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.2 mt -64.46 -31.79 73.15 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.784 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -67.62 -45.78 74.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.072 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -67.4 -44.17 79.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.51 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 39.6 mtt -63.55 -34.04 76.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.88 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.5 tpp180 -61.32 -35.7 78.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.944 0.402 . . . . 10.0 110.304 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -65.52 -39.8 92.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.808 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -69.04 -39.45 79.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.915 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.42 HG13 HD12 ' A' ' 88' ' ' LEU . 52.7 t -58.33 -37.51 63.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 121.277 0.56 . . . . 10.0 109.935 178.828 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -65.45 -38.74 90.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.334 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 72.1 mt -66.64 -45.02 89.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.075 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.5 mt -59.33 -41.76 85.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.642 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -67.55 -27.69 67.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.074 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.25 -26.66 30.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.064 0.459 . . . . 10.0 110.597 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 8.6 tpt -83.95 -18.72 36.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.629 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.493 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 37.2 tt0 -56.98 -52.01 77.32 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.304 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.493 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 71.5 Cg_exo -53.47 -33.41 67.37 Favored 'Trans proline' 0 C--N 1.36 1.159 0 C-N-CA 121.927 1.751 . . . . 10.0 112.178 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -70.52 -40.31 73.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.168 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.3 mmt -66.59 -29.83 69.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.579 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -66.14 -23.09 66.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.562 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.0 mtpt -83.32 -24.2 32.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.046 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp -76.92 142.19 40.2 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.542 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.7 p -82.48 171.12 14.48 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.041 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -57.03 -38.78 73.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.312 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -68.43 -36.33 78.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.904 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.9 -32.11 70.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.285 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.98 -45.4 94.93 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -67.44 -31.45 71.63 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.951 -1.022 . . . . 10.0 109.725 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.81 -37.59 95.11 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.56 -0.746 . . . . 10.0 111.736 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -67.28 -36.26 81.18 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.724 -0.472 . . . . 10.0 109.724 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 19.1 m -58.18 -48.16 81.16 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.162 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.54 -35.25 80.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.342 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.18 -43.2 99.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.553 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -58.79 -43.06 90.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.738 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.7 mtp180 -61.81 -44.23 97.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.656 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' A' ' 56' ' ' LYS . . . -66.67 -39.41 88.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.267 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 -62.83 -39.29 93.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.555 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 mt -58.09 -37.36 74.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.317 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.15 -37.14 72.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.321 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 52' ' ' ALA . 28.4 mtpp -72.72 -9.19 58.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.958 -0.565 . . . . 10.0 111.204 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.67 61.67 0.66 Allowed Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.757 -0.735 . . . . 10.0 111.983 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -116.91 146.1 43.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.718 -0.475 . . . . 10.0 109.718 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 38.2 t -85.84 133.18 30.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.182 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.417 HD11 ' O ' ' A' ' 118' ' ' LEU . 17.8 tp -61.09 -43.89 98.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.918 0.389 . . . . 10.0 110.464 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -65.83 -21.54 66.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.17 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -81.23 -17.36 49.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.243 0.544 . . . . 10.0 110.151 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.1 mt -84.65 -13.29 51.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.079 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.51 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 73.9 mt -50.23 -52.55 52.91 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 113.054 0.761 . . . . 10.0 113.054 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.51 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.0 Cg_exo -53.46 -34.77 73.35 Favored 'Trans proline' 0 C--N 1.36 1.151 0 C-N-CA 122.362 2.041 . . . . 10.0 113.444 -179.355 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.471 ' O ' HG23 ' A' ' 70' ' ' VAL . 38.4 mt-10 -89.58 -46.59 8.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.46 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.482 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -58.8 -47.92 83.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.996 -178.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -63.33 -32.34 73.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.675 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.91 -43.63 78.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.257 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 66' ' ' GLU . 58.3 t -61.08 -47.72 92.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.107 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 67' ' ' ALA . 46.7 t -59.5 -45.21 94.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.34 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.431 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 19.0 ttm180 -61.0 -44.86 96.8 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.604 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 29.1 tp10 -61.05 -48.4 81.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.376 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.99 -33.27 74.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.079 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 29.8 m -61.04 -35.89 78.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.746 0.307 . . . . 10.0 111.059 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -75.06 -16.89 60.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.296 -0.411 . . . . 10.0 112.028 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -104.24 -35.83 7.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.762 0.315 . . . . 10.0 111.518 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 92.8 t -81.41 -52.52 13.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.614 -0.266 . . . . 10.0 111.64 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -104.22 -14.05 15.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.656 0.265 . . . . 10.0 111.562 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.22 29.09 66.96 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.714 -0.755 . . . . 10.0 111.552 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.5 mtt -126.49 141.23 51.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.799 0.333 . . . . 10.0 110.791 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 37.0 ttt85 -85.59 122.67 30.03 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.95 111.06 1.52 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -47.23 141.12 4.76 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 124.139 0.9 . . . . 10.0 112.307 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -64.17 -34.42 78.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.338 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 m -69.58 -25.19 28.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.847 0.355 . . . . 10.0 110.839 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -71.67 -28.4 63.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.826 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.42 HD12 HG13 ' A' ' 25' ' ' VAL . 85.2 mt -62.03 -36.78 82.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.055 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 36.0 mt -66.15 -47.88 72.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.826 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -63.14 -36.45 93.46 Favored Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.712 -0.677 . . . . 10.0 112.164 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.76 -34.57 89.12 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.195 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.416 ' HG3' ' O ' ' A' ' 88' ' ' LEU . 38.4 mtt -74.21 -35.87 63.93 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.2 t -65.47 -43.05 94.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 10.0 110.02 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 84.3 mt -72.92 -5.35 37.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.268 -0.878 . . . . 10.0 111.966 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -83.29 -24.67 32.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.892 0.377 . . . . 10.0 110.383 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -103.37 -146.33 0.37 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.585 -179.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 97' ' ' ARG . 28.7 ttt85 -108.07 58.98 0.61 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.168 0.509 . . . . 10.0 110.189 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 408' ' ' ASP . 0.0 OUTLIER -137.57 150.19 47.28 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.335 0.588 . . . . 10.0 111.981 -178.862 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.552 HD12 HG11 ' A' ' 211' ' ' VAL . 50.7 mm -93.46 132.55 37.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.373 -0.831 . . . . 10.0 108.881 178.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -107.6 120.11 41.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.735 0.302 . . . . 10.0 111.703 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -85.47 125.68 33.22 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.4 mtm -122.48 140.6 52.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.076 0.465 . . . . 10.0 110.886 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.497 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 11.5 mmm180 -77.1 152.19 35.08 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.563 -0.744 . . . . 10.0 111.082 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.65 94.68 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.9 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.2 -33.48 1.23 Allowed Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.824 -0.703 . . . . 10.0 112.353 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.623 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 2.2 mm-40 -65.56 -49.42 68.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.013 0.435 . . . . 10.0 110.292 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 143.79 168.03 12.08 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.753 -0.737 . . . . 10.0 112.085 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.97 -82.63 0.65 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.93 0.395 . . . . 10.0 110.461 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.03 -20.86 66.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.166 0.508 . . . . 10.0 111.117 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 27.7 tp -70.02 -19.96 63.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.252 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 3.2 m -95.72 -36.6 11.13 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.194 0.521 . . . . 10.0 110.654 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.624 ' HB1' HD21 ' A' ' 207' ' ' LEU . . . -75.98 -4.66 42.35 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.863 0.69 . . . . 10.0 112.863 -178.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.06 -24.28 61.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.947 0.403 . . . . 10.0 111.27 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.409 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 17.7 mt -71.15 -57.13 4.95 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-N 116.11 -0.495 . . . . 10.0 111.795 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 29.4 Cg_endo -61.92 -30.62 83.98 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 122.17 1.914 . . . . 10.0 112.222 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.55 -47.16 73.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.635 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.434 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 65.4 t80 -61.25 -46.15 91.59 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.068 0.461 . . . . 10.0 110.477 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.417 ' O ' HD11 ' A' ' 60' ' ' LEU . 20.5 tp -61.86 -50.39 72.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.629 -0.714 . . . . 10.0 112.007 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -68.2 -28.42 67.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.24 -28.51 67.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.396 0.141 . . . . 10.0 111.34 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 85.9 mt -55.38 -29.24 58.08 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 76.7 p -66.29 -26.82 67.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.632 -0.258 . . . . 10.0 111.363 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.36 -1.33 87.41 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.389 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -76.53 -21.41 55.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.717 0.294 . . . . 10.0 110.953 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 101.12 138.04 10.05 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.708 -0.758 . . . . 10.0 113.778 178.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 68.4 t -107.04 121.39 59.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -98.41 102.7 14.52 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.67 0.271 . . . . 10.0 110.782 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 26.2 t -95.59 125.06 48.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.905 0.384 . . . . 10.0 110.447 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 79.3 t -110.48 117.59 55.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.453 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.87 160.76 14.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.955 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 13.2 m -67.24 -35.25 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -145.63 161.35 40.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.518 -0.31 . . . . 10.0 110.187 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -67.37 -28.83 68.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.697 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -55.3 -53.7 52.83 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.132 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.3 mt -74.23 -32.92 63.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.877 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -53.83 -49.98 67.19 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.833 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -72.1 -36.41 69.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.856 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 17.6 ttp180 -62.61 -59.64 4.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.966 -0.561 . . . . 10.0 112.13 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.63 -29.31 69.32 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.667 -178.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.45 88.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 10.0 110.55 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -75.8 -26.0 56.88 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.154 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ASN . . . . . 0.435 ' O ' ' HD2' ' A' ' 145' ' ' PRO . 11.3 t30 -73.43 -40.82 63.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.021 0.439 . . . . 10.0 110.634 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -86.92 -6.81 58.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.367 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.512 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 61.7 ttm-85 -60.01 -49.46 91.06 Favored Pre-proline 0 CA--C 1.537 0.467 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' PRO . . . . . 0.512 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 34.1 Cg_exo -63.81 -10.37 22.25 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 122.155 1.903 . . . . 10.0 112.886 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 20.3 tp -96.07 -48.92 5.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.935 0.398 . . . . 10.0 110.424 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -71.54 -51.11 25.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.012 -0.54 . . . . 10.0 112.18 -178.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -65.27 -23.48 67.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.677 0.275 . . . . 10.0 111.438 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -67.17 -28.92 68.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.105 0.479 . . . . 10.0 110.037 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 43.9 mt -96.9 -2.41 43.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.006 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 98.82 22.8 12.81 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.598 -0.811 . . . . 10.0 113.502 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 43.2 mt -109.76 121.8 46.05 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.7 p -78.4 130.32 35.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.016 0.436 . . . . 10.0 112.024 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 48.3 t -104.74 127.88 58.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.933 -0.576 . . . . 10.0 109.971 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -123.02 142.72 14.73 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.613 -0.803 . . . . 10.0 112.264 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 6.6 tp -112.85 134.55 55.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -121.34 110.29 15.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.856 0.36 . . . . 10.0 110.247 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 161' ' ' MET . 94.1 mt -102.4 147.75 34.44 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.617 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 159' ' ' PRO . . . . . 0.519 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 16.7 Cg_endo -58.49 114.26 1.91 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.7 2.267 . . . . 10.0 112.232 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 99.63 6.96 54.36 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.771 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' MET . . . . . 0.49 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.1 OUTLIER -67.27 144.8 98.36 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 110.529 -0.174 . . . . 10.0 110.529 179.57 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -57.3 149.56 64.0 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.635 2.223 . . . . 10.0 112.301 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' ALA . . . . . 0.507 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.09 -49.86 82.03 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 112.769 0.655 . . . . 10.0 112.769 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.507 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 53.0 Cg_exo -57.15 -41.39 74.66 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 121.774 1.65 . . . . 10.0 112.029 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -63.08 -44.42 95.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.661 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.459 ' HE2' ' O ' ' A' ' 161' ' ' MET . 59.6 mttm -60.86 -45.44 94.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.432 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -57.83 -42.69 84.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.821 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 164' ' ' PRO . 58.2 mt-10 -66.28 -39.12 89.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.784 0.326 . . . . 10.0 111.024 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -69.44 -42.56 74.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.584 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -74.7 -31.2 61.8 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.449 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.12 3.26 18.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.882 0.372 . . . . 10.0 110.832 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -84.59 -179.17 7.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.148 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -79.22 -42.59 25.62 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.1 mp -128.78 121.51 54.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.281 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.7 m -108.74 123.34 48.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.84 0.352 . . . . 10.0 111.353 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -102.71 131.26 49.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.747 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.62 176.74 44.05 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.568 -0.825 . . . . 10.0 112.202 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.79 155.79 16.63 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.77 0.319 . . . . 10.0 111.158 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -59.99 -35.4 74.95 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.237 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -55.63 -57.87 10.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.037 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.519 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.6 tp10 -69.53 -36.61 76.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.381 -178.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -58.1 -38.87 77.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.904 0.383 . . . . 10.0 111.308 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -78.23 -42.4 15.29 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.715 -0.755 . . . . 10.0 111.921 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -64.56 -38.17 90.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.767 0.318 . . . . 10.0 111.077 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 185' ' ' ASP . . . . . 0.412 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 10.9 m-20 -60.6 -41.55 94.98 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.47 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -64.51 -38.33 90.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.411 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 18.6 mt -63.85 -44.78 92.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.777 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 39.0 mtm-85 -72.03 -36.05 69.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.868 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -64.14 -47.29 80.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.287 0.565 . . . . 10.0 110.917 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -74.69 -8.91 57.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.804 -0.634 . . . . 10.0 112.258 -178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 17.8 ttp -101.08 14.71 31.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.169 0.509 . . . . 10.0 110.75 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -76.42 160.13 29.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.843 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -102.69 -24.16 13.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.176 0.513 . . . . 10.0 110.029 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 67.7 m -129.0 140.84 39.8 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.716 -0.674 . . . . 10.0 109.625 178.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.0 -24.96 75.83 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.847 2.364 . . . . 10.0 112.846 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.83 -9.35 58.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.585 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -91.66 -6.93 51.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.854 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 198' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 198' ' ' ARG . 19.4 mtt85 -58.97 155.94 12.52 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.148 0.499 . . . . 10.0 111.875 -179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 16.1 m -137.43 -16.29 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.514 -0.766 . . . . 10.0 111.047 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -84.87 -178.5 6.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.324 0.583 . . . . 10.0 111.799 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -143.02 177.22 8.51 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.218 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 32.9 tttm -60.88 133.74 56.39 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.203 0.525 . . . . 10.0 111.201 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 17.4 mt -84.94 69.93 10.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.612 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 204' ' ' HIS . . . . . 0.409 ' HA ' ' OE2' ' A' ' 385' ' ' GLU . 18.3 t-80 -81.09 -64.66 1.14 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.905 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -124.69 133.76 53.1 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.935 0.397 . . . . 10.0 111.288 -178.415 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.582 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -119.99 123.3 43.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.626 179.065 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 207' ' ' LEU . . . . . 0.624 HD21 ' HB1' ' A' ' 112' ' ' ALA . 53.6 tp -117.09 100.36 7.68 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.073 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -94.04 128.59 45.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.052 0.454 . . . . 10.0 110.579 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -55.99 -72.15 0.08 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.324 -0.853 . . . . 10.0 111.905 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.39 105.45 13.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.638 0.256 . . . . 10.0 110.681 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.552 HG11 HD12 ' A' ' 99' ' ' ILE . 27.4 m -68.38 -22.32 27.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.537 -0.302 . . . . 10.0 111.178 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 212' ' ' ASP . . . . . 0.567 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.2 m-20 -45.04 -64.08 0.79 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.026 0.828 . . . . 10.0 111.878 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 213' ' ' SER . . . . . 0.449 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 68.7 m -96.62 -37.08 10.5 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.801 0.667 . . . . 10.0 112.801 -178.489 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 73.4 mt -64.21 -38.62 82.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -178.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 12.7 mt -102.25 -50.82 3.52 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 216' ' ' ILE . . . . . 0.567 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 50.5 mm -73.62 -56.31 9.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.979 0.733 . . . . 10.0 112.979 -177.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 217' ' ' ASP . . . . . 0.449 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 79.0 m-20 -63.45 -45.74 89.47 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.133 0.42 . . . . 10.0 112.133 -178.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -93.26 28.91 2.05 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -66.97 -48.38 68.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.972 0.415 . . . . 10.0 111.644 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 220' ' ' ARG . . . . . 0.41 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -98.59 18.8 15.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.063 -179.007 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 85.0 m -84.57 113.0 46.41 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.319 -0.401 . . . . 10.0 110.465 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -92.82 135.1 1.25 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.806 2.337 . . . . 10.0 113.17 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 223' ' ' LEU . . . . . 0.642 ' O ' ' HA ' ' A' ' 374' ' ' SER . 96.9 mt -94.48 120.17 34.3 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 21.6 mt -113.99 132.76 62.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.241 0.46 . . . . 10.0 112.241 -178.271 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 27.9 mt . . . . . 0 C--N 1.327 -0.381 0 N-CA-C 108.767 -0.827 . . . . 10.0 108.767 177.802 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.279 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 374' ' ' SER . . . . . 0.642 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 1.4 t -156.41 142.55 18.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.115 0.483 . . . . 10.0 111.516 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 14.3 tt -146.9 147.39 17.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.794 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.96 142.37 30.54 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -56.74 -49.18 76.0 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 123.036 0.21 . . . . 10.0 111.215 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 378' ' ' GLN . . . . . 0.441 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.5 tm0? -57.07 -43.89 82.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.028 0.442 . . . . 10.0 110.715 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -73.54 -11.36 60.42 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.72 -0.673 . . . . 10.0 111.768 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -93.69 -44.88 7.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.911 0.386 . . . . 10.0 110.329 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -69.36 -21.7 63.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.136 -0.483 . . . . 10.0 111.313 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -72.88 -4.18 30.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.134 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 56.9 mt -97.42 8.57 44.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.937 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 384' ' ' TYR . . . . . 0.582 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 27.6 m-85 -99.17 146.44 26.15 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.818 0.342 . . . . 10.0 110.793 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 385' ' ' GLU . . . . . 0.409 ' OE2' ' HA ' ' A' ' 204' ' ' HIS . 34.4 mt-10 -70.37 -65.8 0.68 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.091 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -102.63 104.09 14.43 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.45 HD23 HD21 ' A' ' 407' ' ' LEU . 61.5 tp -110.72 110.61 21.33 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.641 -179.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -131.92 165.66 23.41 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.783 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -163.84 162.7 35.31 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.403 -0.903 . . . . 10.0 112.409 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 63.3 mtm -107.82 156.85 18.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.989 0.424 . . . . 10.0 110.399 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 391' ' ' THR . . . . . 0.41 ' HB ' HG22 ' A' ' 211' ' ' VAL . 15.3 t -153.59 165.68 35.15 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.21 179.026 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -101.9 -171.25 27.58 Favored Glycine 0 N--CA 1.441 -1.006 0 N-CA-C 110.613 -0.995 . . . . 10.0 110.613 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 393' ' ' THR . . . . . 0.497 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 3.1 m -74.67 66.26 1.43 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.536 0.684 . . . . 10.0 110.589 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 394' ' ' ALA . . . . . 0.533 ' HB1' ' HG2' ' A' ' 566' ' ' ARG . . . -102.76 -45.72 4.92 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.125 -0.943 . . . . 10.0 110.274 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 395' ' ' ASP . . . . . 0.426 ' CG ' ' H ' ' A' ' 396' ' ' THR . 10.0 t70 56.78 -144.35 0.66 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.615 -0.721 . . . . 10.0 110.214 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 396' ' ' THR . . . . . 0.426 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 3.0 m 70.02 -79.88 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.851 0.686 . . . . 10.0 112.851 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -79.31 26.98 0.26 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 10.0 111.683 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 398' ' ' ALA . . . . . 0.465 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -66.21 -35.89 81.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.138 0.494 . . . . 10.0 110.992 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -72.76 -15.58 61.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.598 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -83.88 -21.32 31.99 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.651 -0.25 . . . . 10.0 111.047 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 401' ' ' PHE . . . . . 0.465 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 24.7 m-85 -59.61 -46.67 88.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.056 0.455 . . . . 10.0 110.546 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.55 -0.15 36.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.733 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.3 m -108.26 -43.71 4.3 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.772 0.286 . . . . 10.0 111.772 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 44.6 mt -86.41 -55.18 6.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 405' ' ' TYR . . . . . 0.441 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 60.8 m-85 -100.04 -4.81 29.14 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 31.4 mmtt 60.98 51.09 4.69 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.365 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 407' ' ' LEU . . . . . 0.476 HD13 HD11 ' A' ' 99' ' ' ILE . 26.4 mt -117.65 149.77 40.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.896 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 408' ' ' ASP . . . . . 0.581 ' OD2' ' HD2' ' A' ' 13' ' ' ARG . 21.0 t70 -85.2 170.25 13.04 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 18.2 m -138.71 120.73 15.59 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.835 -0.541 . . . . 10.0 111.605 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 14.0 t -127.35 137.11 58.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.326 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 87.4 t -93.45 133.33 34.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.648 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 59.2 t -91.3 127.07 52.52 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.795 -0.446 . . . . 10.0 109.795 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.66 142.1 69.18 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.522 2.148 . . . . 10.0 112.634 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' A' ' 416' ' ' ARG . 0.2 OUTLIER -64.1 151.55 42.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.584 -0.735 . . . . 10.0 111.604 -179.868 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -70.0 -26.85 64.27 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.178 0.514 . . . . 10.0 110.492 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 416' ' ' ARG . . . . . 0.509 ' HB2' ' O ' ' A' ' 578' ' ' GLN . 58.3 mtm180 -134.14 157.9 76.55 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.84 122.49 11.06 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.28 1.987 . . . . 10.0 111.445 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 3.8 mtm -76.53 100.42 5.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.034 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.6 pt -95.24 51.39 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.303 0.573 . . . . 10.0 110.602 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 30.4 ttp-105 -94.2 116.02 28.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.494 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -84.43 105.04 14.95 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.148 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -88.54 112.47 23.05 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 26.5 mt -93.06 150.62 39.53 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.547 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -62.68 163.69 20.75 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.52 2.147 . . . . 10.0 112.381 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -83.7 133.97 34.78 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.937 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 31.3 mt -105.88 94.72 5.33 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.148 0.499 . . . . 10.0 110.389 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 427' ' ' VAL . . . . . 0.641 HG22 ' HB3' ' A' ' 588' ' ' LEU . 21.8 t -90.24 119.43 37.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.345 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 428' ' ' TYR . . . . . 0.533 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 3.3 m-85 -105.22 177.86 4.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.043 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 8.8 mmm -77.21 -77.62 0.14 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.862 -0.335 . . . . 10.0 111.409 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 41.4 p -86.09 165.65 16.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.972 0.415 . . . . 10.0 111.431 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 431' ' ' GLU . . . . . 0.448 ' O ' HG12 ' A' ' 435' ' ' ILE . 2.9 tp10 -62.44 -40.17 95.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.691 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.97 82.01 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.129 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -60.96 -42.03 97.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.272 0.558 . . . . 10.0 109.972 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 434' ' ' LYS . . . . . 0.54 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 28.4 ttpt -65.79 -52.42 50.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.369 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 435' ' ' ILE . . . . . 0.602 ' O ' HG12 ' A' ' 439' ' ' ILE . 32.3 mm -61.04 -44.1 97.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.342 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.56 -36.99 74.77 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.72 0.295 . . . . 10.0 110.985 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.91 -37.36 70.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.312 179.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 438' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 434' ' ' LYS . 81.1 mt -62.65 -45.59 98.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.155 179.153 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 439' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 435' ' ' ILE . 37.8 mm -59.89 -39.95 81.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.6 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -65.66 -43.78 88.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.601 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -60.35 -40.75 91.86 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.167 0.508 . . . . 10.0 110.136 179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.414 HG12 HG11 ' A' ' 452' ' ' VAL . 71.9 mt -70.74 -42.48 77.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.724 179.425 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -60.07 -42.52 94.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.035 -0.529 . . . . 10.0 111.147 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -73.38 0.79 11.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.159 -0.473 . . . . 10.0 112.202 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 70.3 mtt-85 -117.41 -31.25 5.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.855 0.359 . . . . 10.0 110.917 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.19 -28.31 65.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.229 0.538 . . . . 10.0 109.859 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -80.82 -3.47 51.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.38 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -108.89 -38.85 5.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.876 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 121.05 18.6 3.8 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.722 -0.752 . . . . 10.0 113.004 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -98.5 125.51 42.68 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 122.541 -0.388 . . . . 10.0 111.081 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.12 144.96 48.18 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.767 2.311 . . . . 10.0 111.226 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 452' ' ' VAL . . . . . 0.414 HG11 HG12 ' A' ' 442' ' ' ILE . 84.0 t -125.62 128.04 72.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.978 0.418 . . . . 10.0 111.464 -178.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 58.2 tp -108.46 111.2 22.96 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.182 -0.673 . . . . 10.0 109.182 178.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 47.5 t -94.72 124.42 47.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.523 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -111.3 114.52 3.68 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.839 -0.696 . . . . 10.0 111.898 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 22.8 p -106.17 145.21 31.81 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.712 0.291 . . . . 10.0 110.882 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 23.1 pt -92.71 -2.63 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.781 0.324 . . . . 10.0 111.142 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 59.5 m -149.66 141.48 23.69 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.433 -0.348 . . . . 10.0 110.234 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 17.1 mt -61.69 -34.38 61.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-O 121.111 0.482 . . . . 10.0 110.603 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -56.89 -40.31 75.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.539 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.407 ' HG2' ' OE2' ' A' ' 560' ' ' GLU . 0.6 OUTLIER -71.36 -33.53 69.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.475 179.833 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.5 m -62.44 -48.08 81.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.352 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -62.55 -37.78 87.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.203 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 55.8 tp -62.94 -54.85 32.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.341 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.5 p -65.7 -32.65 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.621 -0.263 . . . . 10.0 111.632 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 60.0 m -65.68 -37.56 86.82 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.777 0.322 . . . . 10.0 110.644 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -64.41 -48.47 75.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.523 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 468' ' ' GLU . . . . . 0.519 ' HG3' HG21 ' A' ' 435' ' ' ILE . 20.9 mm-40 -61.91 -41.24 97.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.122 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 26.4 mt -60.91 -36.05 78.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.675 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.3 m -70.45 -34.89 72.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.11 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 42.5 mtpt -63.98 -37.21 86.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.336 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.48 -16.68 51.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.129 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 81.47 29.02 41.43 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.307 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 60.9 mt -94.64 121.31 45.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 110.263 -0.273 . . . . 10.0 110.263 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -59.16 125.67 24.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.658 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 53.0 p-80 -148.6 151.59 35.29 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.762 -178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -134.8 141.06 46.32 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.4 t -105.81 131.29 55.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.818 0.342 . . . . 10.0 110.836 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.45 HD12 ' HB2' ' A' ' 503' ' ' ALA . 67.8 mt -73.08 105.53 4.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.107 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.89 123.84 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.48 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -82.58 -8.82 59.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.043 -0.526 . . . . 10.0 112.209 -178.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -92.85 -53.09 4.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.174 0.512 . . . . 10.0 110.014 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -102.49 96.61 7.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.37 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 484' ' ' HIS . . . . . 0.425 ' HA ' ' HB3' ' A' ' 487' ' ' GLU . 9.9 m170 -66.6 -15.48 63.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.685 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -57.98 -49.26 77.44 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.032 0.444 . . . . 10.0 110.6 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 486' ' ' ASN . . . . . 0.495 ' O ' HG13 ' A' ' 490' ' ' ILE . 64.8 t30 -72.56 -41.52 65.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.73 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 487' ' ' GLU . . . . . 0.425 ' HB3' ' HA ' ' A' ' 484' ' ' HIS . 1.7 tt0 -55.36 -57.14 13.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.575 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -57.94 -34.2 69.64 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.571 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -67.88 -41.84 82.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.776 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 490' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 486' ' ' ASN . 45.7 mt -69.5 -45.81 77.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.809 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 491' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 487' ' ' GLU . 89.8 t -56.22 -38.38 54.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.402 -179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -60.82 -26.47 67.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.743 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -124.3 27.61 6.98 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.818 0.342 . . . . 10.0 110.721 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -73.72 -19.81 60.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.124 0.487 . . . . 10.0 110.943 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -90.58 10.39 74.74 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.669 -0.777 . . . . 10.0 112.023 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -67.26 140.29 95.33 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 110.269 -0.271 . . . . 10.0 110.269 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -51.9 123.91 13.47 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.616 2.211 . . . . 10.0 112.918 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 63.62 39.96 8.37 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.388 -0.824 . . . . 10.0 112.483 178.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -109.03 118.86 37.89 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 37.1 t -97.07 112.81 29.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.029 0.442 . . . . 10.0 110.426 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.8 m -111.91 128.37 56.12 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.41 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 43.4 mt -109.34 124.76 66.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.896 0.379 . . . . 10.0 110.328 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 503' ' ' ALA . . . . . 0.45 ' HB2' HD12 ' A' ' 479' ' ' LEU . . . -120.45 128.98 53.67 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.865 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 14.4 m -103.86 120.75 41.65 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.578 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 58.49 77.19 0.31 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.368 0.604 . . . . 10.0 110.453 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.56 133.3 34.45 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.449 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.67 -178.37 4.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.806 -0.633 . . . . 10.0 110.945 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -73.07 164.15 54.93 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.166 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 68.89 -75.44 0.07 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.116 0.567 . . . . 10.0 111.34 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 84.24 143.86 6.05 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.976 -0.631 . . . . 10.0 112.095 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.93 150.73 23.55 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.853 0.359 . . . . 10.0 111.463 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -75.67 95.93 3.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.014 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 71.4 mt -85.47 115.71 27.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.986 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 19.0 t -90.51 140.15 16.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.94 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 61.0 mt -67.91 128.85 38.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.302 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 87.28 9.11 73.59 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.438 -0.665 . . . . 10.0 111.438 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 91.8 -171.7 34.79 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 111.064 -0.814 . . . . 10.0 111.064 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 25.5 p -128.65 110.59 12.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.121 0.46 . . . . 10.0 110.441 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 61.7 p-90 -59.31 -25.32 64.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.568 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -59.75 -41.63 91.44 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.451 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -73.23 -32.8 64.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.921 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -70.06 -47.49 61.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.194 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.8 m -68.14 -25.5 32.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.937 0.398 . . . . 10.0 110.232 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -80.52 -8.58 59.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.574 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -97.19 10.08 40.42 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.276 0.56 . . . . 10.0 110.645 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 70.8 mt -105.16 141.18 37.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.941 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 48.8 mp0 -73.99 -33.05 63.68 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.248 0.547 . . . . 10.0 109.769 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -137.96 82.08 26.18 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.547 -0.751 . . . . 10.0 109.692 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -78.18 95.01 1.06 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.835 2.357 . . . . 10.0 111.734 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 1.4 p -77.69 160.15 28.66 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.68 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.08 -44.12 70.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 10.0 111.437 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -63.55 -39.95 95.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.437 -0.347 . . . . 10.0 111.238 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.71 -42.37 95.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.669 0.271 . . . . 10.0 110.65 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 92.3 mt -59.88 -44.77 95.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.192 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.19 -36.97 69.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.149 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -64.26 -47.63 78.85 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.583 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 87.9 mt -64.04 -40.41 88.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.652 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -60.78 -37.63 82.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.826 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -65.32 -39.83 92.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.725 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.43 -40.02 67.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.013 -0.54 . . . . 10.0 109.978 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 56.8 t90 -57.69 -40.34 79.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.68 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 64.6 tp60 -56.43 -42.74 78.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.497 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.5 -44.67 93.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.451 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -69.93 -37.49 75.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.8 -0.637 . . . . 10.0 110.525 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 17.6 t-80 -61.26 -51.18 70.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.855 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -68.19 -31.36 70.84 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.639 -0.71 . . . . 10.0 111.312 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -63.67 -36.24 83.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.161 0.505 . . . . 10.0 110.179 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 71.7 t -78.74 -40.1 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.466 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 19.4 tp -59.3 -48.02 83.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.543 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -78.48 2.32 19.38 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.613 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -101.15 -5.06 26.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.808 0.337 . . . . 10.0 110.979 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 116.71 3.31 18.47 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.639 -0.791 . . . . 10.0 112.861 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 75.04 -162.5 53.81 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.993 -0.622 . . . . 10.0 112.632 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 44.3 tp -73.89 120.5 19.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.875 0.369 . . . . 10.0 110.576 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -94.47 123.28 37.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.999 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 36.7 mm -103.2 129.63 54.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.264 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 557' ' ' ILE . . . . . 0.4 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 10.7 mt -123.84 118.22 53.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.923 0.392 . . . . 10.0 110.207 178.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.16 118.27 5.81 Favored Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 111.28 -0.728 . . . . 10.0 111.28 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 18.8 p -68.89 -38.83 79.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.144 0.497 . . . . 10.0 110.195 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 560' ' ' GLU . . . . . 0.407 ' OE2' ' HG2' ' A' ' 461' ' ' LYS . 28.0 mp0 -144.34 158.86 43.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.124 -0.944 . . . . 10.0 109.638 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 561' ' ' ARG . . . . . 0.44 ' H ' HD22 ' A' ' 594' ' ' LEU . 93.0 mtt-85 -104.89 -160.12 0.74 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.62 -0.881 . . . . 10.0 108.62 178.127 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -152.32 150.92 30.26 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.769 -0.372 . . . . 10.0 110.552 178.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 563' ' ' GLU . . . . . 0.432 ' H ' ' CD ' ' A' ' 563' ' ' GLU . 1.8 mp0 -51.14 -47.54 62.04 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 123.882 0.739 . . . . 10.0 110.377 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 564' ' ' SER . . . . . 0.45 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.7 OUTLIER -69.2 104.45 2.2 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.225 178.918 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 565' ' ' ARG . . . . . 0.409 ' HB3' ' CG2' ' A' ' 396' ' ' THR . 25.4 tpt180 -69.86 -19.99 63.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.105 -178.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 566' ' ' ARG . . . . . 0.533 ' HG2' ' HB1' ' A' ' 394' ' ' ALA . 16.1 ttm180 -59.01 -40.92 86.43 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.3 0.572 . . . . 10.0 109.771 178.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 48.0 mt -79.09 -36.33 18.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.718 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.59 -54.79 41.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.642 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -61.97 -40.1 94.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.149 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -65.0 -31.55 72.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.816 0.341 . . . . 10.0 110.884 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 37.2 tp -76.06 -31.28 58.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.136 0.493 . . . . 10.0 110.355 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 9.6 ttp180 -76.81 -36.4 56.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.66 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.15 36.61 2.37 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 121.071 -0.585 . . . . 10.0 114.137 -178.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 574' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 574' ' ' ARG . 3.2 mmt180 -83.89 -44.02 14.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 117.134 0.467 . . . . 10.0 110.095 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 5.9 m -81.76 175.55 10.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.072 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 67.5 45.93 73.87 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.435 -0.888 . . . . 10.0 111.689 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -70.64 118.28 13.24 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.354 -0.239 . . . . 10.0 110.354 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 578' ' ' GLN . . . . . 0.623 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 9.7 tt0 62.45 30.48 17.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.471 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 82.11 51.93 4.25 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.836 -0.62 . . . . 10.0 112.266 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.41 -167.62 1.21 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.375 -0.231 . . . . 10.0 110.375 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -87.03 175.44 8.11 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.252 0.549 . . . . 10.0 111.87 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 153.65 164.62 12.83 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.546 -0.752 . . . . 10.0 111.924 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.0 p -148.06 125.41 11.59 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 110.368 -0.234 . . . . 10.0 110.368 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.17 128.08 54.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.169 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 585' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 1.2 ttm180 -138.62 120.61 15.54 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -111.14 155.53 22.74 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.022 0.439 . . . . 10.0 110.61 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 587' ' ' TYR . . . . . 0.54 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 56.6 m-85 -129.27 166.17 19.97 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.852 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 588' ' ' LEU . . . . . 0.641 ' HB3' HG22 ' A' ' 427' ' ' VAL . 15.8 tp -161.69 158.31 25.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.533 -0.303 . . . . 10.0 110.274 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 589' ' ' SER . . . . . 0.448 ' OG ' ' HD3' ' A' ' 434' ' ' LYS . 0.7 OUTLIER -123.34 143.82 49.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.306 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 590' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 92.0 mmm -71.39 -11.64 61.0 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.361 -0.381 . . . . 10.0 111.252 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -108.76 7.64 26.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.538 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -81.66 158.24 24.35 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.341 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -67.38 -30.05 69.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.816 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 594' ' ' LEU . . . . . 0.44 HD22 ' H ' ' A' ' 561' ' ' ARG . 13.4 tp -66.89 -25.14 66.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.698 0.285 . . . . 10.0 111.53 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 4.1 tpt -74.2 0.65 13.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.128 0.489 . . . . 10.0 111.127 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -94.52 1.07 55.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.269 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 597' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 594' ' ' LEU . 41.5 pt -72.99 -7.79 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-O 120.637 0.255 . . . . 10.0 111.664 -179.592 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -81.07 -7.67 59.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.61 -0.268 . . . . 10.0 110.842 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.4 -64.56 0.38 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.498 0.719 . . . . 10.0 111.196 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 600' ' ' SER . . . . . 0.509 ' HB2' HG23 ' A' ' 603' ' ' VAL . 4.0 m -77.64 116.59 18.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.795 0.331 . . . . 10.0 110.473 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -62.71 -26.04 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.125 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 76.0 mmt-85 -60.45 -29.44 69.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.21 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 603' ' ' VAL . . . . . 0.509 HG23 ' HB2' ' A' ' 600' ' ' SER . 59.9 t -66.68 -51.66 53.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 604' ' ' SER . . . . . 0.555 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 0.7 OUTLIER -63.25 -38.05 89.65 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.989 179.063 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -61.48 -38.69 96.2 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.922 -0.581 . . . . 10.0 112.507 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 42.5 tpp -74.29 -33.52 63.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.955 0.407 . . . . 10.0 110.679 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 51.2 mtt -68.68 -17.91 64.17 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.047 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 608' ' ' ARG . . . . . 0.555 ' HG3' ' O ' ' A' ' 604' ' ' SER . 63.7 mtt180 -77.6 -5.46 50.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.155 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -91.92 8.46 37.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.986 0.422 . . . . 10.0 110.306 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 25.0 tp -73.15 -16.33 61.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 10.0 111.186 -179.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 98.79 -43.78 1.82 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.981 -0.628 . . . . 10.0 111.671 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 70.62 -54.97 0.64 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.687 0.795 . . . . 10.0 112.596 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt 59.64 76.13 0.45 Allowed Pre-proline 0 N--CA 1.463 0.219 0 O-C-N 123.448 0.467 . . . . 10.0 110.485 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 614' ' ' PRO . . . . . 0.533 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 32.3 Cg_exo -58.38 96.95 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.454 2.769 . . . . 10.0 113.064 -178.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 130.17 -13.66 5.72 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.778 -0.725 . . . . 10.0 111.92 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -117.16 142.54 46.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.86 0.362 . . . . 10.0 110.253 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -80.59 107.32 13.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.387 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.63 -30.31 49.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.962 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 41.5 74.25 0.11 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.564 0.746 . . . . 10.0 112.68 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 22.6 m170 -117.61 100.37 52.53 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -57.01 -29.28 82.24 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 123.415 2.744 . . . . 10.0 113.982 -178.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 68.3 p-90 -68.79 -20.4 64.33 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.746 -0.382 . . . . 10.0 111.075 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.88 -48.96 73.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.705 -0.48 . . . . 10.0 109.705 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.28 -39.27 82.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.42 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -69.68 -36.29 75.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.891 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -65.15 -44.7 87.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.402 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 75.7 mt -64.44 -42.99 96.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.024 -0.534 . . . . 10.0 110.254 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.81 -38.63 86.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.482 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -67.47 -39.92 85.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.141 179.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -65.69 -44.11 87.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.652 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -61.45 -42.32 98.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.109 0.481 . . . . 10.0 109.743 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -62.28 -30.38 71.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.632 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 633' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' A' ' 633' ' ' LYS . 66.1 mmtt -64.7 -39.32 93.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.521 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 13.3 t -64.52 -43.13 96.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.45 ' OE2' ' HA ' ' A' ' 564' ' ' SER . 3.6 mm-40 -65.0 -35.7 82.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.865 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 27.9 m -62.92 -42.95 99.97 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.701 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 637' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 637' ' ' ARG . 41.7 ttm180 -63.33 -41.74 98.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.394 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -59.01 -43.5 91.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.298 -0.865 . . . . 10.0 110.322 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -67.76 -39.3 84.18 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.869 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 640' ' ' ASP . . . . . 0.53 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 27.0 t70 -60.06 -35.56 75.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.202 -0.453 . . . . 10.0 110.394 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 66.6 mt -83.29 -36.16 12.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.795 178.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -57.74 -40.47 79.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.419 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 643' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 20.2 pttm -69.15 -28.34 66.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.312 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 644' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 16.0 mm100 -66.9 -38.26 85.9 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.908 0.385 . . . . 10.0 110.181 -179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 26.8 mt -66.73 -38.41 86.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.878 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 646' ' ' LEU . . . . . . . . . . . . . 94.9 mt -64.0 -35.02 79.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.698 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.73 -19.81 65.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.969 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -100.57 -45.86 5.39 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.323 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -72.1 -28.47 63.32 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.029 0.751 . . . . 10.0 113.029 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -67.16 -22.79 65.75 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.05 0.452 . . . . 10.0 110.554 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 18.7 t -68.88 -48.87 68.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -68.18 -29.52 68.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.437 -0.801 . . . . 10.0 109.579 178.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -60.12 -51.53 69.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.615 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -60.92 -45.83 93.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.769 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -61.32 -42.78 99.24 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.458 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 4.3 ttp-105 -63.39 -42.55 98.82 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.924 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -62.21 -44.35 96.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.592 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.73 -48.68 76.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.592 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.45 -34.64 58.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.599 -0.273 . . . . 10.0 111.547 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -64.98 -44.34 89.64 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.0 m -61.62 -41.75 97.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.014 -0.539 . . . . 10.0 109.921 179.291 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -65.05 -46.64 80.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.727 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 23.8 ttt-85 -65.08 -43.62 91.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.724 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -66.61 -35.12 79.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.734 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -62.65 -51.2 68.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.081 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 666' ' ' LEU . . . . . 0.485 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 54.4 mt -65.28 -28.81 69.6 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.227 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 27.9 tp -71.21 -40.76 70.95 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.962 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.8 -41.8 74.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.812 -178.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 33.0 m -82.6 158.7 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.38 . . . . 10.0 111.223 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 50.8 m -102.97 -34.04 9.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.752 0.31 . . . . 10.0 111.111 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -90.31 117.07 28.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.848 0.356 . . . . 10.0 110.409 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 8.1 p -123.21 -1.01 6.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.656 0.741 . . . . 10.0 109.947 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 673' ' ' SER . . . . . 0.431 ' OG ' ' HD3' ' A' ' 760' ' ' ARG . 0.3 OUTLIER -54.15 -39.09 66.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.868 -1.06 . . . . 10.0 111.846 -179.209 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -59.44 -48.19 82.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.833 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 675' ' ' THR . . . . . 0.404 ' O ' HG12 ' A' ' 679' ' ' ILE . 1.8 m -64.68 -44.27 90.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.664 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 44.4 mm -57.72 -48.34 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.689 -0.687 . . . . 10.0 111.438 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -66.53 -39.83 88.8 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.605 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 46.3 m -64.42 -46.01 85.09 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.867 0.321 . . . . 10.0 111.867 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 679' ' ' ILE . . . . . 0.54 ' O ' HG23 ' A' ' 683' ' ' VAL . 37.9 pt -71.67 -25.29 24.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.472 -0.491 . . . . 10.0 110.642 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 3.4 ttm-85 -58.55 -39.41 80.16 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.848 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -63.23 -43.76 97.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.667 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -70.56 -36.9 73.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.129 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 683' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 679' ' ' ILE . 69.1 t -59.5 -52.21 63.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 120.928 0.394 . . . . 10.0 110.429 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -63.41 -38.75 92.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.919 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 10.2 tttm -58.02 -52.53 65.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.24 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -61.46 -37.69 84.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.033 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 35.8 m -64.14 -41.58 97.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.543 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 94.2 mt -70.53 -42.44 78.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.241 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -56.3 -30.35 62.4 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.042 0.449 . . . . 10.0 111.725 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -66.33 -25.26 66.74 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.77 0.656 . . . . 10.0 112.77 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -120.86 -24.14 5.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.917 0.389 . . . . 10.0 111.445 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 692' ' ' ILE . . . . . 0.574 HG23 ' CD1' ' A' ' 701' ' ' TRP . 71.3 mt -127.65 103.76 21.77 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.4 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -68.58 128.79 17.69 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.027 1.818 . . . . 10.0 111.338 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -54.79 123.03 12.73 Favored 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 122.695 2.263 . . . . 10.0 112.784 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 61.55 78.76 0.28 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.251 -0.886 . . . . 10.0 111.406 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 17.5 p -145.93 -167.72 2.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.134 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 79.4 mt -85.65 152.54 23.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.64 0.257 . . . . 10.0 110.51 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.73 -31.49 68.35 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.741 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -76.63 -3.42 37.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.591 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.45 3.63 35.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.055 0.455 . . . . 10.0 110.238 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 701' ' ' TRP . . . . . 0.574 ' CD1' HG23 ' A' ' 692' ' ' ILE . 34.2 m0 -100.9 107.78 19.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.939 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -82.34 82.48 7.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.207 0.527 . . . . 10.0 109.582 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 703' ' ' ILE . . . . . 0.557 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 46.8 mm -58.6 -50.82 85.95 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.443 -0.799 . . . . 10.0 111.65 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 704' ' ' PRO . . . . . 0.557 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.2 Cg_exo -57.23 -42.94 57.47 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 121.91 1.74 . . . . 10.0 112.078 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -60.45 -42.96 99.21 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.128 -0.558 . . . . 10.0 111.993 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 47.5 tp -67.73 -39.95 84.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.97 0.414 . . . . 10.0 110.135 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -64.37 -49.29 72.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.482 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -58.29 -35.92 72.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.005 0.431 . . . . 10.0 110.26 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -66.35 -52.36 47.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.673 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 93.8 mt -65.69 -38.66 89.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.751 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -78.33 0.02 27.13 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.847 0.684 . . . . 10.0 112.847 -178.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -127.33 -53.58 1.37 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.846 0.355 . . . . 10.0 111.69 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 713' ' ' ASP . . . . . 0.561 ' O ' ' HE2' ' A' ' 828' ' ' LYS . 0.9 OUTLIER -76.15 -39.08 55.82 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.591 -178.461 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -100.6 -14.67 18.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.607 0.225 . . . . 10.0 111.607 -179.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.48 33.06 18.72 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.337 0.589 . . . . 10.0 110.678 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 49.3 tp -115.45 114.09 24.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.171 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -83.53 115.43 22.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.881 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 50.2 mt -133.14 129.52 20.96 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.121 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -86.04 61.6 5.01 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 123.116 2.544 . . . . 10.0 112.035 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 31.3 mt -60.62 -36.95 73.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.274 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -62.69 -30.86 71.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.972 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.12 -39.31 29.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.157 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 34.0 m0 -61.06 -48.36 82.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.155 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 55.2 tp -69.0 -20.02 64.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.682 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -87.61 -46.01 9.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.762 0.315 . . . . 10.0 111.384 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -81.86 -31.69 31.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.464 -0.334 . . . . 10.0 111.698 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -123.16 76.59 51.68 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 116.622 -0.263 . . . . 10.0 110.959 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.5 -18.87 60.54 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.38 2.053 . . . . 10.0 111.784 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.09 -15.95 63.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.301 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 67.3 mt -66.43 -23.35 66.28 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.766 0.317 . . . . 10.0 110.456 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 57.19 -101.98 0.14 Allowed 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 115.528 -0.76 . . . . 10.0 111.303 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -144.8 -47.02 0.24 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.022 0.439 . . . . 10.0 109.907 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -59.5 -51.07 71.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.118 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 3.1 m -62.69 -31.69 72.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.126 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 8.3 mt -60.74 -42.01 96.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.898 0.38 . . . . 10.0 110.198 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -62.69 -43.44 98.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.707 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -62.07 -39.28 91.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.35 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 27.4 mmm-85 -64.48 -46.41 83.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.317 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 90.2 mt -61.94 -43.47 97.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.278 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 54.1 tp -61.5 -52.67 63.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.912 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -58.8 -41.03 85.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.124 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -62.7 -40.75 98.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.967 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 24.3 p -64.46 -30.13 71.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.903 0.382 . . . . 10.0 110.453 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 744' ' ' ILE . . . . . 0.446 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 78.1 mt -73.28 -47.95 44.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 10.0 109.898 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -49.24 78.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.105 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 76.1 t -60.89 -38.12 78.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.064 0.459 . . . . 10.0 110.401 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -65.5 -42.94 91.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.041 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 748' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 97.6 mt-30 -63.02 -37.36 86.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.367 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 -59.59 -34.97 73.41 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.355 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -76.75 -36.83 56.84 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -61.4 -35.64 78.06 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.016 -0.993 . . . . 10.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -68.88 -14.6 63.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.759 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.47 -37.57 5.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.754 0.312 . . . . 10.0 111.639 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.7 t -84.15 -42.75 17.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.864 0.364 . . . . 10.0 111.364 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 126.07 130.69 3.46 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.905 -0.878 . . . . 10.0 110.905 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 756' ' ' ALA . . . . . 0.601 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -56.35 -54.22 48.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.749 0.309 . . . . 10.0 111.603 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -64.1 -38.1 89.82 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.089 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 14.3 tpt -64.86 -43.85 91.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.318 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 70.0 mmm -60.26 -43.97 95.7 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 116.06 -0.518 . . . . 10.0 111.151 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.601 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 15.6 mmp_? -55.23 -41.78 72.52 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.244 0.545 . . . . 10.0 111.06 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -72.97 -35.2 66.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.265 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -66.84 -45.24 78.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.273 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 763' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 760' ' ' ARG . 61.8 mt-10 -58.15 -47.07 84.47 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.641 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 764' ' ' LYS . . . . . 0.485 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 83.0 tttt -61.52 -45.72 92.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.785 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -59.88 -48.31 86.72 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.01 -0.614 . . . . 10.0 111.992 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 55.8 t -63.05 -44.63 99.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.617 0.246 . . . . 10.0 110.879 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 21.4 ttt -60.11 -47.91 83.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.813 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 48.0 mt -63.04 -43.01 99.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.644 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -60.39 -48.27 82.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.926 0.393 . . . . 10.0 110.538 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 11.9 m -62.43 -44.17 97.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.735 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 4.4 tt -61.35 -47.33 86.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.622 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 772' ' ' ASP . . . . . 0.578 ' O ' ' HG3' ' A' ' 776' ' ' LYS . 1.9 t70 -62.03 -47.39 84.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.091 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 29.6 m -59.15 -48.06 82.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.424 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 74.5 mt -65.91 -30.35 70.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.979 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -65.48 -40.88 93.64 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.578 ' HG3' ' O ' ' A' ' 772' ' ' ASP . 51.5 mttm -63.01 -39.14 93.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.913 -0.585 . . . . 10.0 109.767 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.73 -42.96 94.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.416 178.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 778' ' ' HIS . . . . . 0.492 ' O ' ' HG2' ' A' ' 782' ' ' MET . 47.1 t60 -63.49 -41.02 98.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.371 -0.831 . . . . 10.0 110.575 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 39.5 mt -56.26 -50.59 70.9 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 123.335 0.397 . . . . 10.0 110.421 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -65.62 -44.04 87.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.78 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.2 73.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.671 -179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 782' ' ' MET . . . . . 0.492 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 91.6 mmm -61.0 -41.98 97.56 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.909 0.385 . . . . 10.0 110.929 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -75.49 -33.35 60.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.583 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -60.86 -39.26 88.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.932 0.396 . . . . 10.0 110.257 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.1 tp -76.23 -32.16 58.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.576 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -65.63 -38.96 90.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.617 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.529 179.336 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo . . . . . 0 CA--C 1.526 0.109 0 N-CA-C 113.533 0.551 . . . . 10.0 113.533 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 800' ' ' LYS . . . . . 0.54 ' HB2' ' NZ ' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -78.64 -47.06 17.8 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.859 -0.336 . . . . 10.0 110.354 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -61.92 -40.89 97.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.545 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -64.09 -43.73 94.49 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 92.0 t80 -60.6 -43.34 97.52 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.219 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -58.3 -50.85 72.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.847 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -59.29 -45.9 90.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.864 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.2 -41.8 93.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.531 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 26.7 m -65.51 -34.76 79.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.904 -0.589 . . . . 10.0 111.146 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 21.6 m-30 -65.81 -43.2 89.35 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.975 0.417 . . . . 10.0 110.042 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 32.2 m -65.93 -36.34 83.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.428 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 29.2 ttm -65.49 -37.59 87.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.25 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -67.98 -43.04 79.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.21 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 812' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 816' ' ' GLU . . . -59.47 -49.14 78.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.965 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.89 -32.33 73.57 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.941 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 29.5 ttp -65.82 -44.55 85.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.008 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.53 -36.48 83.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.511 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 816' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 812' ' ' ALA . 18.0 mm-40 -63.37 -42.03 98.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.299 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 12.8 m -74.09 -29.82 62.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.523 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 50.6 tp -60.46 -58.47 8.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.757 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 40.4 pttt -60.73 -32.63 71.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.541 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -64.57 -59.01 4.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.645 -0.707 . . . . 10.0 111.322 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -60.87 -39.74 90.36 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.339 0.496 . . . . 10.0 112.339 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 54.7 t -57.66 -50.24 78.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.841 0.353 . . . . 10.0 110.66 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.1 -38.72 72.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.904 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 38.6 m -61.93 -40.1 94.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.626 0.25 . . . . 10.0 110.615 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 74.7 m -63.94 -41.26 97.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.709 0.29 . . . . 10.0 110.769 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 87.7 mt -69.76 -19.63 63.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.235 0.54 . . . . 10.0 110.871 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 16.9 m -92.42 -36.82 12.91 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.753 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 828' ' ' LYS . . . . . 0.561 ' HE2' ' O ' ' A' ' 713' ' ' ASP . 44.1 mttm -69.66 -28.99 66.34 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.966 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 5.7 p -66.82 108.15 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.688 0.756 . . . . 10.0 109.908 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -98.73 99.88 11.03 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.75 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 C--N 1.322 -0.6 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.991 179.423 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.8 t80 . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.96 0.409 . . . . 10.0 110.635 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 130.38 178.84 15.64 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.903 -0.665 . . . . 10.0 111.972 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.2 m -68.64 116.58 9.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.801 0.334 . . . . 10.0 110.181 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.53 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 17.3 mmt180 -67.54 155.16 39.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.042 -0.527 . . . . 10.0 111.345 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.3 m120 73.65 -49.56 0.69 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.264 -0.88 . . . . 10.0 112.318 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -90.53 -71.26 0.63 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.824 0.675 . . . . 10.0 112.824 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -65.2 -18.25 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 -177.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.51 -52.74 64.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.684 0.278 . . . . 10.0 111.159 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 mt -67.06 -33.4 75.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.946 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 19' ' ' ARG . 12.4 ttp-105 -66.78 -45.05 79.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.384 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.54 -28.41 64.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.129 0.49 . . . . 10.0 109.996 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.554 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 45.3 mtt -76.22 -36.23 58.66 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.842 179.018 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -60.97 -35.64 77.31 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -60.37 -38.0 82.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.432 -0.803 . . . . 10.0 109.532 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -77.1 -35.36 22.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.848 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.9 t -58.13 -36.16 55.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.95 178.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.5 -37.44 87.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.729 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.3 mt -68.3 -44.0 84.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.716 -0.674 . . . . 10.0 109.704 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 77.6 mt -59.78 -40.57 82.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.774 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -63.64 -38.42 91.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.377 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.56 -28.32 65.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.006 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 53.4 mtt -84.11 -17.53 39.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.138 -0.483 . . . . 10.0 111.61 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.509 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 17.9 tt0 -57.46 -54.62 53.11 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-O 119.271 -0.395 . . . . 10.0 111.646 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 38.2 Cg_exo -61.05 -28.25 85.74 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.755 1.637 . . . . 10.0 111.516 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -69.51 -43.99 71.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.613 -0.722 . . . . 10.0 109.924 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 25.9 mmt -69.37 -29.03 66.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.355 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -62.68 -27.24 69.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.768 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -79.97 -16.45 55.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.709 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp -84.01 147.8 27.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.301 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 p -76.6 165.56 24.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.103 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.54 -43.17 84.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.865 0.364 . . . . 10.0 111.449 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -68.59 -28.08 66.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.922 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -69.79 -33.09 71.9 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.669 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.5 mt -61.94 -40.38 95.32 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -67.23 -32.4 73.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.14 -0.936 . . . . 10.0 109.552 178.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.97 -35.99 92.84 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.474 -0.785 . . . . 10.0 111.687 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -65.6 -37.3 86.23 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 28.1 m -61.38 -47.35 86.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.282 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.82 -30.02 70.1 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.236 0.541 . . . . 10.0 110.144 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -66.26 -45.66 79.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.441 -0.799 . . . . 10.0 110.564 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -59.64 -37.95 80.07 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.048 0.452 . . . . 10.0 110.252 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -57.95 -41.74 83.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.729 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.16 -41.47 61.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.994 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -60.48 -36.37 78.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.35 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.39 -38.13 89.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.771 0.319 . . . . 10.0 111.035 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -70.37 -28.12 64.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.421 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -69.16 -33.57 73.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.368 179.129 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 132.19 16.77 1.34 Allowed Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.532 -0.842 . . . . 10.0 113.069 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -77.3 149.55 35.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.926 0.393 . . . . 10.0 110.145 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.1 t -86.86 131.82 33.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.19 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.541 HD11 ' O ' ' A' ' 118' ' ' LEU . 18.8 tp -58.8 -39.87 82.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.135 0.493 . . . . 10.0 110.864 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.408 ' HG3' ' ND2' ' A' ' 95' ' ' ASN . 14.6 mp0 -68.0 -10.49 54.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.39 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -97.91 -13.52 21.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.301 0.572 . . . . 10.0 110.112 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.5 mt -91.6 -7.06 51.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.887 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.509 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 75.2 mt -49.99 -51.52 60.84 Favored Pre-proline 0 CA--C 1.541 0.622 0 N-CA-C 113.192 0.812 . . . . 10.0 113.192 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.509 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 62.2 Cg_exo -52.08 -51.17 11.73 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 122.085 1.856 . . . . 10.0 113.209 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -71.25 -42.75 68.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.65 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.427 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -61.05 -49.72 76.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.806 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -63.84 -35.2 79.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.321 -0.399 . . . . 10.0 111.025 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.28 -45.58 90.79 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 120.872 0.367 . . . . 10.0 110.494 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 70.1 t -61.74 -47.14 94.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.469 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 67' ' ' ALA . 63.4 t -61.73 -41.97 92.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.955 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.458 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 7.0 ttm180 -59.43 -49.36 78.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.927 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.45 ' HA ' ' OE1' ' A' ' 73' ' ' GLU . 35.1 tp10 -65.83 -40.21 91.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.917 0.389 . . . . 10.0 110.39 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.71 -32.46 71.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.136 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 17.2 m -68.27 -33.5 74.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.416 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.1 mtmm -72.35 -24.07 61.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.25 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 67.7 mtt180 -97.16 -50.35 4.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 96.8 t -67.5 -61.52 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.713 0.292 . . . . 10.0 111.24 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -82.75 -59.62 2.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.849 0.357 . . . . 10.0 110.937 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 131.08 -27.95 3.74 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.535 -0.626 . . . . 10.0 111.535 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -90.69 138.4 31.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.897 0.379 . . . . 10.0 110.594 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 82' ' ' ARG . 12.4 ttp180 -80.86 139.69 35.8 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.596 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.27 109.0 2.93 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -53.35 147.03 11.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.799 -0.637 . . . . 10.0 111.967 -178.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.07 -35.54 77.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.318 -0.855 . . . . 10.0 111.165 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.2 m -65.62 -28.94 45.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.83 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -75.02 -30.56 61.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.22 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.5 mt -63.31 -36.26 83.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.235 -0.439 . . . . 10.0 109.866 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.433 ' O ' HG23 ' A' ' 93' ' ' VAL . 48.9 mt -64.98 -47.94 75.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.83 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -64.75 -39.36 96.59 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.908 -0.663 . . . . 10.0 111.961 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.9 -35.2 91.7 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.021 -0.609 . . . . 10.0 112.301 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.554 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 18.5 ttm -71.03 -34.47 71.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.04 0.447 . . . . 10.0 110.008 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 89' ' ' LEU . 68.7 t -67.56 -37.04 78.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.505 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.35 6.28 2.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.533 -0.758 . . . . 10.0 112.915 -178.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASN . . . . . 0.408 ' ND2' ' HG3' ' A' ' 61' ' ' GLU . 50.0 t30 -88.82 -20.75 24.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.301 0.572 . . . . 10.0 109.882 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -117.31 -176.95 3.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.405 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.579 ' HA ' ' O ' ' A' ' 387' ' ' LEU . 6.7 ttt85 -76.36 74.95 3.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.121 0.486 . . . . 10.0 111.037 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -142.81 154.66 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.235 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.535 HD12 HG11 ' A' ' 211' ' ' VAL . 36.3 mm -108.61 124.2 64.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.013 -0.736 . . . . 10.0 109.013 178.562 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -100.75 111.54 23.79 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.744 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.43 125.39 29.88 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.914 -0.772 . . . . 10.0 108.914 178.668 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 47.9 ttm -130.56 147.6 52.26 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.006 0.431 . . . . 10.0 110.793 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.527 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 13.0 mmm180 -76.59 153.93 34.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.964 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.32 99.25 1.91 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.022 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 139.42 -23.78 2.82 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.471 -0.871 . . . . 10.0 112.839 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -68.78 -20.48 64.35 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.932 0.396 . . . . 10.0 111.073 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.16 70.48 1.32 Allowed Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 121.039 -0.6 . . . . 10.0 113.065 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.3 ptmm? -68.34 -32.79 73.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.329 . . . . 10.0 110.974 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -36.02 80.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 10.0 111.192 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 24.2 tp -78.07 -18.32 55.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.212 0.529 . . . . 10.0 110.474 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 60.2 m -82.11 -29.43 31.71 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.365 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.44 -23.89 67.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.563 -0.744 . . . . 10.0 112.205 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.18 -23.92 66.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.234 0.457 . . . . 10.0 112.234 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 58.3 mt -70.65 -59.26 3.89 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.156 0.428 . . . . 10.0 112.156 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.36 -28.25 63.15 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.929 1.752 . . . . 10.0 111.883 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.72 -50.19 65.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.459 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.442 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 63.0 t80 -60.87 -45.89 92.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.026 0.441 . . . . 10.0 110.504 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.541 ' O ' HD11 ' A' ' 60' ' ' LEU . 23.9 tp -59.47 -54.61 44.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.865 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -70.5 -20.54 62.83 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.413 0.523 . . . . 10.0 112.413 -178.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.549 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -71.9 -29.79 64.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.729 0.3 . . . . 10.0 110.763 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 65.4 mt -56.8 -25.53 55.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.791 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 73.1 p -69.22 -25.15 64.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.887 0.375 . . . . 10.0 111.35 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 82.15 -1.13 87.81 Favored Glycine 0 CA--C 1.519 0.318 0 C-N-CA 121.019 -0.61 . . . . 10.0 112.624 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -74.13 -33.95 63.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.92 0.39 . . . . 10.0 110.813 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 115.8 131.57 4.91 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.493 -0.86 . . . . 10.0 113.341 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 73.9 t -106.22 112.96 41.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -94.13 105.41 17.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.887 0.375 . . . . 10.0 110.481 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 55.4 t -91.73 116.91 33.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.165 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 82.8 t -98.11 112.54 30.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.323 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.27 158.47 15.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.528 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 16.0 m -66.74 -24.11 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -154.81 170.69 21.04 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.965 -0.383 . . . . 10.0 109.965 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -78.54 -24.24 45.77 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.177 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -62.49 -55.04 31.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.956 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.9 mt -71.11 -29.25 65.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.558 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.67 -53.53 56.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.782 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.21 -30.09 64.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.459 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -63.55 -54.74 31.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.296 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ASP . . . . . 0.464 ' HA ' ' HB3' ' A' ' 142' ' ' ASN . 0.5 OUTLIER -75.87 -20.02 58.41 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.711 -0.396 . . . . 10.0 112.034 -178.402 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.65 -35.74 81.54 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -84.47 -27.94 27.13 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.189 -0.914 . . . . 10.0 110.05 178.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ASN . . . . . 0.464 ' HB3' ' HA ' ' A' ' 139' ' ' ASP . 38.8 t30 -67.82 -47.57 68.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.093 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -86.48 -4.92 59.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.541 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.503 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 56.1 ttm-85 -58.82 -49.86 91.14 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' PRO . . . . . 0.503 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 27.6 Cg_exo -63.6 -7.3 12.35 Favored 'Trans proline' 0 C--N 1.36 1.171 0 C-N-CA 122.32 2.013 . . . . 10.0 113.031 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 19.8 tp -100.35 -50.14 4.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.948 0.404 . . . . 10.0 110.346 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -65.83 -50.6 64.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.667 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -67.12 -21.15 65.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.885 0.374 . . . . 10.0 111.119 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -69.4 -34.63 74.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.312 0.577 . . . . 10.0 109.613 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.415 HD13 ' CE1' ' A' ' 117' ' ' TYR . 39.5 mt -89.26 -22.65 22.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.262 -0.881 . . . . 10.0 110.72 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.7 4.44 11.74 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.21 -0.995 . . . . 10.0 113.831 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 36.6 mt -88.86 134.15 34.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.949 0.375 . . . . 10.0 110.135 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 7.0 p -83.4 128.1 34.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.388 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.464 HG21 ' HA ' ' A' ' 144' ' ' ARG . 4.8 t -104.52 111.87 35.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.858 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -107.91 145.03 16.18 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 111.647 -0.581 . . . . 10.0 111.647 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.4 tp -122.08 127.36 75.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 120.798 0.332 . . . . 10.0 110.153 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -112.21 115.08 28.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.122 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 92.2 mt -107.97 148.29 37.14 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.31 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' PRO . . . . . 0.501 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 19.2 Cg_endo -58.91 112.46 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 122.71 2.273 . . . . 10.0 112.691 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.75 -1.53 48.74 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.689 -0.767 . . . . 10.0 112.927 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' MET . . . . . 0.516 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 49.9 ttm -59.2 138.31 88.31 Favored Pre-proline 0 C--N 1.326 -0.424 0 C-N-CA 122.195 0.198 . . . . 10.0 110.745 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -53.68 144.42 53.49 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.812 2.341 . . . . 10.0 112.654 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 163' ' ' ALA . . . . . 0.468 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.18 -49.08 86.7 Favored Pre-proline 0 CA--C 1.54 0.584 0 N-CA-C 113.202 0.816 . . . . 10.0 113.202 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 31.9 Cg_exo -60.38 -32.78 94.38 Favored 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 121.771 1.647 . . . . 10.0 112.26 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.13 -37.85 63.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.577 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.516 ' HE2' ' O ' ' A' ' 161' ' ' MET . 60.6 mttm -60.49 -40.5 91.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.708 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -64.23 -27.97 69.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.116 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -78.12 -18.92 55.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.971 0.415 . . . . 10.0 110.779 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -96.27 -39.64 9.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.932 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -73.08 -27.02 61.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.327 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 171' ' ' ALA . . . . . 0.47 ' HA ' ' NE ' ' A' ' 201' ' ' ARG . . . -82.99 -3.23 56.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.959 0.409 . . . . 10.0 110.784 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -80.25 169.64 17.5 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.408 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 173' ' ' ASP . . . . . 0.549 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 11.9 m-20 -64.9 -47.25 78.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.199 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.8 mp -124.04 130.33 73.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.142 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.7 m -118.49 112.19 19.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.853 0.359 . . . . 10.0 111.16 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -88.73 137.54 32.23 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.492 -0.558 . . . . 10.0 109.492 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -174.63 174.88 46.8 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.219 -0.991 . . . . 10.0 112.898 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.59 149.06 21.86 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.608 0.242 . . . . 10.0 110.777 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -58.4 -38.02 76.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.729 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -59.19 -52.26 66.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.364 -179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.501 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.5 tp10 -68.18 -38.02 81.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.836 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -57.99 -37.59 74.54 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.99 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -73.54 -43.35 37.23 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.929 -0.653 . . . . 10.0 111.848 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -65.51 -38.84 90.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.695 0.283 . . . . 10.0 110.628 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 185' ' ' ASP . . . . . 0.449 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 20.2 m-20 -60.54 -44.13 96.44 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.008 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -61.94 -39.97 93.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.568 -0.742 . . . . 10.0 110.449 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 75.8 mt -66.98 -44.1 81.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.509 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 56.9 mtm-85 -63.81 -41.69 97.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.781 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 189' ' ' ASP . . . . . 0.427 ' OD1' HG22 ' A' ' 199' ' ' VAL . 0.4 OUTLIER -64.44 -31.22 72.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.267 0.556 . . . . 10.0 110.88 179.732 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -80.1 -14.87 58.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.163 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 35.6 mtp -103.66 17.08 24.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.963 0.411 . . . . 10.0 111.099 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -80.35 162.24 24.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.333 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -104.13 -25.12 13.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.342 0.592 . . . . 10.0 109.927 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -128.6 139.3 35.18 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.56 -0.746 . . . . 10.0 109.357 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.58 -22.7 73.35 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.528 2.152 . . . . 10.0 111.983 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 48.0 mp0 -71.83 -15.88 62.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.14 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -84.61 -17.78 37.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.272 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 24.6 mtt85 -55.36 137.85 47.0 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 123.481 0.488 . . . . 10.0 111.53 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 199' ' ' VAL . . . . . 0.427 HG22 ' OD1' ' A' ' 189' ' ' ASP . 22.6 m -110.15 -20.38 6.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.998 -0.547 . . . . 10.0 111.287 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -90.74 -175.09 4.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.339 0.59 . . . . 10.0 111.552 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 201' ' ' ARG . . . . . 0.47 ' NE ' ' HA ' ' A' ' 171' ' ' ALA . 11.2 mtm180 -140.29 -174.41 3.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.611 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 26.5 mttm -55.61 137.83 48.24 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.239 0.542 . . . . 10.0 111.804 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 18.5 mt -86.37 66.65 9.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.619 -0.719 . . . . 10.0 109.692 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -74.68 -72.7 0.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.661 -0.7 . . . . 10.0 112.235 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 205' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' A' ' 386' ' ' LYS . 29.1 t80 -122.33 135.91 54.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.008 0.432 . . . . 10.0 111.778 -177.582 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.49 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -128.07 123.74 35.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.369 -0.832 . . . . 10.0 109.499 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 64.4 tp -119.83 110.52 16.86 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.334 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -100.54 130.62 49.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.355 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -58.47 -65.38 0.66 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.798 -0.637 . . . . 10.0 111.984 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 210' ' ' GLU . . . . . 0.469 ' OE2' ' HA ' ' A' ' 391' ' ' THR . 17.6 tp10 -112.75 110.39 20.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.006 0.432 . . . . 10.0 110.482 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.535 HG11 HD12 ' A' ' 99' ' ' ILE . 28.4 m -82.91 -18.83 10.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.237 -0.438 . . . . 10.0 112.083 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 212' ' ' ASP . . . . . 0.483 ' OD1' ' HD2' ' A' ' 566' ' ' ARG . 7.2 t70 -51.87 -72.22 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.23 19.24 2.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.749 0.648 . . . . 10.0 112.749 -177.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 214' ' ' ILE . . . . . 0.4 ' O ' ' HB2' ' A' ' 218' ' ' GLU . 36.3 mt -125.04 -50.52 2.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.624 -0.431 . . . . 10.0 112.002 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 18.8 mt -82.7 -30.31 29.25 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 35.0 mm -98.43 -50.99 10.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.785 -0.366 . . . . 10.0 111.466 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.56 -46.54 72.42 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.02 0.378 . . . . 10.0 112.02 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 218' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 214' ' ' ILE . 5.8 mm-40 -95.89 31.97 1.99 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.687 0.28 . . . . 10.0 111.602 -178.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 219' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 378' ' ' GLN . . . -72.91 -51.94 16.61 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.826 0.346 . . . . 10.0 111.789 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 220' ' ' ARG . . . . . 0.474 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -93.8 22.06 5.95 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -178.085 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 4.1 m -88.74 108.99 26.46 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.94 -0.392 . . . . 10.0 109.94 178.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 222' ' ' PRO . . . . . 0.474 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 87.0 Cg_endo -93.47 134.16 0.98 Allowed 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.054 2.503 . . . . 10.0 113.789 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 223' ' ' LEU . . . . . 0.582 ' O ' ' HA ' ' A' ' 374' ' ' SER . 86.5 mt -94.04 110.46 22.15 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.875 -0.787 . . . . 10.0 108.875 178.081 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 224' ' ' ILE . . . . . 0.414 HG12 ' OG ' ' A' ' 374' ' ' SER . 22.1 mt -105.72 125.59 61.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 120.809 0.338 . . . . 10.0 111.32 -179.082 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 54.0 mt . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 178.49 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.403 0 N-CA-C 109.683 -0.488 . . . . 10.0 109.683 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 374' ' ' SER . . . . . 0.582 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 7.5 t -155.55 147.82 23.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.809 0.338 . . . . 10.0 111.031 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.3 tt -157.06 147.08 11.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.021 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 4.0 p -97.31 148.77 22.8 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -57.68 -41.75 82.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.712 0.291 . . . . 10.0 110.889 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 378' ' ' GLN . . . . . 0.4 ' HB3' ' O ' ' A' ' 219' ' ' ALA . 0.0 OUTLIER -61.17 -33.06 72.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.375 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 -90.01 -8.44 51.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.775 0.321 . . . . 10.0 111.119 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -87.61 -43.52 11.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.113 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -72.96 -11.25 60.5 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.267 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 44.5 mtp180 -77.86 -9.72 59.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.023 0.439 . . . . 10.0 110.304 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 30.3 mt -94.77 -8.25 38.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.502 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 384' ' ' TYR . . . . . 0.49 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 18.5 m-85 -84.96 132.89 34.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.684 0.278 . . . . 10.0 111.208 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -64.15 -56.09 17.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.197 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 386' ' ' LYS . . . . . 0.457 ' O ' ' HA ' ' A' ' 205' ' ' TYR . 69.1 mttt -110.56 113.14 25.53 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.579 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 41.5 tp -122.25 124.68 44.34 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.257 -0.428 . . . . 10.0 110.082 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -140.64 160.04 40.88 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.595 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -166.53 164.21 37.51 Favored Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.381 -0.914 . . . . 10.0 112.368 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 62.4 mtm -119.03 171.65 8.11 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.877 -0.416 . . . . 10.0 109.877 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 391' ' ' THR . . . . . 0.469 ' HA ' ' OE2' ' A' ' 210' ' ' GLU . 1.9 t -162.55 158.31 23.32 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.881 0.372 . . . . 10.0 110.782 179.093 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -81.76 -171.32 45.62 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.916 -0.659 . . . . 10.0 111.843 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 393' ' ' THR . . . . . 0.527 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 1.9 m -73.56 79.59 1.47 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.228 0.537 . . . . 10.0 111.136 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -119.89 -60.86 1.67 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.56 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 395' ' ' ASP . . . . . 0.449 ' CG ' ' H ' ' A' ' 396' ' ' THR . 9.9 t70 58.8 -145.84 0.54 Allowed 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.262 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 396' ' ' THR . . . . . 0.686 HG21 ' HB3' ' A' ' 565' ' ' ARG . 5.3 m 69.56 -79.53 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.101 0.56 . . . . 10.0 112.169 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -86.26 26.49 1.04 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.129 0.49 . . . . 10.0 110.444 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -69.86 -29.72 67.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 10.0 111.238 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -64.13 -23.87 67.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.063 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 400' ' ' GLU . . . . . 0.471 ' HA ' ' OE1' ' A' ' 400' ' ' GLU . 5.0 mm-40 -68.93 -24.06 64.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.875 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 401' ' ' PHE . . . . . 0.464 ' HB3' ' HB2' ' A' ' 407' ' ' LEU . 39.2 m-85 -64.09 -31.81 73.14 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 178.355 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.23 -27.41 26.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.262 -0.881 . . . . 10.0 110.539 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 2.6 m -73.01 -39.54 65.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.806 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 17.4 mt -98.96 -53.66 7.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 113.451 0.908 . . . . 10.0 113.451 -177.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -99.64 -2.0 36.62 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.802 0.667 . . . . 10.0 112.802 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt 63.16 29.8 16.05 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.45 0.469 . . . . 10.0 111.659 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 407' ' ' LEU . . . . . 0.496 HD13 HD11 ' A' ' 99' ' ' ILE . 5.3 mt -84.94 138.58 32.41 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.617 -0.265 . . . . 10.0 111.065 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 408' ' ' ASP . . . . . 0.53 ' OD2' ' HD2' ' A' ' 13' ' ' ARG . 22.0 t70 -81.41 160.09 24.14 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 6.8 m -114.4 115.5 27.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.986 0.422 . . . . 10.0 111.733 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.61 138.28 54.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.016 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 44.7 t -104.32 125.55 59.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.73 0.3 . . . . 10.0 110.752 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 94.4 t -84.0 127.66 66.03 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.497 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.32 136.6 47.88 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.665 2.244 . . . . 10.0 112.41 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.43 HG23 ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.8 149.87 45.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.651 -0.704 . . . . 10.0 111.016 179.257 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -58.4 -50.23 74.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.146 0.498 . . . . 10.0 110.066 179.219 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -114.34 158.71 39.12 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.94 114.12 2.16 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.239 1.959 . . . . 10.0 111.333 178.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 54.0 ttp -68.55 113.44 6.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.092 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 34.3 mt -98.67 73.12 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.335 0.588 . . . . 10.0 109.827 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -102.04 116.48 32.77 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.024 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -84.96 99.23 10.85 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.71 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.23 110.52 16.78 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.734 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 424' ' ' PRO . 51.4 mt -100.55 132.28 22.58 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.101 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 424' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 423' ' ' LEU . 50.6 Cg_exo -53.86 144.7 54.28 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.936 2.424 . . . . 10.0 113.544 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.83 138.83 48.57 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.506 -0.77 . . . . 10.0 109.825 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 15.4 mt -113.56 118.54 34.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.991 0.424 . . . . 10.0 110.549 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 91.3 t -99.7 122.23 51.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.598 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 428' ' ' TYR . . . . . 0.471 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 5.0 m-85 -109.76 176.36 5.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.252 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -80.25 -79.28 0.15 Allowed 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.972 -0.291 . . . . 10.0 110.99 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 70.1 p -82.24 160.23 23.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.737 0.303 . . . . 10.0 110.993 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -62.5 -33.52 75.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.371 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.79 80.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.595 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.51 -42.77 99.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.247 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 434' ' ' LYS . . . . . 0.435 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 38.3 ttpt -62.09 -50.08 73.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.566 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 435' ' ' ILE . . . . . 0.496 ' O ' HG12 ' A' ' 439' ' ' ILE . 51.4 mm -62.88 -44.3 99.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.598 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.6 -41.88 86.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.615 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.23 -36.97 85.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.339 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 438' ' ' ILE . . . . . 0.428 HG23 HG21 ' A' ' 557' ' ' ILE . 90.6 mt -64.24 -47.92 87.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.769 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 439' ' ' ILE . . . . . 0.496 HG12 ' O ' ' A' ' 435' ' ' ILE . 46.6 mm -59.78 -40.24 82.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.081 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -62.05 -44.57 96.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.443 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -63.58 -36.62 84.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.609 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.488 HG12 HG11 ' A' ' 452' ' ' VAL . 96.4 mt -72.24 -42.75 66.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.445 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -48.52 -53.93 16.28 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.971 0.73 . . . . 10.0 112.971 -179.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -62.49 -41.84 99.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.967 0.413 . . . . 10.0 111.866 -178.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.419 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 76.2 mtt-85 -71.26 -35.79 71.51 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.18 0.437 . . . . 10.0 112.18 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 24.8 m -66.43 -33.89 76.72 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.258 0.551 . . . . 10.0 110.146 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -70.69 -46.14 63.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.37 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.63 -44.89 76.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.357 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 120.9 32.45 1.08 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.43 -0.891 . . . . 10.0 112.97 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 450' ' ' GLN . . . . . 0.419 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 61.9 tt0 -104.04 125.82 33.41 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.871 0.335 . . . . 10.0 110.16 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.38 136.51 47.31 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.553 2.168 . . . . 10.0 111.697 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 452' ' ' VAL . . . . . 0.488 HG11 HG12 ' A' ' 442' ' ' ILE . 59.5 t -124.57 122.61 64.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.04 0.448 . . . . 10.0 111.62 -178.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 52.2 tp -108.33 110.0 21.46 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 19.9 t -89.61 113.83 26.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.464 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -93.66 123.78 7.56 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.79 -0.719 . . . . 10.0 111.664 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 34.2 p -122.9 130.47 52.89 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.591 0.234 . . . . 10.0 110.695 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 30.0 pt -95.73 -8.76 9.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.103 0.478 . . . . 10.0 110.296 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 458' ' ' SER . . . . . 0.415 ' HB2' ' HD3' ' A' ' 461' ' ' LYS . 0.9 OUTLIER -124.79 126.13 45.13 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.769 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 47.0 mt -57.73 -37.09 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-O 121.051 0.453 . . . . 10.0 111.517 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -56.19 -42.95 77.94 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.142 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.415 ' HD3' ' HB2' ' A' ' 458' ' ' SER . 0.8 OUTLIER -72.91 -28.93 62.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.314 -178.922 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.5 m -62.44 -47.65 83.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.247 0.546 . . . . 10.0 109.685 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -68.45 -35.4 77.54 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.718 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 50.7 tp -63.79 -52.45 60.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.799 -0.637 . . . . 10.0 111.356 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 8.8 p -67.16 -31.62 54.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.847 0.356 . . . . 10.0 110.812 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 5.6 t -65.59 -38.96 90.98 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.72 -0.474 . . . . 10.0 109.72 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -62.35 -51.05 69.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.41 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -60.58 -41.19 94.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.39 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.64 -38.42 87.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.761 0.315 . . . . 10.0 110.755 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.0 m -68.51 -36.88 79.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.326 0.584 . . . . 10.0 110.058 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -67.64 -23.31 65.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.854 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -95.5 -3.09 47.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.009 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 72.65 14.15 77.91 Favored Glycine 0 C--N 1.329 0.169 0 C-N-CA 121.013 -0.613 . . . . 10.0 112.481 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 94.5 mt -78.4 120.86 30.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.837 0.351 . . . . 10.0 110.23 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -65.93 117.34 8.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.019 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -145.56 158.21 43.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.171 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -132.1 144.76 50.95 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.255 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 17.2 t -104.63 132.12 52.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.967 -0.382 . . . . 10.0 109.967 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.4 HD12 ' HB2' ' A' ' 503' ' ' ALA . 88.4 mt -86.31 93.84 9.19 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.122 0.486 . . . . 10.0 110.425 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -85.37 119.81 26.15 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.413 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -64.62 -25.06 67.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.901 -0.59 . . . . 10.0 112.179 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -69.68 -23.1 63.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.042 0.449 . . . . 10.0 110.701 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -120.06 64.84 0.82 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.644 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 484' ' ' HIS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 487' ' ' GLU . 0.0 OUTLIER -64.58 -24.36 67.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.593 -178.756 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.38 -33.22 75.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.085 0.469 . . . . 10.0 110.05 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -89.88 -40.49 12.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.955 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 487' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 484' ' ' HIS . 0.1 OUTLIER -54.01 -51.92 62.43 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.659 -0.7 . . . . 10.0 111.515 -179.81 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -56.46 -32.47 64.97 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 112.4 0.518 . . . . 10.0 112.4 -178.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -73.49 -37.52 65.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.033 0.444 . . . . 10.0 110.754 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 28.8 mt -76.55 -41.43 34.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.329 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 66.6 t -57.22 -34.75 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-O 121.073 0.463 . . . . 10.0 110.744 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -63.43 -22.34 66.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.57 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 -120.03 22.44 11.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.64 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -71.6 -16.66 62.3 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.997 0.427 . . . . 10.0 111.144 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -95.39 16.44 61.26 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.854 -0.688 . . . . 10.0 111.862 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -74.39 141.09 76.44 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 110.134 -0.321 . . . . 10.0 110.134 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.38 125.6 19.7 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.452 2.101 . . . . 10.0 112.51 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.24 29.8 4.48 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.697 -0.683 . . . . 10.0 112.35 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -105.66 114.61 28.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.832 0.348 . . . . 10.0 110.341 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 23.4 t -98.7 118.4 45.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.198 -0.455 . . . . 10.0 109.892 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.62 138.18 54.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.061 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 41.2 mt -109.98 129.36 65.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.727 -0.471 . . . . 10.0 109.727 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 503' ' ' ALA . . . . . 0.4 ' HB2' HD12 ' A' ' 479' ' ' LEU . . . -121.42 129.45 53.01 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.818 0.342 . . . . 10.0 111.066 -179.603 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 7.4 m -104.89 119.55 39.28 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.464 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 66.8 t30 59.21 77.3 0.32 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.953 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -78.03 123.61 27.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.482 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -70.51 172.74 7.96 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.172 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -65.64 152.95 51.49 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.044 -0.598 . . . . 10.0 112.578 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 67.78 -81.91 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.162 0.585 . . . . 10.0 111.502 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 87.33 149.15 15.23 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.967 -0.635 . . . . 10.0 112.37 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.96 151.07 31.39 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 122.666 0.387 . . . . 10.0 111.527 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -76.27 103.65 6.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.447 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 66.8 mt -84.97 111.29 20.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.209 -0.45 . . . . 10.0 109.98 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 18.4 t -80.5 132.49 31.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.736 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 65.4 mt -67.42 130.39 42.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.703 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 94.32 -11.42 70.41 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.986 -0.626 . . . . 10.0 111.786 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 117.13 -170.78 13.56 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 110.914 -0.874 . . . . 10.0 110.914 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 5.1 p -129.19 99.49 5.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 117.206 0.503 . . . . 10.0 110.993 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 20.0 p-90 -58.28 -28.48 65.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.88 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -62.88 -31.38 72.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.871 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -86.48 -34.26 20.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.057 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -64.76 -40.76 95.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.716 -0.675 . . . . 10.0 111.169 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.9 m -73.42 -19.9 18.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.979 0.419 . . . . 10.0 110.708 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -87.31 -6.81 58.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.728 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -91.47 3.57 54.65 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.486 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 16.5 mt -97.83 150.33 21.39 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.26 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -74.83 -49.08 21.89 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.031 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -126.63 90.59 49.41 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.535 -0.542 . . . . 10.0 109.535 179.125 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.3 113.46 2.26 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.765 2.31 . . . . 10.0 112.504 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -104.18 149.0 25.66 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.525 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.38 -37.17 64.68 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.689 0.281 . . . . 10.0 111.465 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -58.19 -36.28 72.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.87 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -81.95 -40.49 22.18 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.793 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 76.7 mt -58.81 -48.04 87.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.353 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -72.41 -29.07 63.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.81 0.338 . . . . 10.0 110.859 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -69.59 -50.74 41.66 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 94.2 mt -62.81 -36.23 74.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.141 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -59.78 -42.16 92.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.023 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -70.06 -45.29 67.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.566 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.19 -47.08 84.54 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.331 0.586 . . . . 10.0 110.065 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -62.46 -40.66 97.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.334 -0.848 . . . . 10.0 110.427 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -55.21 -42.51 73.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.854 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 61.9 t -65.79 -47.81 84.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.437 179.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 10.0 mtp180 -62.67 -37.84 88.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.572 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -60.71 -49.05 79.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.326 -0.852 . . . . 10.0 111.058 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -70.15 -27.34 64.47 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.537 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -65.27 -35.55 81.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.106 0.479 . . . . 10.0 109.991 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 95.6 t -73.46 -33.97 41.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.576 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 88.6 mt -58.88 -50.4 74.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.322 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -69.07 -24.78 64.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.916 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -72.12 -23.42 61.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.24 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 122.46 5.15 8.69 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.362 -0.923 . . . . 10.0 113.477 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 79.24 -169.03 53.61 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.732 -0.747 . . . . 10.0 112.678 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 52.9 tp -69.2 123.06 20.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.865 0.364 . . . . 10.0 110.693 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -101.59 123.23 45.27 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.965 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 21.8 mm -106.89 131.49 56.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.335 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 557' ' ' ILE . . . . . 0.428 HG21 HG23 ' A' ' 438' ' ' ILE . 25.5 mt -119.24 124.41 73.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.054 178.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 558' ' ' GLY . . . . . 0.537 ' HA3' ' CD2' ' A' ' 586' ' ' PHE . . . -101.68 125.6 8.61 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.991 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 2.0 p -83.02 -30.41 28.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.24 0.543 . . . . 10.0 110.428 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -153.6 152.75 31.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.043 -0.98 . . . . 10.0 109.134 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 37.4 mtt-85 -101.16 158.76 15.79 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.195 -0.298 . . . . 10.0 110.195 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -87.41 152.58 22.13 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.012 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.25 -45.25 95.31 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 3.9 p -89.22 128.61 35.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.487 -0.779 . . . . 10.0 109.874 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 565' ' ' ARG . . . . . 0.686 ' HB3' HG21 ' A' ' 396' ' ' THR . 16.2 tpt180 -70.91 -21.59 62.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.535 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 566' ' ' ARG . . . . . 0.483 ' HD2' ' OD1' ' A' ' 212' ' ' ASP . 3.2 mtm180 -54.65 -52.6 61.79 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.954 0.407 . . . . 10.0 110.796 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 46.5 mt -80.03 -30.75 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.54 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -62.42 -40.34 96.23 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.77 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -69.13 -31.81 70.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.791 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -65.12 -28.22 69.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.998 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 35.7 tp -74.4 -26.96 60.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.109 0.48 . . . . 10.0 110.375 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 20.9 ttp180 -84.82 -27.47 26.76 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.518 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -84.03 29.64 3.79 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.991 -0.623 . . . . 10.0 113.499 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -82.17 -44.33 16.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 117.001 0.401 . . . . 10.0 110.211 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 1.2 m -87.97 172.45 9.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.938 -0.573 . . . . 10.0 110.201 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 69.38 42.3 74.66 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.568 -0.825 . . . . 10.0 112.337 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -82.36 135.88 35.09 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 64.61 18.02 11.18 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.131 0.491 . . . . 10.0 110.018 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 80.84 43.92 8.66 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.696 -0.684 . . . . 10.0 111.825 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -99.29 -163.84 1.07 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.513 -0.18 . . . . 10.0 110.513 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -93.73 173.1 7.85 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.232 0.539 . . . . 10.0 111.791 -179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 159.29 166.69 18.75 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.761 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 p -147.6 138.37 23.37 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.761 0.281 . . . . 10.0 110.326 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 12.6 m -123.06 132.08 53.97 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.605 -0.271 . . . . 10.0 110.681 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -146.21 128.31 15.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.091 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 586' ' ' PHE . . . . . 0.537 ' CD2' ' HA3' ' A' ' 558' ' ' GLY . 18.1 m-85 -114.84 146.96 40.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.039 0.447 . . . . 10.0 110.646 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 587' ' ' TYR . . . . . 0.435 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 65.3 m-85 -126.5 135.38 51.25 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 63.9 mt -133.91 160.0 39.0 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.697 0.284 . . . . 10.0 110.699 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 25.5 p -130.88 164.75 24.56 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.003 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 78.5 mmm -76.22 -2.52 31.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.92 0.391 . . . . 10.0 111.117 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -98.01 1.93 48.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.366 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -88.41 142.69 27.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.78 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -65.26 -13.73 59.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.547 -0.751 . . . . 10.0 112.34 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 594' ' ' LEU . . . . . 0.562 ' O ' HG12 ' A' ' 597' ' ' ILE . 15.7 tp -65.38 -23.95 67.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.918 0.39 . . . . 10.0 110.858 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 19.5 mmt -77.52 -3.79 42.35 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.916 0.389 . . . . 10.0 111.159 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -92.4 -15.33 27.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.771 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 597' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 594' ' ' LEU . 29.1 pt -67.3 -14.29 17.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-O 120.999 0.428 . . . . 10.0 111.241 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -76.53 -10.65 59.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.046 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.83 -55.93 0.65 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.458 0.703 . . . . 10.0 110.781 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 7.3 m -93.91 103.64 15.73 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -16.52 39.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.871 -0.604 . . . . 10.0 112.113 -178.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 4.4 mmt180 -63.0 -32.78 74.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.696 0.284 . . . . 10.0 110.552 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 50.7 t -68.0 -48.89 72.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.281 -0.418 . . . . 10.0 109.938 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.1 -38.47 85.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.32 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -64.6 -26.57 71.0 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.946 -0.57 . . . . 10.0 112.489 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 58.2 tpp -68.93 -18.04 64.04 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.113 0.482 . . . . 10.0 110.572 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 59.7 mtt -76.58 -14.98 59.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.257 -0.428 . . . . 10.0 110.522 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 608' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 608' ' ' ARG . 36.5 mtt-85 -72.07 -12.97 61.46 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.23 0.538 . . . . 10.0 110.358 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 10.6 mmmt -82.93 1.99 36.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.889 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 5.2 mp -75.91 -14.87 60.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.572 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 92.35 -31.73 5.89 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.973 -0.632 . . . . 10.0 111.774 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 612' ' ' MET . . . . . 0.438 ' HG3' ' HA ' ' A' ' 428' ' ' TYR . 0.0 OUTLIER 69.78 -66.8 0.25 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 123.539 0.736 . . . . 10.0 111.69 179.763 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp 57.42 78.32 0.37 Allowed Pre-proline 0 CA--C 1.53 0.198 0 O-C-N 123.524 0.515 . . . . 10.0 111.131 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 614' ' ' PRO . . . . . 0.471 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 52.3 Cg_exo -56.56 119.12 6.13 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.142 2.561 . . . . 10.0 112.506 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 101.74 -9.32 56.88 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.893 -0.67 . . . . 10.0 111.891 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -111.05 120.11 41.26 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.992 0.425 . . . . 10.0 110.347 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -79.28 96.93 6.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.618 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.2 tp -72.24 -23.22 21.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.841 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 46.98 83.65 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.797 0.685 . . . . 10.0 112.524 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -116.79 94.03 42.87 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.273 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -61.44 -29.22 84.87 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.102 2.535 . . . . 10.0 113.447 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 70.1 p-90 -65.36 -25.75 67.71 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.886 -0.326 . . . . 10.0 110.996 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 73.1 t -67.85 -42.36 85.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 1.8 m -62.74 -38.85 92.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.445 -0.798 . . . . 10.0 110.081 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -68.97 -39.18 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.177 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -61.68 -38.4 87.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.231 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.76 -43.64 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.935 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 628' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' A' ' 632' ' ' ARG . . . -60.33 -42.21 95.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.411 179.534 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 629' ' ' ASN . . . . . 0.411 ' O ' ' HG3' ' A' ' 633' ' ' LYS . 61.3 t30 -67.65 -35.86 79.69 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.144 179.391 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -64.75 -41.87 95.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.975 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 631' ' ' GLN . . . . . 0.402 ' OE1' ' HD3' ' A' ' 565' ' ' ARG . 49.5 mt-30 -62.76 -37.45 86.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.083 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 632' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 628' ' ' ALA . 12.7 mtp180 -61.77 -34.62 76.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.277 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 633' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 629' ' ' ASN . 57.5 mttm -64.91 -38.93 92.61 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 92.1 t -62.22 -49.56 83.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.053 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -62.41 -30.95 71.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.292 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.4 m -69.43 -23.78 63.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.282 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -73.28 -35.68 66.21 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -65.0 -42.29 94.61 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.63 -0.713 . . . . 10.0 109.521 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -55.7 -44.84 77.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.308 -0.86 . . . . 10.0 110.4 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -59.6 -43.37 93.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.821 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 52.3 mt -64.57 -47.6 88.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.224 179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 642' ' ' ARG . . . . . 0.507 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 75.4 mtm-85 -60.28 -43.34 96.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.945 -0.57 . . . . 10.0 110.314 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 18.5 ttpt -55.21 -45.99 75.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.914 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -64.93 -41.5 95.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.944 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 88.9 mt -65.99 -41.39 91.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.926 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 646' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 97.5 mt -59.07 -42.47 90.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.879 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -66.43 -13.59 60.96 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.002 0.371 . . . . 10.0 112.002 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -102.27 -38.72 7.53 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.946 0.403 . . . . 10.0 111.162 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -83.41 -25.5 31.25 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 -178.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -65.27 -31.34 72.44 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.021 0.439 . . . . 10.0 110.319 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 651' ' ' VAL . . . . . 0.427 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 13.2 t -62.98 -47.28 93.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.8 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.12 -26.54 64.95 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.539 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -63.18 -48.23 79.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.598 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.79 -44.61 95.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.555 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 655' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 42.3 mt-30 -61.56 -44.05 97.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.364 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 24.9 ttp-105 -63.02 -42.44 99.8 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.857 -0.61 . . . . 10.0 109.952 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -63.23 -44.91 93.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.956 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.83 -49.64 69.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.769 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.3 tp -65.93 -36.9 78.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 C-N-CA 121.103 -0.239 . . . . 10.0 111.271 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 6.1 m-30 -68.32 -40.08 81.75 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.937 -0.394 . . . . 10.0 109.937 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 5.1 t -60.47 -49.46 77.48 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.066 -0.516 . . . . 10.0 109.698 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -58.88 -47.77 83.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.781 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 667' ' ' LEU . 43.8 ttt-85 -60.91 -39.23 88.57 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.042 -0.527 . . . . 10.0 111.571 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -73.45 -43.35 60.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.562 0.22 . . . . 10.0 111.487 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -58.45 -37.62 75.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.095 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 61.2 mt -88.7 -4.43 58.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.834 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.498 ' HB2' ' O ' ' A' ' 663' ' ' ARG . 20.3 tp -87.15 -46.96 9.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.075 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -68.41 -41.71 80.05 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.066 -0.516 . . . . 10.0 111.623 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 21.7 m -72.67 164.2 3.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.072 0.463 . . . . 10.0 111.423 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 53.9 m -115.96 -38.72 3.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.331 -179.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -80.12 84.63 5.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.136 0.493 . . . . 10.0 110.579 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 672' ' ' VAL . . . . . 0.4 ' O ' HG12 ' A' ' 676' ' ' ILE . 9.5 p -95.01 -5.46 10.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.567 0.699 . . . . 10.0 109.716 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -39.16 69.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.074 -0.966 . . . . 10.0 111.93 -179.308 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -58.54 -50.47 73.67 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.097 0.475 . . . . 10.0 110.551 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 675' ' ' THR . . . . . 0.443 ' O ' HG12 ' A' ' 679' ' ' ILE . 0.6 OUTLIER -64.9 -44.49 89.41 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.811 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 676' ' ' ILE . . . . . 0.4 HG12 ' O ' ' A' ' 672' ' ' VAL . 36.0 mm -56.7 -51.63 64.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.755 -0.657 . . . . 10.0 111.954 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -67.52 -35.75 79.7 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 52.8 m -65.43 -46.6 79.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.618 0.247 . . . . 10.0 111.483 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 679' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 675' ' ' THR . 48.1 pt -74.76 -20.73 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.92 -0.312 . . . . 10.0 110.732 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 48.5 ttm-85 -60.48 -40.84 92.73 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.957 0.408 . . . . 10.0 110.179 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -62.96 -38.26 90.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.662 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -72.78 -46.79 51.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.223 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 683' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 679' ' ' ILE . 94.2 t -58.62 -46.11 90.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-O 120.831 0.348 . . . . 10.0 111.05 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -62.53 -42.24 99.4 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.465 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -64.07 -43.2 96.17 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.651 -0.249 . . . . 10.0 110.438 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.7 87.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.976 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 8.8 m -68.37 -37.32 80.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.563 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.04 -44.32 50.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.797 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -31.11 62.26 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.037 0.535 . . . . 10.0 111.931 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -66.62 -28.17 68.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.852 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -110.17 -22.09 11.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.739 0.304 . . . . 10.0 111.599 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 692' ' ' ILE . . . . . 0.403 HG12 ' HB3' ' A' ' 701' ' ' TRP . 28.1 mt -125.85 100.26 31.08 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.515 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.48 130.28 26.22 Favored 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.507 2.138 . . . . 10.0 110.766 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -48.11 109.04 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 123.056 2.504 . . . . 10.0 113.529 -178.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 60.06 88.91 0.07 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.661 -0.699 . . . . 10.0 111.551 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 11.9 p -154.67 -168.71 2.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.215 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 697' ' ' LEU . 32.3 mt -72.56 136.64 45.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.206 -0.294 . . . . 10.0 110.206 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -59.86 -31.71 70.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.873 -178.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -76.33 -4.56 42.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.974 0.416 . . . . 10.0 111.48 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 13.1 mmt -100.95 8.79 42.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.334 0.588 . . . . 10.0 109.784 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 701' ' ' TRP . . . . . 0.403 ' HB3' HG12 ' A' ' 692' ' ' ILE . 48.4 m0 -102.5 125.09 49.1 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.298 -0.865 . . . . 10.0 110.194 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -82.14 77.49 8.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.431 0.634 . . . . 10.0 109.334 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 703' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 32.8 mm -63.36 -49.45 79.0 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.175 -0.92 . . . . 10.0 111.16 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 704' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 51.7 Cg_exo -56.44 -45.88 34.26 Favored 'Trans proline' 0 C--N 1.359 1.13 0 C-N-CA 121.866 1.711 . . . . 10.0 112.008 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -64.22 -41.76 98.19 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.962 -0.637 . . . . 10.0 111.965 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.468 ' O ' ' HG ' ' A' ' 710' ' ' LEU . 60.0 tp -64.7 -43.44 93.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.487 0.184 . . . . 10.0 110.702 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -61.15 -47.41 86.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.525 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -66.09 -35.04 79.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.393 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.5 -46.85 88.24 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.254 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 710' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 706' ' ' LEU . 63.1 mt -60.58 -36.74 79.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.776 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -73.22 -21.08 60.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.989 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -99.15 -42.28 7.13 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.523 0.564 . . . . 10.0 112.523 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -96.02 -23.36 16.85 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.699 1.0 . . . . 10.0 113.699 -177.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -120.34 1.23 10.72 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.504 0.927 . . . . 10.0 113.504 -177.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 715' ' ' ASP . . . . . 0.415 ' HB2' ' HA ' ' A' ' 828' ' ' LYS . 22.8 t70 57.76 31.31 20.27 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 121.554 0.692 . . . . 10.0 110.22 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 14.8 tp -125.96 128.17 47.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.155 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -104.02 105.19 15.28 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.898 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 82.3 mt -121.04 104.05 41.87 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.938 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.56 73.84 3.94 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 122.536 2.157 . . . . 10.0 111.655 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 57.3 mt -55.73 -43.14 72.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.42 -0.809 . . . . 10.0 111.932 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -64.91 -21.99 66.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.679 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -80.51 -17.21 52.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.977 0.418 . . . . 10.0 110.453 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 20.0 m0 -101.75 -43.87 5.71 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.533 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 16.1 tp -57.17 -27.6 62.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.415 -178.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -86.73 -10.5 53.52 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.841 0.311 . . . . 10.0 111.841 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 42.8 mttp -111.02 -45.9 3.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.663 0.268 . . . . 10.0 111.285 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -116.3 95.15 44.52 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 121.178 0.513 . . . . 10.0 110.336 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -72.97 8.91 1.51 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.456 2.104 . . . . 10.0 112.346 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -79.45 -8.47 59.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.132 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 63.7 mt -65.43 -40.24 93.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.242 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 53.93 -97.57 0.07 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.597 -0.728 . . . . 10.0 110.833 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 732' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 736' ' ' ARG . 0.2 OUTLIER -144.55 -57.63 0.36 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.21 -48.75 76.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.981 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 2.3 m -60.14 -33.1 71.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.154 0.502 . . . . 10.0 110.376 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.99 -43.57 98.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.733 -0.667 . . . . 10.0 109.483 178.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 736' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 732' ' ' GLU . 71.0 mtt-85 -65.07 -47.77 76.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.199 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -57.94 -39.91 79.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.474 -0.784 . . . . 10.0 111.335 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 27.9 mmm-85 -62.11 -40.27 95.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.854 0.359 . . . . 10.0 110.45 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 92.2 mt -67.61 -44.35 86.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.526 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 29.1 tp -66.35 -43.14 86.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.016 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.96 -42.7 94.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.803 0.335 . . . . 10.0 110.928 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -64.88 -40.61 95.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.317 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 2.3 p -66.38 -44.6 82.67 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.865 -0.334 . . . . 10.0 110.632 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.6 -38.87 83.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.05 -54.76 42.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.392 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.421 ' HA ' ' HD3' ' A' ' 749' ' ' ARG . 97.0 t -63.65 -34.12 65.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.987 0.423 . . . . 10.0 110.576 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -60.39 -49.95 75.54 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.36 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -65.16 -31.75 73.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.556 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 749' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 746' ' ' VAL . 65.9 mtp180 -67.2 -41.34 85.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.87 -0.605 . . . . 10.0 109.695 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -66.08 -39.97 90.48 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -59.09 -39.12 81.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.053 -0.976 . . . . 10.0 111.725 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.43 -21.25 65.26 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.457 0.54 . . . . 10.0 112.457 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.0 t -87.63 -27.93 5.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.883 0.373 . . . . 10.0 111.463 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 6.6 t -96.77 -42.12 11.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.033 0.444 . . . . 10.0 111.259 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 125.46 130.81 3.52 Favored Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 111.158 -0.777 . . . . 10.0 111.158 -179.076 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 756' ' ' ALA . . . . . 0.505 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -55.12 -47.12 75.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 10.0 111.707 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.13 -38.57 91.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.163 0.506 . . . . 10.0 110.663 -179.329 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.5 tpt -69.4 -42.31 75.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.839 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 76.8 mmm -61.12 -39.54 90.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.948 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.505 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.8 mmp_? -60.81 -39.95 90.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.266 0.555 . . . . 10.0 110.011 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 10.9 m-70 -71.11 -33.4 70.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.927 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -67.04 -46.85 73.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.687 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 79.5 mt-10 -59.6 -44.88 93.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.335 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -61.46 -41.08 96.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.173 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -66.81 -43.66 91.1 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.15 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 48.7 t -60.69 -41.45 88.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 120.678 0.275 . . . . 10.0 110.906 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 8.9 mtp -57.64 -49.12 77.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.254 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 60.4 mt -66.65 -40.41 88.67 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.235 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -53.21 -57.12 11.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.751 -0.659 . . . . 10.0 111.312 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 3.7 m -68.72 -35.78 77.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.346 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.26 -54.27 43.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.977 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -62.19 -37.58 85.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.298 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 49.6 m -65.75 -42.45 90.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.816 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 62.9 mt -77.41 -23.83 50.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.611 -0.268 . . . . 10.0 110.908 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -66.14 -51.06 61.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.645 -0.252 . . . . 10.0 110.658 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.441 ' HG3' ' N ' ' A' ' 777' ' ' GLU . 13.5 ptpt -62.45 -34.24 76.41 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.805 0.336 . . . . 10.0 110.324 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 777' ' ' GLU . . . . . 0.441 ' N ' ' HG3' ' A' ' 776' ' ' LYS . 0.9 OUTLIER -70.34 -39.92 74.4 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 178.845 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -60.65 -32.42 71.6 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.929 -0.578 . . . . 10.0 109.986 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 85.0 mt -65.69 -45.81 81.4 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -67.96 -42.4 80.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.125 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.77 -42.93 94.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.936 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 85.1 mmm -64.39 -38.27 90.45 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.024 0.44 . . . . 10.0 109.979 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.58 -40.77 93.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.066 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -64.84 -41.92 95.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.216 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.7 tp -71.59 -35.52 70.56 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.706 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -57.25 -39.36 75.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.145 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.754 179.841 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo . . . . . 0 C--O 1.232 0.22 0 N-CA-C 113.479 0.53 . . . . 10.0 113.479 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 800' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 804' ' ' LYS . 27.4 mtpt -74.28 -46.82 38.79 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.638 -0.504 . . . . 10.0 109.638 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -65.38 -37.94 88.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.538 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -66.33 -41.28 89.85 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -57.54 -44.16 84.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.491 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 804' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 800' ' ' LYS . 95.6 mttt -62.51 -47.24 84.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.857 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 39.3 ttp85 -61.03 -47.6 85.63 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.427 -0.351 . . . . 10.0 111.238 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.26 -47.25 86.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.467 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 8.3 p -65.77 -39.21 90.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.495 -0.321 . . . . 10.0 111.501 -179.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -65.05 -35.65 81.85 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.873 0.368 . . . . 10.0 110.272 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 19.4 m -68.56 -40.79 80.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.206 0.527 . . . . 10.0 109.754 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 13.4 ttm -62.69 -38.42 90.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.609 -0.723 . . . . 10.0 110.241 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -65.28 -44.11 89.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.666 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.78 -49.05 77.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.612 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -61.65 -34.91 76.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.693 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 32.9 ttp -64.59 -43.61 93.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.216 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 97.3 mt -65.97 -40.59 91.38 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.409 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 816' ' ' GLU . . . . . 0.42 ' HA ' ' HE2' ' A' ' 819' ' ' LYS . 37.9 mm-40 -62.94 -39.43 94.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.591 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 19.9 m -76.58 -27.2 55.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.508 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 36.7 tp -62.76 -57.11 12.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.729 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 819' ' ' LYS . . . . . 0.42 ' HE2' ' HA ' ' A' ' 816' ' ' GLU . 53.9 pttt -61.32 -30.06 70.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.478 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -61.73 -56.53 18.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.817 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.55 -31.3 71.29 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.587 -0.278 . . . . 10.0 111.498 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 822' ' ' VAL . . . . . 0.64 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 36.6 t -60.63 -56.95 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 39.5 mm -63.44 -37.28 79.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 121.073 0.463 . . . . 10.0 110.03 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 824' ' ' SER . . . . . 0.505 ' O ' ' HB2' ' A' ' 828' ' ' LYS . 29.4 t -59.78 -53.83 53.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.37 179.119 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 98.0 m -59.99 -38.69 83.33 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.557 -0.292 . . . . 10.0 111.727 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 826' ' ' LEU . . . . . 0.64 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 94.4 mt -62.03 -29.06 70.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.92 0.39 . . . . 10.0 111.423 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 1.7 m -97.0 -27.92 14.4 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.237 0.541 . . . . 10.0 110.095 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 828' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 824' ' ' SER . 2.0 ttpt -69.8 -19.63 63.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.127 -0.942 . . . . 10.0 111.415 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.8 p -53.2 130.09 14.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 CA-C-O 121.213 0.53 . . . . 10.0 111.183 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 36.3 mm-40 -86.0 113.66 22.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.728 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.816 -179.107 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.5 t80 . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 120.692 0.282 . . . . 10.0 110.7 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.66 163.65 10.68 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 111.569 -0.612 . . . . 10.0 111.569 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.72 117.64 5.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.789 0.328 . . . . 10.0 110.207 179.558 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -58.21 142.93 46.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.037 -0.528 . . . . 10.0 111.214 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 77.12 -63.16 0.38 Allowed 'General case' 0 N--CA 1.465 0.277 0 O-C-N 124.158 0.911 . . . . 10.0 111.595 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -69.29 -66.51 0.57 Allowed 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.215 0.82 . . . . 10.0 113.215 -177.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -72.57 -26.27 61.66 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -178.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 m -56.81 -45.09 82.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 10.0 111.366 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.3 mt -69.47 -28.81 66.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.398 -0.365 . . . . 10.0 111.731 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -71.71 -49.07 42.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.765 0.317 . . . . 10.0 110.549 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 20' ' ' ARG . 3.0 ttp85 -66.63 -37.04 84.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.406 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.594 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -64.12 -32.99 74.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.251 179.38 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.0 tpp180 -62.1 -36.17 80.92 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.645 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.9 -41.03 97.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.104 -0.498 . . . . 10.0 109.868 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 22.7 t -67.57 -36.79 77.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.999 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 21' ' ' MET . 70.2 t -59.49 -37.3 69.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.08 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -62.95 -43.1 99.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.894 -0.594 . . . . 10.0 109.944 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.4 mt -62.07 -47.12 94.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.268 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 60.5 mt -60.39 -35.9 65.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.804 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -69.38 -34.43 74.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.056 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.482 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -77.61 -26.56 50.74 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.062 0.458 . . . . 10.0 110.744 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 45.8 mtt -79.06 -10.5 59.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.136 -0.483 . . . . 10.0 111.263 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.47 ' CD ' ' HD3' ' A' ' 72' ' ' ARG . 5.8 mt-10 -57.79 -56.89 29.88 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 119.147 -0.454 . . . . 10.0 111.632 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.482 ' HD2' ' O ' ' A' ' 30' ' ' ALA . 50.7 Cg_exo -56.0 -32.31 85.56 Favored 'Trans proline' 0 C--N 1.36 1.141 0 C-N-CA 121.803 1.669 . . . . 10.0 112.022 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -67.05 -46.62 73.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.704 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 24.6 mmt -68.51 -35.6 77.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.823 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -63.13 -29.3 70.68 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.207 0.527 . . . . 10.0 110.253 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -74.34 -31.73 62.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.89 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.4 mp -74.83 136.95 41.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.962 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.6 p -78.55 175.93 9.89 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.894 -0.322 . . . . 10.0 110.497 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -55.64 -51.9 65.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.213 0.449 . . . . 10.0 112.213 -178.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -63.87 -29.6 70.77 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.069 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -67.93 -39.41 83.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.677 0.275 . . . . 10.0 110.308 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -66.04 -40.14 90.75 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -60.75 -38.85 86.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.17 -0.923 . . . . 10.0 109.815 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.01 -26.14 74.11 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.466 -0.788 . . . . 10.0 112.038 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -65.48 -38.78 90.78 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.049 -0.352 . . . . 10.0 110.049 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 17.1 m -62.76 -40.23 96.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.198 0.523 . . . . 10.0 109.75 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.77 -35.76 77.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.06 178.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -62.59 -41.91 99.24 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.077 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -62.96 -39.63 95.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.231 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -59.99 -46.62 88.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.052 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.68 -38.94 80.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.782 -0.644 . . . . 10.0 111.077 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -61.39 -47.61 85.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.97 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.2 mt -62.97 -35.0 78.71 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.146 0.498 . . . . 10.0 110.704 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.61 -42.63 95.41 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.485 -0.78 . . . . 10.0 111.138 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.483 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -83.98 -51.08 7.42 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.005 0.372 . . . . 10.0 112.005 -179.156 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 171.28 88.13 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.254 -0.975 . . . . 10.0 113.006 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -149.07 148.72 30.02 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.8 t -95.79 131.44 42.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.6 tp -58.77 -41.82 87.52 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.098 0.475 . . . . 10.0 110.636 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -69.46 -11.42 60.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.377 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -93.45 -20.04 20.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.282 0.563 . . . . 10.0 110.371 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 67.3 mt -82.2 -10.78 59.02 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.756 -0.657 . . . . 10.0 111.557 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.545 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 67.4 mt -46.9 -53.33 27.17 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.545 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.5 Cg_exo -54.11 -54.06 5.33 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.736 1.624 . . . . 10.0 113.067 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.431 ' O ' HG23 ' A' ' 70' ' ' VAL . 42.5 mt-10 -68.08 -43.67 78.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 10.0 112.108 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.524 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -62.18 -50.28 72.43 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.805 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -63.08 -33.0 74.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.772 -179.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.78 -45.4 86.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.484 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 66' ' ' GLU . 96.5 t -61.93 -46.68 95.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.134 -0.485 . . . . 10.0 110.211 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 67' ' ' ALA . 45.3 t -60.82 -45.77 97.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.208 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.47 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 5.3 ttm180 -59.45 -43.74 93.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.593 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 -62.88 -47.43 83.35 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.116 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.5 -30.33 71.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.849 -0.614 . . . . 10.0 111.124 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.9 m -61.78 -35.62 78.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.756 0.313 . . . . 10.0 111.185 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.494 ' O ' ' HA2' ' A' ' 80' ' ' GLY . 51.2 mtmt -76.41 -28.85 56.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.532 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -88.28 -43.81 11.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.352 -0.386 . . . . 10.0 111.931 -178.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 90.4 t -77.11 -62.81 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.828 0.347 . . . . 10.0 111.694 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -83.05 -41.6 18.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.384 -178.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLY . . . . . 0.494 ' HA2' ' O ' ' A' ' 76' ' ' LYS . . . 100.33 29.58 6.65 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.888 -0.672 . . . . 10.0 111.868 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 47.1 ttm -144.27 127.95 17.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.701 0.286 . . . . 10.0 110.39 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 29.4 ttp85 -71.48 126.23 29.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.202 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.38 117.46 3.84 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.803 -0.443 . . . . 10.0 109.803 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -57.06 147.16 25.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.315 0.578 . . . . 10.0 111.636 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -63.89 -32.52 74.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.198 -0.91 . . . . 10.0 111.79 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.67 -26.64 31.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.033 0.444 . . . . 10.0 110.728 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.52 HE22 HD23 ' A' ' 110' ' ' LEU . 92.9 mt-30 -74.14 -31.05 62.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.265 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.405 HD11 ' CZ ' ' A' ' 72' ' ' ARG . 92.8 mt -63.45 -37.65 88.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.153 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.0 mt -65.04 -49.53 69.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.426 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -64.51 -44.68 94.82 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.733 -0.667 . . . . 10.0 112.554 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.33 -31.23 80.17 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.082 -0.58 . . . . 10.0 112.566 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.594 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 16.3 ttm -70.14 -37.74 75.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.763 0.316 . . . . 10.0 110.69 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 91.8 t -72.87 -29.14 28.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.149 0.5 . . . . 10.0 110.198 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 mt -70.63 -5.57 30.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.715 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -80.41 -25.74 38.86 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.03 -0.729 . . . . 10.0 109.03 178.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -93.96 177.49 5.97 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.319 -0.855 . . . . 10.0 110.179 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.587 ' HG2' ' CD2' ' A' ' 407' ' ' LEU . 13.7 ttt85 -86.57 75.36 9.73 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.097 -0.501 . . . . 10.0 109.708 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 85.6 m -147.94 174.94 11.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.114 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.445 HD12 HG11 ' A' ' 211' ' ' VAL . 40.9 mm -112.72 134.39 55.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.619 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -112.36 119.73 39.28 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.869 0.366 . . . . 10.0 111.375 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -89.89 106.05 18.21 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.422 ' O ' ' HA2' ' A' ' 392' ' ' GLY . 35.4 ttm -103.3 151.47 22.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.095 0.474 . . . . 10.0 110.665 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.505 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 0.2 OUTLIER -85.52 149.68 25.21 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.758 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.78 107.28 5.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.982 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 133.66 -25.66 3.56 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.775 -0.726 . . . . 10.0 112.705 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.609 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 1.2 mm-40 -74.31 -21.17 59.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.818 0.342 . . . . 10.0 110.983 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.33 85.39 1.87 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.638 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.498 ' HD2' ' SD ' ' A' ' 390' ' ' MET . 8.4 mtmt -62.97 -65.88 0.62 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.925 0.393 . . . . 10.0 111.852 -179.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -60.09 -30.03 68.98 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.162 0.43 . . . . 10.0 112.162 -178.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.52 HD23 HE22 ' A' ' 87' ' ' GLN . 35.0 tp -68.01 -25.82 65.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.787 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 60.6 m -89.69 -28.95 19.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.008 0.432 . . . . 10.0 111.07 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.12 -11.46 49.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.976 -0.556 . . . . 10.0 112.492 -179.073 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 14.9 p -74.98 -23.73 58.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.797 0.332 . . . . 10.0 111.622 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 38.1 mt -68.24 -57.87 8.34 Favored Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -65.46 -26.64 54.93 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.888 1.725 . . . . 10.0 112.098 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -67.67 -48.44 66.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.822 -0.627 . . . . 10.0 110.784 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.426 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 55.2 t80 -60.85 -45.4 94.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.644 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 32.0 tp -59.87 -52.34 65.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.02 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -70.49 -20.62 62.84 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 111.971 0.36 . . . . 10.0 111.971 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.546 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -73.52 -27.59 61.45 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.497 -0.32 . . . . 10.0 110.743 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 69.3 mt -57.49 -35.5 70.29 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.985 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -20.84 66.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.71 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.41 25.76 75.19 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.926 -0.654 . . . . 10.0 112.677 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -96.41 -10.88 26.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.736 0.303 . . . . 10.0 110.932 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 94.3 112.66 2.41 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.728 -0.749 . . . . 10.0 113.343 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.5 t -88.21 113.57 25.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.428 -0.582 . . . . 10.0 109.428 178.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -89.52 100.4 13.2 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.971 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 29.8 t -91.59 114.44 28.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.975 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 54.8 t -97.69 118.49 44.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.508 -179.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.43 148.54 34.15 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.629 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.66 -31.55 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 112.191 0.441 . . . . 10.0 112.191 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -149.92 166.09 30.65 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.667 0.27 . . . . 10.0 110.801 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -72.64 -23.47 60.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.696 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -55.8 -54.56 43.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.691 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.3 mt -73.72 -35.87 65.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.564 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.64 -52.3 64.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.077 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -69.28 -39.47 78.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.601 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 138' ' ' ARG . 4.1 ttp85 -53.83 -55.64 24.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.134 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.93 -28.94 61.76 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.741 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.81 85.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.967 0.413 . . . . 10.0 110.783 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -90.54 -32.17 16.43 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.051 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -68.42 -42.62 78.68 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.933 0.397 . . . . 10.0 111.291 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -89.51 2.91 53.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.222 -0.444 . . . . 10.0 111.105 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.457 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 56.3 ttm-85 -63.62 -48.18 81.08 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.79 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' PRO . . . . . 0.457 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 16.3 Cg_exo -68.73 8.73 0.52 Allowed 'Trans proline' 0 C--N 1.361 1.216 0 C-N-CA 122.21 1.94 . . . . 10.0 112.618 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.7 tp -111.59 -57.84 2.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.138 -0.483 . . . . 10.0 109.863 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -71.11 -49.43 44.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.65 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.13 -13.51 62.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.23 0.538 . . . . 10.0 110.601 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -78.62 -39.81 36.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.901 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 92.4 mt -81.86 -37.75 26.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.405 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 139.26 29.15 0.22 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.075 -1.06 . . . . 10.0 113.277 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 88.8 mt -119.94 123.2 42.97 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.62 127.43 32.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.19 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.407 ' HB ' ' NH1' ' A' ' 144' ' ' ARG . 14.7 t -104.68 107.02 21.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.474 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -105.31 143.23 15.64 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.841 -0.695 . . . . 10.0 111.999 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.4 tp -117.02 123.71 72.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.051 0.453 . . . . 10.0 110.544 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -101.69 115.19 29.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.134 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 85.2 mt -103.99 144.86 29.54 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.035 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' PRO . . . . . 0.514 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 23.5 Cg_endo -62.06 112.52 1.55 Allowed 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.623 2.215 . . . . 10.0 111.937 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 96.99 8.7 56.7 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.874 -0.679 . . . . 10.0 112.434 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 43.3 ttm -68.31 135.93 91.18 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.428 -0.212 . . . . 10.0 110.428 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -50.45 144.29 24.97 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.799 2.333 . . . . 10.0 112.573 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' ALA . . . . . 0.441 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.46 -48.24 90.58 Favored Pre-proline 0 CA--C 1.54 0.573 0 N-CA-C 113.359 0.874 . . . . 10.0 113.359 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.441 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.4 Cg_exo -57.1 -33.36 95.65 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 121.789 1.659 . . . . 10.0 112.584 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.44 -38.99 48.29 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -59.61 -42.99 93.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.797 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -58.81 -32.9 69.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.437 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -75.72 -38.33 58.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.893 0.378 . . . . 10.0 110.417 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.27 -38.69 88.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.628 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -79.58 -24.28 42.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.194 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -75.24 -11.82 60.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.139 0.495 . . . . 10.0 110.285 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -72.69 173.33 9.18 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.471 -0.786 . . . . 10.0 110.28 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 173' ' ' ASP . . . . . 0.546 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 5.1 m-20 -77.36 -36.01 54.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.088 0.47 . . . . 10.0 109.826 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 76.1 mt -130.02 128.3 64.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.911 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 9.4 m -119.4 117.54 28.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.915 0.388 . . . . 10.0 111.527 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -94.29 133.06 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.638 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -167.61 164.68 38.12 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.126 -1.035 . . . . 10.0 113.131 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.56 150.11 28.33 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 122.275 0.23 . . . . 10.0 110.972 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -57.98 -41.07 82.2 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -51.81 66.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.506 -0.315 . . . . 10.0 111.261 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.514 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 4.4 tp10 -64.33 -36.96 85.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.954 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.28 -34.84 72.75 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.019 0.438 . . . . 10.0 110.543 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -77.66 -41.16 20.48 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 111.298 -0.721 . . . . 10.0 111.298 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -62.44 -39.47 93.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.339 . . . . 10.0 110.485 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -61.26 -41.78 97.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.579 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -64.16 -35.96 82.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.178 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 62.5 mt -68.95 -42.88 76.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.666 -0.697 . . . . 10.0 110.29 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 62.3 mtm-85 -67.04 -41.36 86.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.559 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.82 -39.92 90.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.758 -0.656 . . . . 10.0 110.731 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -83.86 7.97 16.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.694 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.98 5.27 13.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.909 0.385 . . . . 10.0 110.736 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -78.34 168.32 20.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.629 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -110.45 -24.29 10.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.208 0.528 . . . . 10.0 110.271 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.89 138.36 30.41 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.46 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 195' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 667' ' ' LEU . 16.1 Cg_endo -59.05 -23.31 68.2 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.628 2.218 . . . . 10.0 112.377 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -77.49 -7.07 55.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.246 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -94.36 0.2 55.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.8 0.333 . . . . 10.0 110.476 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 198' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 198' ' ' ARG . 43.6 mtt85 -62.88 158.84 18.04 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.151 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 16.7 m -134.8 -19.21 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.908 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -84.93 175.77 8.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.218 0.532 . . . . 10.0 111.654 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.43 -179.19 5.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.6 -0.727 . . . . 10.0 109.67 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -61.73 129.75 42.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.026 0.441 . . . . 10.0 111.05 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 203' ' ' LEU . . . . . 0.4 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . 22.3 mt -84.11 63.51 7.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.387 0.613 . . . . 10.0 110.154 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -80.3 -53.42 6.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.738 -0.665 . . . . 10.0 112.03 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -130.97 137.58 49.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.981 0.42 . . . . 10.0 111.416 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.588 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -133.13 121.3 22.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.416 -0.811 . . . . 10.0 109.703 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 57.7 tp -122.91 113.48 19.16 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 208' ' ' VAL . . . . . 0.468 HG22 ' H ' ' A' ' 210' ' ' GLU . 9.0 p -97.0 139.34 19.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.594 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.73 -27.61 62.15 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.591 -179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 210' ' ' GLU . . . . . 0.541 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 4.4 tp10 -145.76 134.09 21.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.113 0.482 . . . . 10.0 110.954 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.652 HG22 ' HB ' ' A' ' 391' ' ' THR . 3.4 m -102.37 -17.95 6.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.335 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 212' ' ' ASP . . . . . 0.401 ' OD1' ' HD2' ' A' ' 566' ' ' ARG . 3.8 t70 -60.04 -68.41 0.29 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.52 -0.764 . . . . 10.0 111.574 -179.411 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 213' ' ' SER . . . . . 0.433 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 0.8 OUTLIER -84.58 22.57 1.28 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.561 0.578 . . . . 10.0 112.561 -178.22 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 45.4 mt -138.05 -66.22 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 112.545 0.572 . . . . 10.0 112.545 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 27.0 mt -70.28 -46.05 65.12 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.495 0.554 . . . . 10.0 112.495 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 50.8 mm -85.51 -47.36 16.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.882 -0.327 . . . . 10.0 111.759 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 217' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 0.3 OUTLIER -69.98 -59.63 2.79 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -178.947 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -85.38 46.59 1.31 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.005 0.431 . . . . 10.0 111.78 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -76.51 -53.19 8.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.389 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 220' ' ' ARG . . . . . 0.458 ' O ' ' HD3' ' A' ' 220' ' ' ARG . 0.2 OUTLIER -105.85 46.68 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.227 0.537 . . . . 10.0 110.837 -179.08 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 2.9 m -107.55 102.44 44.52 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.583 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -88.83 132.44 2.41 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.802 2.335 . . . . 10.0 113.578 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 223' ' ' LEU . . . . . . . . . . . . . 96.7 mt -82.62 93.12 7.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.147 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 29.2 mt -92.74 125.8 45.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.051 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 2.6 mt . . . . . 0 C--N 1.326 -0.431 0 N-CA-C 109.416 -0.587 . . . . 10.0 109.416 179.655 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.705 0.288 . . . . 10.0 110.735 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 374' ' ' SER . . . . . . . . . . . . . 8.8 t -164.22 161.84 22.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.239 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.6 tt -157.73 148.46 9.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.38 . . . . 10.0 110.489 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.14 143.06 29.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.619 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -56.06 -50.64 70.4 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 123.126 0.266 . . . . 10.0 111.356 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -53.45 -47.64 69.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.101 -0.499 . . . . 10.0 111.402 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -67.18 -31.11 71.28 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.202 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -70.27 -41.42 73.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.509 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -72.78 -19.26 61.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.047 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 72.1 mtp180 -77.12 -5.85 50.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.735 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.417 HD21 HH22 ' A' ' 656' ' ' ARG . 47.1 mt -96.79 7.58 46.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.798 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 384' ' ' TYR . . . . . 0.588 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 21.2 m-85 -99.51 151.36 21.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.733 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -78.95 -76.36 0.2 Allowed 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 76.1 mttt -90.41 90.3 7.97 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.412 ' H ' ' HG3' ' A' ' 97' ' ' ARG . 57.7 tp -95.73 109.55 21.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.768 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -125.66 154.08 42.88 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.692 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -155.24 143.97 10.5 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.539 -0.839 . . . . 10.0 112.192 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 390' ' ' MET . . . . . 0.498 ' SD ' ' HD2' ' A' ' 108' ' ' LYS . 33.4 ttm -114.0 128.93 56.61 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 391' ' ' THR . . . . . 0.652 ' HB ' HG22 ' A' ' 211' ' ' VAL . 5.7 t -122.75 -175.35 3.14 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 121.147 -0.221 . . . . 10.0 110.574 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 392' ' ' GLY . . . . . 0.422 ' HA2' ' O ' ' A' ' 102' ' ' MET . . . -103.4 165.54 15.8 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 110.979 -0.848 . . . . 10.0 110.979 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 393' ' ' THR . . . . . 0.454 ' OG1' ' HA ' ' A' ' 103' ' ' ARG . 1.0 OUTLIER -62.17 103.46 0.38 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.845 0.355 . . . . 10.0 111.074 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -151.61 -27.97 0.18 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.471 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 18.2 t70 54.39 -118.93 1.38 Allowed 'General case' 0 CA--C 1.535 0.377 0 O-C-N 123.374 0.421 . . . . 10.0 110.318 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 4.7 m 64.74 -96.66 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -81.62 36.87 0.45 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.912 0.387 . . . . 10.0 111.452 -178.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -64.5 -20.14 66.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.081 0.467 . . . . 10.0 110.961 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -81.74 -24.73 35.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.128 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -65.44 -38.3 89.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.733 0.302 . . . . 10.0 110.983 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -57.97 -47.26 83.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.171 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 4.9 m -75.83 -9.19 58.4 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.503 0.557 . . . . 10.0 112.503 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.2 m -102.77 -53.24 2.9 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.01 0.374 . . . . 10.0 112.01 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 60.3 mt -82.58 -50.41 15.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 112.809 0.67 . . . . 10.0 112.809 -177.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -94.97 -8.82 35.82 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm 62.09 43.34 8.91 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.834 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 407' ' ' LEU . . . . . 0.587 ' CD2' ' HG2' ' A' ' 97' ' ' ARG . 14.6 mt -117.66 140.92 49.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.36 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -88.98 128.85 35.71 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 110.067 -0.345 . . . . 10.0 110.067 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 2.1 m -87.13 101.2 13.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.984 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 38.2 t -96.57 133.86 36.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.607 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 15.3 t -88.68 122.23 39.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.934 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 48.6 t -87.22 130.15 48.95 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.219 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.83 150.21 86.06 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.719 2.279 . . . . 10.0 112.336 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 17.4 p -79.83 157.73 26.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.881 -0.599 . . . . 10.0 111.426 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -66.75 -40.46 88.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.334 0.588 . . . . 10.0 109.708 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 69.5 mtm180 -125.49 153.47 72.51 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.764 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -63.46 117.93 4.87 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.368 2.045 . . . . 10.0 111.413 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 30.9 mtm -66.33 114.14 5.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.557 -179.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 419' ' ' ILE . . . . . 0.476 ' HB ' ' HA ' ' A' ' 581' ' ' ALA . 0.7 OUTLIER -96.37 41.89 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.317 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -81.37 101.11 9.61 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.441 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -76.98 100.16 5.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.482 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -80.03 131.51 35.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.797 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 40.2 mt -116.04 149.14 42.87 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -62.47 169.21 8.54 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 122.85 2.367 . . . . 10.0 113.712 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -86.54 116.12 24.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.374 -0.83 . . . . 10.0 109.857 179.281 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 426' ' ' LEU . 25.2 mt -92.28 88.22 6.37 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.181 0.515 . . . . 10.0 110.273 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 15.8 t -83.38 125.18 40.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.474 -0.785 . . . . 10.0 110.11 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 428' ' ' TYR . . . . . 0.53 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 10.2 m-85 -111.99 179.5 3.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.511 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 4.3 mmt -70.53 -75.86 0.11 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.909 0.385 . . . . 10.0 111.923 -178.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 41.1 p -90.58 165.62 13.65 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.71 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 431' ' ' GLU . . . . . 0.431 ' HG3' ' HE2' ' A' ' 434' ' ' LYS . 8.0 tt0 -67.32 -26.88 66.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.547 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -61.1 -44.5 97.26 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.031 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -63.21 -40.83 98.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.572 -0.74 . . . . 10.0 110.21 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 434' ' ' LYS . . . . . 0.484 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 39.7 ttpt -59.72 -50.54 73.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.468 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 435' ' ' ILE . . . . . 0.537 ' O ' HG12 ' A' ' 439' ' ' ILE . 48.5 mm -65.44 -43.7 94.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.859 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -39.69 89.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.746 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.87 -33.92 76.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.026 0.441 . . . . 10.0 110.441 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 438' ' ' ILE . . . . . 0.406 HG23 HG21 ' A' ' 557' ' ' ILE . 89.1 mt -66.23 -45.49 89.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.688 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 439' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 435' ' ' ILE . 33.5 mm -62.38 -36.38 74.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.348 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -64.04 -45.54 88.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.378 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -61.76 -40.77 96.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.469 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.434 HG12 HG11 ' A' ' 452' ' ' VAL . 78.7 mt -72.13 -38.03 61.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.901 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 14.2 tttm -53.01 -38.68 62.55 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.918 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 444' ' ' GLU . . . . . 0.503 ' O ' ' HE2' ' A' ' 448' ' ' LYS . 61.8 mm-40 -78.0 -45.05 24.83 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.918 0.39 . . . . 10.0 111.959 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 43.1 mtt-85 -68.14 -29.89 68.89 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 -177.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 1.6 p -68.69 -35.05 76.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.134 0.492 . . . . 10.0 110.268 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.97 -15.01 49.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.49 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 448' ' ' LYS . . . . . 0.503 ' HE2' ' O ' ' A' ' 444' ' ' GLU . 0.2 OUTLIER -90.46 -31.44 16.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.627 179.804 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 105.57 23.55 7.49 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.766 -0.731 . . . . 10.0 112.964 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 450' ' ' GLN . . . . . 0.44 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 64.3 tt0 -104.64 127.76 28.27 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.896 0.348 . . . . 10.0 110.887 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 451' ' ' PRO . . . . . 0.409 ' HB3' ' O ' ' A' ' 496' ' ' TYR . 38.2 Cg_endo -68.25 140.01 47.64 Favored 'Trans proline' 0 C--O 1.237 0.466 0 C-N-CA 122.625 2.217 . . . . 10.0 111.372 178.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 452' ' ' VAL . . . . . 0.434 HG11 HG12 ' A' ' 442' ' ' ILE . 77.4 t -125.28 130.78 72.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.086 0.47 . . . . 10.0 111.695 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 55.8 tp -114.66 106.61 14.44 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 40.9 t -92.73 117.82 36.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.508 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -96.89 127.75 9.31 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.597 -0.811 . . . . 10.0 111.738 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 10.1 p -120.61 137.0 54.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.589 0.233 . . . . 10.0 110.556 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 34.5 pt -93.6 -25.61 4.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.053 0.454 . . . . 10.0 110.486 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 4.0 p -115.62 133.54 55.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.102 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 20.5 mt -62.79 -32.84 57.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.256 0.55 . . . . 10.0 110.22 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.456 ' CD ' ' H ' ' A' ' 460' ' ' GLU . 1.9 mp0 -59.57 -35.03 73.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.606 -0.724 . . . . 10.0 110.577 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.91 -32.33 51.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.773 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.4 m -61.25 -42.55 98.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.049 0.452 . . . . 10.0 110.089 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -70.68 -35.45 72.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.179 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.64 -51.6 54.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.79 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 14.2 p -62.51 -35.44 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.71 0.29 . . . . 10.0 110.743 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 60.3 m -65.71 -39.74 91.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.574 -0.284 . . . . 10.0 110.407 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -58.46 -43.26 88.79 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.957 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -71.44 -35.42 70.92 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.64 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 47.5 mt -65.6 -44.22 87.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.553 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 3.1 m -67.8 -30.31 69.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.202 0.525 . . . . 10.0 109.886 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -66.1 -38.78 89.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.395 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -84.96 -3.09 58.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.986 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 72.83 36.24 57.91 Favored Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.88 -0.6 . . . . 10.0 112.483 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 88.5 mt -104.42 123.61 58.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 120.622 0.249 . . . . 10.0 110.67 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -64.21 139.37 58.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.403 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -159.8 145.04 15.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.918 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -117.17 125.47 51.25 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 478' ' ' VAL . . . . . 0.448 HG22 HD12 ' A' ' 502' ' ' ILE . 4.5 t -100.08 140.23 19.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.158 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 90.3 mt -94.02 151.61 19.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.101 -0.5 . . . . 10.0 109.752 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -161.71 130.12 4.29 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -58.18 -19.6 34.52 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -80.46 -6.83 58.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.938 0.399 . . . . 10.0 110.723 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 483' ' ' PHE . . . . . 0.435 ' O ' ' HG3' ' A' ' 487' ' ' GLU . 54.6 m-85 -131.07 45.96 2.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.45 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 9.2 m80 -51.32 -41.1 60.31 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.896 -179.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -63.64 -30.91 71.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.846 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -81.81 -38.12 26.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.918 0.39 . . . . 10.0 110.395 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 487' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 483' ' ' PHE . 53.8 mt-10 -55.6 -37.41 68.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.27 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -54.66 -41.48 70.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.592 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.26 -29.14 42.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.986 0.422 . . . . 10.0 111.092 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.1 mt -73.22 -53.3 18.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.308 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 68.6 t -60.48 -35.49 63.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.949 0.404 . . . . 10.0 111.239 -179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -64.08 -26.33 68.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.363 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -115.8 19.07 15.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.822 0.344 . . . . 10.0 110.888 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.74 -17.32 62.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.056 0.455 . . . . 10.0 111.045 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -93.89 8.65 73.5 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.851 -0.69 . . . . 10.0 112.086 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 496' ' ' TYR . . . . . 0.409 ' O ' ' HB3' ' A' ' 451' ' ' PRO . 61.7 t80 -68.72 138.55 90.76 Favored Pre-proline 0 C--N 1.325 -0.465 0 N-CA-C 110.271 -0.27 . . . . 10.0 110.271 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.84 128.13 29.16 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.642 2.228 . . . . 10.0 112.682 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.61 14.18 8.23 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.561 -0.745 . . . . 10.0 112.808 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.92 133.76 34.59 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.879 0.371 . . . . 10.0 110.351 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 25.9 t -111.62 113.45 44.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.375 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.9 m -111.79 134.17 53.53 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.502 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 502' ' ' ILE . . . . . 0.448 HD12 HG22 ' A' ' 478' ' ' VAL . 80.1 mt -111.63 117.62 55.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.787 0.327 . . . . 10.0 110.133 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -97.9 121.3 39.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.087 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 2.7 m -98.94 109.72 22.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.868 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 55.81 67.33 1.02 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.391 0.615 . . . . 10.0 111.002 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 38.6 tpp -76.3 128.57 35.15 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.699 -0.682 . . . . 10.0 111.136 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -76.68 179.75 5.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.789 -0.642 . . . . 10.0 111.448 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -68.59 160.82 51.44 Favored Glycine 0 CA--C 1.52 0.402 0 CA-C-N 116.029 -0.532 . . . . 10.0 113.357 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.541 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 99.1 mtt180 65.15 -82.72 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.54 0.736 . . . . 10.0 111.895 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 81.07 155.75 13.26 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.961 -0.638 . . . . 10.0 112.717 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.05 154.28 41.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.77 0.319 . . . . 10.0 111.009 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -75.66 109.9 9.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.367 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 45.9 mt -78.47 118.42 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.157 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 2.7 t -86.65 128.65 39.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.805 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 60.7 mt -74.05 133.31 42.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.33 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 83.78 15.72 69.76 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.274 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 95.43 -170.54 28.53 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.629 -0.796 . . . . 10.0 111.475 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 2.8 p -134.1 94.58 3.27 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.944 0.372 . . . . 10.0 110.896 -179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 519' ' ' TRP . . . . . 0.408 ' O ' HG22 ' A' ' 523' ' ' VAL . 21.9 p-90 -56.57 -30.07 62.75 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.826 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -61.25 -40.66 94.9 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.986 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.37 -24.55 39.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.972 0.415 . . . . 10.0 110.873 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -77.43 -46.87 21.27 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.98 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 523' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 519' ' ' TRP . 33.8 m -69.62 -26.41 30.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.861 0.362 . . . . 10.0 110.94 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -84.79 -5.61 59.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.432 . . . . 10.0 110.78 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -89.65 -9.73 48.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.481 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 11.2 mt -82.16 158.33 23.67 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.311 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.99 -28.87 32.39 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 178.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -146.75 92.35 5.07 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.461 -0.791 . . . . 10.0 109.759 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.5 92.48 1.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.449 2.1 . . . . 10.0 112.688 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -75.09 153.96 38.09 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.205 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -57.11 -35.68 69.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.979 0.419 . . . . 10.0 110.915 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -66.81 -43.95 82.46 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.15 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -69.12 -40.63 78.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.925 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.19 -44.08 94.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.32 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.55 -39.78 94.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.355 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -59.95 -53.37 58.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.736 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 94.0 mt -63.66 -39.1 84.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.74 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -61.97 -41.19 97.73 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.263 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.48 86.01 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.372 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 540' ' ' ASP . . . . . 0.593 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 40.7 m-20 -60.69 -46.21 91.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.777 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 541' ' ' TRP . . . . . 0.416 ' CZ2' ' HD2' ' A' ' 545' ' ' HIS . 70.6 t90 -58.58 -41.03 84.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.318 -0.856 . . . . 10.0 110.558 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -58.37 -43.54 88.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.622 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.84 -45.03 96.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.149 0.499 . . . . 10.0 110.019 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 544' ' ' ARG . . . . . 0.593 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 14.6 mtm180 -63.68 -38.96 93.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.547 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 545' ' ' HIS . . . . . 0.416 ' HD2' ' CZ2' ' A' ' 541' ' ' TRP . 6.3 t-80 -66.25 -39.41 89.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.094 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -66.24 -40.03 89.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.157 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -58.85 -43.44 90.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.876 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 548' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 544' ' ' ARG . 65.1 t -62.57 -35.89 72.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.79 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 549' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 545' ' ' HIS . 99.7 mt -64.33 -43.66 93.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.005 0.431 . . . . 10.0 110.225 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -71.14 -29.49 65.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.673 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 551' ' ' ALA . . . . . 0.44 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -70.02 -35.74 74.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.951 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 129.49 18.08 1.67 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.484 -0.865 . . . . 10.0 113.04 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 75.31 -169.94 54.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.828 -0.701 . . . . 10.0 112.55 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.433 ' HB3' ' OG ' ' A' ' 575' ' ' SER . 54.3 tp -75.5 126.08 30.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.928 0.394 . . . . 10.0 110.115 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -95.36 120.53 35.75 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.936 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 35.1 mm -98.04 128.3 49.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.596 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 557' ' ' ILE . . . . . 0.406 HG21 HG23 ' A' ' 438' ' ' ILE . 17.1 mt -119.34 125.75 74.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.384 . . . . 10.0 110.186 178.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -107.41 117.23 5.17 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.625 -0.798 . . . . 10.0 112.094 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 3.4 p -70.71 -48.12 56.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.539 0.685 . . . . 10.0 109.757 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.55 140.07 35.13 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.608 -1.178 . . . . 10.0 108.676 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 561' ' ' ARG . . . . . 0.512 ' HB2' HD22 ' A' ' 594' ' ' LEU . 77.8 mtt-85 -78.65 164.05 24.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.824 0.345 . . . . 10.0 110.18 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -86.98 153.26 21.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.198 -0.455 . . . . 10.0 109.839 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.89 -44.1 81.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.122 0.487 . . . . 10.0 110.026 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 58.7 m -99.53 142.23 31.28 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.488 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 565' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 565' ' ' ARG . 0.0 OUTLIER -68.84 -27.88 66.23 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.538 -179.555 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 566' ' ' ARG . . . . . 0.401 ' HD2' ' OD1' ' A' ' 212' ' ' ASP . 8.9 ttm180 -59.98 -51.22 70.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.107 0.479 . . . . 10.0 110.391 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 13.2 mt -72.59 -25.36 22.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.269 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -69.51 -50.62 43.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.069 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 17.1 m-20 -62.7 -37.67 87.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.03 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -58.86 -33.02 69.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.918 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.409 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 39.5 tp -78.49 -35.21 46.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.876 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -74.11 -30.43 62.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.898 0.38 . . . . 10.0 111.114 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.61 17.52 14.61 Favored Glycine 0 CA--C 1.521 0.426 0 C-N-CA 121.082 -0.58 . . . . 10.0 114.015 -178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 574' ' ' ARG . . . . . 0.409 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 1.2 mmt180 -72.17 -41.59 66.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 117.595 0.697 . . . . 10.0 110.557 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 575' ' ' SER . . . . . 0.433 ' OG ' ' HB3' ' A' ' 554' ' ' LEU . 19.4 t -87.61 161.27 17.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.475 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 73.43 36.32 55.01 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.147 -0.549 . . . . 10.0 112.794 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -61.61 130.44 45.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.442 0.163 . . . . 10.0 111.027 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 578' ' ' GLN . . . . . 0.609 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 17.5 tt0 64.03 19.7 11.87 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.635 0.584 . . . . 10.0 111.23 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 87.41 51.34 3.33 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.634 -0.793 . . . . 10.0 112.821 179.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -105.76 -168.83 1.5 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.847 -0.208 . . . . 10.0 110.484 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 581' ' ' ALA . . . . . 0.476 ' HA ' ' HB ' ' A' ' 419' ' ' ILE . . . -88.45 155.23 19.79 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.122 0.487 . . . . 10.0 111.72 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 173.72 177.47 42.95 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.734 -0.667 . . . . 10.0 111.612 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.9 p -153.87 134.43 13.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.823 0.312 . . . . 10.0 110.614 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.88 124.05 49.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.596 -0.274 . . . . 10.0 111.078 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 585' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 3.6 tpm_? -131.19 115.92 17.0 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.951 -0.389 . . . . 10.0 109.951 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -114.5 151.14 33.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.015 0.436 . . . . 10.0 111.285 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 587' ' ' TYR . . . . . 0.484 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 86.4 m-85 -132.54 169.25 16.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.378 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 10.8 tp -168.22 162.16 12.65 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.169 0.293 . . . . 10.0 110.24 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 589' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.8 OUTLIER -113.59 157.31 22.25 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.019 -0.363 . . . . 10.0 110.019 178.796 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 590' ' ' MET . . . . . 0.438 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 70.6 mmm -71.87 -14.21 61.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.162 0.506 . . . . 10.0 111.276 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -121.26 24.18 10.13 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.673 -0.694 . . . . 10.0 109.314 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 592' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 589' ' ' SER . 0.9 OUTLIER -74.14 169.04 18.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.194 -0.912 . . . . 10.0 111.373 -179.099 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -69.18 -34.46 74.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 594' ' ' LEU . . . . . 0.615 ' O ' HG12 ' A' ' 597' ' ' ILE . 10.8 tp -69.87 -21.64 63.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.236 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 3.5 mmt -75.59 -5.86 47.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.097 0.475 . . . . 10.0 110.832 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -93.27 -11.08 33.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.461 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 597' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 594' ' ' LEU . 19.0 pt -74.53 -8.79 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 121.138 0.495 . . . . 10.0 110.539 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -79.19 -10.15 59.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.522 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 72.88 -53.86 0.7 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.923 0.764 . . . . 10.0 111.512 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 31.1 t -89.58 134.84 33.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.498 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -85.01 -4.3 59.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.151 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.66 -33.93 75.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.327 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 21.4 t -65.39 -50.81 70.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.216 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 604' ' ' SER . . . . . 0.497 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 0.2 OUTLIER -63.42 -38.96 93.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.848 179.946 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -68.5 -30.37 73.14 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.822 -0.704 . . . . 10.0 112.639 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 41.0 tpp -81.42 -38.35 26.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.712 0.291 . . . . 10.0 111.27 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 46.9 mtt -66.63 -16.85 64.49 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.545 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 608' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 604' ' ' SER . 33.6 mtt180 -68.45 -15.58 63.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.896 0.379 . . . . 10.0 110.936 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -87.04 23.44 1.77 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.277 -0.42 . . . . 10.0 111.2 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 49.0 tp -93.08 -14.58 27.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.076 0.465 . . . . 10.0 110.589 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 611' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 92.13 -48.88 2.71 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.992 -0.623 . . . . 10.0 111.919 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 612' ' ' MET . . . . . 0.438 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.0 OUTLIER 73.55 -55.01 0.68 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.647 0.779 . . . . 10.0 112.01 179.057 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 15.3 mmtp 59.35 80.74 0.26 Allowed Pre-proline 0 N--CA 1.464 0.273 0 O-C-N 123.475 0.484 . . . . 10.0 111.847 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 614' ' ' PRO . . . . . 0.53 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 21.4 Cg_endo -62.9 95.29 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.629 2.22 . . . . 10.0 112.103 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 140.16 -24.2 2.69 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.21 -0.904 . . . . 10.0 111.03 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -114.38 113.56 24.69 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.73 -0.47 . . . . 10.0 109.73 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -66.32 110.4 3.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.827 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 4.5 tp -67.99 -30.4 48.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.734 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 43.55 74.85 0.11 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.615 0.766 . . . . 10.0 112.643 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -120.44 99.53 47.88 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.66 -26.43 72.71 Favored 'Trans proline' 0 N--CA 1.475 0.403 0 C-N-CA 123.494 2.796 . . . . 10.0 114.584 -178.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 43.3 p-90 -63.06 -24.72 68.04 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.837 -0.345 . . . . 10.0 111.523 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 65.9 t -63.2 -45.83 97.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-O 120.996 0.427 . . . . 10.0 110.115 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 51.6 m -62.08 -36.18 80.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.484 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -67.85 -38.27 82.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.289 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -64.68 -45.71 85.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.836 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 98.6 mt -65.46 -37.57 80.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.136 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -57.92 -41.01 81.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.002 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -70.75 -38.94 73.52 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.895 -0.409 . . . . 10.0 109.895 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.41 89.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.343 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -63.12 -42.24 99.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.076 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -61.9 -32.45 72.83 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.159 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 633' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 637' ' ' ARG . 43.1 mttm -63.75 -37.54 87.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.425 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 40.0 t -61.83 -47.81 91.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.417 ' H ' ' HG2' ' A' ' 635' ' ' GLU . 0.8 OUTLIER -61.99 -40.84 97.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.721 179.254 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 28.3 m -61.56 -35.3 77.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.349 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 637' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 633' ' ' LYS . 72.4 mtt180 -67.22 -48.71 67.03 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -60.46 -42.49 96.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.512 -0.767 . . . . 10.0 110.445 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -56.21 -44.32 79.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.745 -0.662 . . . . 10.0 110.762 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.6 -42.67 99.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.298 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 71.3 mt -58.77 -53.41 47.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.231 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 642' ' ' ARG . . . . . 0.471 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 0.0 OUTLIER -69.02 -27.92 66.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.643 0.259 . . . . 10.0 110.711 -179.792 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -66.78 -38.4 86.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.259 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -68.07 -32.01 72.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.033 0.444 . . . . 10.0 110.141 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 95.5 mt -71.53 -26.29 62.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.384 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 646' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 89.2 mt -62.69 -32.85 74.01 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.383 179.473 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -64.48 -13.53 52.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.855 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -107.3 -46.22 3.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.115 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -73.3 -29.28 62.6 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 -177.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -64.87 -34.78 79.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.038 0.447 . . . . 10.0 109.835 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 651' ' ' VAL . . . . . 0.402 HG21 ' HG2' ' A' ' 804' ' ' LYS . 16.7 t -65.02 -43.07 96.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.738 -0.665 . . . . 10.0 109.917 179.095 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -64.06 -39.8 94.88 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.025 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -61.15 -43.57 98.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.174 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -61.32 -51.44 68.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.418 -0.81 . . . . 10.0 110.968 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -61.92 -42.89 99.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.797 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 656' ' ' ARG . . . . . 0.417 HH22 HD21 ' A' ' 383' ' ' LEU . 2.6 ttp-105 -62.5 -36.12 81.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.325 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -63.9 -48.3 77.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.632 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.53 -50.22 68.19 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.851 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 659' ' ' ILE . . . . . 0.418 HG23 ' HD1' ' A' ' 660' ' ' TYR . 9.1 tp -66.48 -35.99 76.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 111.901 0.334 . . . . 10.0 111.901 -178.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 660' ' ' TYR . . . . . 0.418 ' HD1' HG23 ' A' ' 659' ' ' ILE . 2.9 m-30 -70.6 -35.62 73.09 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 9.9 t -62.23 -50.66 70.87 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -57.3 -43.59 83.34 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.431 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 38.7 ttt-85 -63.05 -41.84 99.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.613 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -65.82 -43.11 89.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.606 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 665' ' ' GLU . . . . . 0.403 ' O ' HG22 ' A' ' 669' ' ' VAL . 28.1 mt-10 -58.45 -50.1 74.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.245 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 26.8 mt -70.02 -16.12 63.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.171 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.406 ' O ' ' HD3' ' A' ' 195' ' ' PRO . 12.1 tp -83.8 -46.04 12.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.662 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -68.73 -41.98 78.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.855 -0.611 . . . . 10.0 112.161 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 665' ' ' GLU . 27.0 m -74.86 150.93 6.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.038 0.447 . . . . 10.0 111.191 -179.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 1.5 m -94.29 -42.21 9.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.451 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -84.32 126.26 33.03 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.564 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 672' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 676' ' ' ILE . 5.6 p -127.49 -0.68 3.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.004 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 673' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 677' ' ' ASN . 0.8 OUTLIER -52.65 -45.51 66.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.348 -0.842 . . . . 10.0 112.364 -178.66 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -62.34 -46.25 89.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.591 0.234 . . . . 10.0 111.586 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 675' ' ' THR . . . . . 0.466 ' O ' HG12 ' A' ' 679' ' ' ILE . 3.9 m -63.57 -46.84 84.05 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.767 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 676' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 672' ' ' VAL . 36.4 mm -65.27 -37.96 81.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.99 0.424 . . . . 10.0 110.856 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 677' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 673' ' ' SER . 5.5 t30 -68.53 -40.23 80.83 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.58 -0.282 . . . . 10.0 111.316 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 29.0 m -62.77 -42.27 99.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.748 0.308 . . . . 10.0 111.142 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 679' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 675' ' ' THR . 27.1 pt -77.44 -21.04 14.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.677 -0.409 . . . . 10.0 110.844 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 680' ' ' ARG . . . . . 0.562 ' HG3' HD12 ' A' ' 823' ' ' ILE . 10.7 mtm-85 -59.53 -46.37 89.05 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.04 0.448 . . . . 10.0 110.144 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -65.81 -44.59 85.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.565 -0.743 . . . . 10.0 110.931 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -62.62 -47.4 83.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.245 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 41.2 t -61.18 -44.95 99.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.767 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -62.74 -42.36 99.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.655 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 54.8 tttm -63.25 -48.32 78.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.559 -0.292 . . . . 10.0 110.325 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.85 -40.6 84.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.209 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 30.0 m -64.72 -43.33 93.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.195 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.68 -39.92 84.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.353 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -61.85 -18.17 59.1 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.254 -0.43 . . . . 10.0 112.143 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -79.26 -14.2 59.18 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.852 0.358 . . . . 10.0 111.495 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -127.14 -24.54 3.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.958 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 692' ' ' ILE . . . . . 0.549 HG23 ' CD1' ' A' ' 701' ' ' TRP . 69.4 mt -129.72 101.03 18.81 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.579 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 693' ' ' PRO . . . . . 0.409 ' HA ' ' HD3' ' A' ' 694' ' ' PRO . 23.4 Cg_exo -64.12 140.39 71.45 Favored 'Trans proline' 0 N--CA 1.464 -0.233 0 C-N-CA 122.518 2.145 . . . . 10.0 111.494 179.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 694' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 693' ' ' PRO . 59.3 Cg_exo -52.28 113.8 1.37 Allowed 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.897 2.398 . . . . 10.0 112.823 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 56.71 67.77 0.95 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.391 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 6.0 p -118.9 -172.32 2.27 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.914 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 35.9 mt -83.5 154.89 23.64 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.769 -0.456 . . . . 10.0 109.769 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -57.71 -34.32 69.34 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 120.937 0.399 . . . . 10.0 111.69 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -74.34 -6.3 47.29 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.288 -0.414 . . . . 10.0 111.882 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.22 8.75 40.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.839 0.352 . . . . 10.0 110.234 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 701' ' ' TRP . . . . . 0.549 ' CD1' HG23 ' A' ' 692' ' ' ILE . 48.4 m0 -101.43 108.13 19.64 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.966 -179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -83.72 82.78 8.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.364 0.602 . . . . 10.0 109.414 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 703' ' ' ILE . . . . . 0.511 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 43.0 mm -60.86 -50.22 85.95 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.201 -0.909 . . . . 10.0 111.956 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 704' ' ' PRO . . . . . 0.511 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 47.7 Cg_exo -56.27 -47.45 24.28 Favored 'Trans proline' 0 C--N 1.36 1.138 0 C-N-CA 122.052 1.834 . . . . 10.0 112.561 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -60.67 -40.67 98.3 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.448 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 61.1 tp -70.47 -45.89 64.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.389 0.138 . . . . 10.0 111.006 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -59.19 -51.23 70.87 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.357 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -59.71 -35.72 75.08 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.826 0.346 . . . . 10.0 110.771 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 709' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 709' ' ' ARG . 2.3 tpt180 -65.5 -45.92 81.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.277 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 79.5 mt -64.87 -38.19 90.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.135 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.88 -36.22 72.69 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.695 0.628 . . . . 10.0 112.695 -179.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -92.68 -44.48 8.54 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -177.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 713' ' ' ASP . . . . . 0.675 ' O ' ' HE3' ' A' ' 828' ' ' LYS . 0.8 OUTLIER -89.27 -31.51 17.83 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 -177.547 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -106.15 -4.22 20.55 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.057 -0.657 . . . . 10.0 112.079 -178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 25.6 t70 57.67 28.72 16.19 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.326 0.584 . . . . 10.0 110.526 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 43.8 tp -118.96 129.79 55.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.09 -0.505 . . . . 10.0 111.662 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -97.68 128.13 44.14 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.492 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.435 HD21 ' HG2' ' A' ' 742' ' ' GLN . 11.8 mt -140.0 122.11 9.87 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 120.782 0.325 . . . . 10.0 111.695 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -81.81 60.86 7.72 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.859 2.373 . . . . 10.0 111.675 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 52.8 mt -63.48 -42.63 96.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.383 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -67.04 -31.67 72.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.207 0.527 . . . . 10.0 110.474 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -88.7 6.86 36.55 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.905 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -106.11 -54.1 2.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.857 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 77.8 mt -63.68 -23.45 67.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.756 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 725' ' ' ASP . . . . . 0.477 ' OD1' ' HG3' ' A' ' 726' ' ' LYS . 0.0 OUTLIER -78.59 -11.79 59.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.942 -179.76 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 726' ' ' LYS . . . . . 0.477 ' HG3' ' OD1' ' A' ' 725' ' ' ASP . 50.6 mttp -111.71 -48.63 3.05 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.01 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -120.64 94.71 48.93 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.26 0.553 . . . . 10.0 110.817 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.27 -3.62 14.11 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.456 2.104 . . . . 10.0 111.851 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.44 -12.31 61.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.012 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 730' ' ' LEU . . . . . 0.508 HD21 ' NH1' ' A' ' 738' ' ' ARG . 32.2 mt -66.48 -34.69 78.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.154 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 53.42 -104.09 0.19 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.142 -0.936 . . . . 10.0 111.318 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.16 -56.34 0.86 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.05 -179.104 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -58.0 -54.41 47.25 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.513 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.28 -31.27 71.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.114 0.483 . . . . 10.0 110.539 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 39.9 tp -65.69 -46.76 77.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.802 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 22.8 mtt180 -63.49 -36.33 83.4 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.966 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -60.37 -45.2 94.34 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.404 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 738' ' ' ARG . . . . . 0.508 ' NH1' HD21 ' A' ' 730' ' ' LEU . 16.7 mmm-85 -63.35 -41.71 98.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.513 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 90.7 mt -62.53 -51.84 67.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.694 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 740' ' ' LEU . . . . . 0.42 ' O ' HG13 ' A' ' 744' ' ' ILE . 36.4 tp -62.08 -44.37 96.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.418 -179.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -61.01 -41.23 96.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.745 0.307 . . . . 10.0 111.407 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 742' ' ' GLN . . . . . 0.435 ' HG2' HD21 ' A' ' 718' ' ' LEU . 23.8 tp60 -60.59 -42.98 97.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.187 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -39.82 95.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.965 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 744' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 740' ' ' LEU . 75.3 mt -62.45 -44.01 98.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.765 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -46.5 87.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.24 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 88.3 t -65.53 -40.2 87.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.126 0.488 . . . . 10.0 110.155 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -59.69 -43.39 94.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.78 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 748' ' ' GLN . . . . . 0.494 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 90.1 mt-30 -59.1 -44.2 91.94 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.02 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.45 -39.94 89.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.475 -0.329 . . . . 10.0 110.77 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -68.36 -34.92 76.93 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.975 0.417 . . . . 10.0 109.879 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -72.42 -39.38 67.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.07 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 752' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 45.9 mt-10 -53.39 -39.83 64.56 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.433 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 13.3 t -75.17 -30.93 23.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.315 -0.402 . . . . 10.0 112.003 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 50.5 t -85.42 -46.52 17.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.245 0.545 . . . . 10.0 111.098 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.03 132.11 3.94 Favored Glycine 0 N--CA 1.441 -0.995 0 N-CA-C 110.404 -1.078 . . . . 10.0 110.404 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 756' ' ' ALA . . . . . 0.617 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -56.84 -51.81 67.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 117.001 0.4 . . . . 10.0 111.646 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 757' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' A' ' 757' ' ' GLU . 11.2 mp0 -59.15 -39.27 81.89 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.076 -0.511 . . . . 10.0 111.132 -179.061 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 16.1 tpt -73.56 -38.68 65.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.725 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 7.8 tpt -60.59 -36.49 78.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.794 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.617 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -61.81 -37.54 84.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.33 0.586 . . . . 10.0 109.491 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -71.07 -34.48 71.22 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.527 -0.761 . . . . 10.0 109.414 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -68.1 -51.61 44.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.272 -0.876 . . . . 10.0 110.304 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -56.84 -44.48 82.14 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.933 0.397 . . . . 10.0 110.145 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 43.6 tttp -60.44 -50.41 73.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.343 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.27 -42.23 99.72 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.494 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 766' ' ' VAL . . . . . 0.405 ' HA ' ' HG2' ' A' ' 769' ' ' GLN . 44.7 t -62.49 -49.19 84.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.424 0.154 . . . . 10.0 110.588 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 18.7 ttt -59.56 -43.3 93.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.657 0.265 . . . . 10.0 110.877 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 84.4 mt -64.28 -51.78 61.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.604 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 769' ' ' GLN . . . . . 0.418 ' HG3' ' N ' ' A' ' 770' ' ' THR . 13.9 pt20 -63.43 -37.29 86.71 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.796 0.295 . . . . 10.0 111.796 -178.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 770' ' ' THR . . . . . 0.418 ' N ' ' HG3' ' A' ' 769' ' ' GLN . 12.6 m -68.39 -34.84 76.76 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.665 -0.495 . . . . 10.0 109.665 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.8 tt -62.14 -50.05 73.4 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.84 -34.05 75.27 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.034 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 773' ' ' SER . . . . . 0.417 ' HA ' ' NZ ' ' A' ' 776' ' ' LYS . 72.7 m -61.63 -52.87 62.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.467 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 16.9 mt -78.02 -22.74 48.8 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.887 -0.325 . . . . 10.0 111.675 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 31.1 t-105 -63.94 -50.37 68.9 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.952 -0.299 . . . . 10.0 110.821 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.417 ' NZ ' ' HA ' ' A' ' 773' ' ' SER . 10.9 ptpp? -62.25 -35.25 78.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.919 0.39 . . . . 10.0 110.434 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -67.28 -41.66 85.11 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 73.5 t60 -61.74 -38.16 86.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.002 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 63.6 mt -66.0 -49.02 69.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.117 179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -61.52 -45.25 95.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.543 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.32 94.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.997 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 37.9 ttm -64.39 -42.86 95.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.766 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 783' ' ' ASP . . . . . 0.466 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 38.5 t70 -64.88 -41.13 95.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.209 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -62.97 -35.35 79.86 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.681 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 13.7 tp -78.37 -35.45 47.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.809 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -59.07 -38.04 78.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.597 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 787' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 C-N-CA 120.998 -0.281 . . . . 10.0 111.157 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo . . . . . 0 CA--C 1.529 0.231 0 N-CA-C 113.535 0.552 . . . . 10.0 113.535 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 800' ' ' LYS . . . . . 0.45 ' HB2' ' NZ ' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -91.0 -48.42 6.99 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.89 -0.324 . . . . 10.0 110.65 -179.674 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 -63.55 -38.88 92.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.219 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -65.11 -40.23 94.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.065 0.46 . . . . 10.0 109.922 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -60.56 -42.52 96.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.06 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 804' ' ' LYS . . . . . 0.402 ' HG2' HG21 ' A' ' 651' ' ' VAL . 88.0 mttt -65.98 -39.72 90.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.571 -0.74 . . . . 10.0 110.601 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 805' ' ' ARG . . . . . 0.42 HH11 ' HG2' ' A' ' 805' ' ' ARG . 41.3 ttp85 -61.34 -45.31 94.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.015 0.436 . . . . 10.0 110.431 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -65.66 -46.97 77.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.279 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 3.5 p -64.59 -37.54 87.92 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.608 -0.269 . . . . 10.0 111.652 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -64.74 -45.79 84.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.757 0.313 . . . . 10.0 110.2 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 13.2 m -64.82 -42.29 95.09 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.01 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 38.5 ttm -60.84 -37.29 81.56 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.866 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -70.23 -41.45 73.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.442 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.21 -50.05 74.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.669 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.41 -33.83 75.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.387 179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 11.6 ttt -63.82 -47.83 79.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.515 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 91.2 mt -62.46 -41.45 98.76 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.929 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -63.09 -44.25 96.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.848 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 12.1 m -73.46 -29.82 62.78 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.896 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 55.0 tp -62.56 -56.79 14.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.976 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 819' ' ' LYS . . . . . 0.406 ' O ' HG12 ' A' ' 823' ' ' ILE . 43.5 pttt -62.24 -28.87 70.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.674 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -62.35 -67.05 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.32 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 821' ' ' GLU . . . . . 0.528 ' HA ' ' OG ' ' A' ' 824' ' ' SER . 1.3 mm-40 -61.43 -28.61 69.39 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 -178.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 5.6 t -60.23 -41.05 85.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 178.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 823' ' ' ILE . . . . . 0.562 HD12 ' HG3' ' A' ' 680' ' ' ARG . 22.4 mm -76.56 -46.49 31.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.251 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 824' ' ' SER . . . . . 0.528 ' OG ' ' HA ' ' A' ' 821' ' ' GLU . 0.1 OUTLIER -63.47 -42.25 98.59 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 121.029 -0.268 . . . . 10.0 111.372 -179.42 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 97.5 m -59.42 -39.56 83.9 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.7 0.286 . . . . 10.0 111.194 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 76.3 mt -67.73 -17.97 64.74 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.099 0.476 . . . . 10.0 110.612 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 3.9 m -100.77 -29.52 12.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.157 179.278 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 828' ' ' LYS . . . . . 0.675 ' HE3' ' O ' ' A' ' 713' ' ' ASP . 77.7 mttt -70.1 -16.22 63.09 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.276 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.2 p -59.75 131.45 24.35 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.334 0.587 . . . . 10.0 111.055 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -97.88 96.9 8.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.823 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.636 179.68 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 86.9 t80 . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 121.003 0.43 . . . . 10.0 111.173 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.99 173.33 12.95 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.886 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.31 129.28 40.47 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.138 -0.319 . . . . 10.0 110.138 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.3 mmt180 -61.85 139.52 58.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.897 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 29.9 m-20 72.35 -19.16 0.3 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.057 0.943 . . . . 10.0 112.046 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -102.9 -64.85 1.04 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.825 0.345 . . . . 10.0 111.586 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -70.07 -27.73 64.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.441 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.7 p -55.67 -62.44 1.69 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.765 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.8 mt -62.69 -36.59 83.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.523 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.0 ttp-105 -63.87 -48.84 75.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.576 -0.283 . . . . 10.0 110.914 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.416 ' O ' HG23 ' A' ' 24' ' ' VAL . 26.2 mtp180 -65.85 -38.12 88.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.922 0.391 . . . . 10.0 110.042 179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.406 ' O ' HG23 ' A' ' 25' ' ' VAL . 41.8 mtt -62.29 -41.64 98.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.431 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HD3' ' O ' ' A' ' 22' ' ' ARG . 15.5 tpp180 -61.75 -36.52 81.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.308 -0.406 . . . . 10.0 109.91 179.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -63.76 -37.64 88.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.205 -0.452 . . . . 10.0 109.899 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 20' ' ' ARG . 44.5 t -72.79 -37.35 54.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.849 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.507 HG13 HD12 ' A' ' 88' ' ' LEU . 36.3 t -57.84 -36.13 54.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.663 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -59.9 -40.27 88.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.182 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.1 mt -66.04 -41.88 90.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.912 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.97 -37.61 78.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.414 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -66.56 -25.21 66.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.018 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -93.17 -17.58 23.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.983 0.421 . . . . 10.0 111.073 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 18.3 mtt -88.02 -25.51 23.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.022 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.491 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 20.2 tt0 -56.78 -49.7 92.27 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 116.166 -0.47 . . . . 10.0 112.01 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 51.2 Cg_exo -55.53 -28.96 67.28 Favored 'Trans proline' 0 C--N 1.363 1.323 0 C-N-CA 122.138 1.892 . . . . 10.0 112.474 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.66 -40.78 66.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.995 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 23.6 mmt -67.59 -29.86 69.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.483 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 23.0 mt-10 -62.89 -32.15 73.35 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.224 0.535 . . . . 10.0 110.251 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -78.13 -24.8 47.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.112 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.9 mp -72.86 142.28 47.95 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.251 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 p -75.56 172.02 13.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.712 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -58.35 -43.71 88.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.101 0.477 . . . . 10.0 110.689 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -67.93 -34.54 76.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.245 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.94 -36.05 82.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.547 -0.297 . . . . 10.0 110.822 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.4 mt -61.55 -46.62 89.15 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.04 -0.726 . . . . 10.0 109.04 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -65.69 -35.7 81.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.289 -0.869 . . . . 10.0 109.643 178.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.76 -36.7 92.32 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.622 -0.717 . . . . 10.0 111.311 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -67.18 -39.29 86.39 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.491 -0.559 . . . . 10.0 109.491 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.7 m -60.73 -45.97 92.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.738 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.48 -35.16 79.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.803 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -62.22 -42.43 99.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.311 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -59.64 -40.21 86.89 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.3 -0.409 . . . . 10.0 109.982 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.7 tpp180 -62.68 -43.31 99.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.767 -0.652 . . . . 10.0 109.955 179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.536 ' O ' ' HG2' ' A' ' 56' ' ' LYS . . . -67.84 -42.09 81.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.633 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 55.8 mtp180 -61.57 -40.0 93.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.74 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 33.2 mt -62.92 -34.17 76.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.168 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.59 -34.87 76.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.158 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 56.0 mmtt -76.9 -43.88 33.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.077 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 145.77 78.3 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.725 -0.75 . . . . 10.0 112.335 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -130.62 144.94 51.77 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.647 -0.501 . . . . 10.0 109.647 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.5 t -85.75 131.52 34.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.441 HD11 ' O ' ' A' ' 118' ' ' LEU . 15.5 tp -56.17 -42.38 76.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.036 0.446 . . . . 10.0 111.038 -179.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -66.75 -16.22 64.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.537 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -88.4 -14.88 36.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.042 0.448 . . . . 10.0 110.536 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.4 mt -87.49 -9.93 53.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.4 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.522 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 76.4 mt -47.3 -53.29 29.75 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 113.399 0.888 . . . . 10.0 113.399 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.522 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 52.1 Cg_exo -54.37 -56.82 2.18 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.905 1.737 . . . . 10.0 113.199 -179.182 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -65.06 -43.41 92.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.89 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.72 80.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.569 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -65.25 -34.0 77.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.851 -179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.04 -44.66 83.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.451 -0.341 . . . . 10.0 110.562 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.7 t -62.54 -48.6 87.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.436 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 71.4 t -61.9 -39.74 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.502 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.477 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 5.4 ttt180 -58.46 -46.13 87.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.454 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -68.9 -42.77 76.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.628 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.34 -36.79 76.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.489 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.9 m -63.19 -34.06 76.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.708 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.405 ' O ' ' HA2' ' A' ' 80' ' ' GLY . 11.2 mtmm -70.47 -30.5 67.33 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.732 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -89.47 -38.8 13.79 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 48.9 t -81.47 -64.54 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.793 0.33 . . . . 10.0 111.632 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -82.07 -33.28 29.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.739 0.304 . . . . 10.0 111.816 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLY . . . . . 0.405 ' HA2' ' O ' ' A' ' 76' ' ' LYS . . . 91.89 13.73 57.45 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.582 -0.818 . . . . 10.0 111.392 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 59.0 ttm -125.02 127.5 47.08 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.697 0.284 . . . . 10.0 110.267 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -78.63 131.73 36.8 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.241 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.91 117.38 4.97 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 179.351 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -58.82 154.89 14.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.194 0.521 . . . . 10.0 112.005 -178.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -43.05 94.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.285 -0.87 . . . . 10.0 111.275 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 m -65.77 -29.02 45.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.143 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -67.22 -34.16 76.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.076 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.507 HD12 HG13 ' A' ' 25' ' ' VAL . 68.2 mt -64.15 -37.13 86.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.705 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 53.2 mt -65.31 -49.99 67.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.732 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.94 -36.71 93.24 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.49 -0.777 . . . . 10.0 112.325 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.64 -33.46 86.72 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.134 -0.555 . . . . 10.0 112.308 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.485 ' HG3' ' O ' ' A' ' 88' ' ' LEU . 56.1 mtt -74.07 -36.72 64.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.967 0.413 . . . . 10.0 110.146 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 95.9 t -64.35 -35.57 74.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.34 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 94.2 mt -77.39 -0.8 27.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.643 -0.708 . . . . 10.0 112.195 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -83.84 -32.27 25.35 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.267 0.556 . . . . 10.0 109.924 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -98.22 -178.93 4.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.274 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.46 ' HG2' HD23 ' A' ' 407' ' ' LEU . 21.9 ttt85 -80.5 71.73 7.36 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.469 ' SG ' ' HB3' ' A' ' 408' ' ' ASP . 14.6 m -141.32 162.93 34.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.432 -178.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.685 HD12 HG11 ' A' ' 211' ' ' VAL . 36.3 mm -110.36 127.27 67.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.468 -0.787 . . . . 10.0 108.988 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -101.25 105.66 16.78 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.886 0.374 . . . . 10.0 111.5 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.418 ' HB3' HG23 ' A' ' 393' ' ' THR . 11.1 mt-10 -76.99 107.03 9.04 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.413 -0.588 . . . . 10.0 109.413 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 55.6 mtt -104.11 -177.44 3.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.059 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -116.55 141.37 48.28 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.847 0.356 . . . . 10.0 111.088 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.21 106.74 2.11 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.204 179.278 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 138.93 -41.82 1.31 Allowed Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.803 -0.713 . . . . 10.0 111.963 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.04 -73.04 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.845 0.355 . . . . 10.0 110.554 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 159.52 126.77 0.87 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.593 -0.813 . . . . 10.0 112.445 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -109.04 -60.68 1.72 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.906 0.384 . . . . 10.0 110.177 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -31.85 72.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.847 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.1 mp -72.75 -14.77 61.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.58 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 20.4 m -100.32 -30.59 11.78 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.266 0.555 . . . . 10.0 110.618 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.439 ' HB1' HD21 ' A' ' 207' ' ' LEU . . . -66.03 -9.81 34.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.415 -0.812 . . . . 10.0 112.504 -179.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.412 HG22 ' CZ ' ' A' ' 147' ' ' PHE . 0.6 OUTLIER -71.92 -22.91 61.41 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.722 0.267 . . . . 10.0 111.722 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.414 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 54.9 mt -72.58 -56.79 3.68 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.214 0.45 . . . . 10.0 112.214 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 35.5 Cg_endo -63.12 -31.13 75.64 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 122.15 1.9 . . . . 10.0 112.327 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.72 -45.92 77.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.51 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.427 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 62.9 t80 -63.06 -45.74 90.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.598 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.441 ' O ' HD11 ' A' ' 60' ' ' LEU . 44.7 tp -60.39 -51.79 67.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.944 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -71.38 -14.94 62.33 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.862 0.319 . . . . 10.0 111.862 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -81.77 -22.85 36.97 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.685 0.279 . . . . 10.0 110.411 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.6 mt -61.9 -31.17 71.45 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.866 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.38 -19.36 61.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.239 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 73.33 9.19 76.95 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.193 -0.527 . . . . 10.0 113.117 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -76.33 -18.33 58.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.733 0.301 . . . . 10.0 110.867 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 103.16 127.97 6.24 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.637 -0.792 . . . . 10.0 113.243 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.1 t -105.84 118.74 53.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 178.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 39.5 m170 -101.09 101.74 12.55 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.853 0.359 . . . . 10.0 111.043 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 38.3 t -92.19 116.53 33.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.767 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.507 ' HB ' HG12 ' A' ' 208' ' ' VAL . 84.0 t -105.27 114.78 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.917 -178.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -101.71 164.12 11.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.634 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.7 m -69.52 -26.95 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -148.32 175.18 11.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.718 0.294 . . . . 10.0 110.705 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -78.35 -25.44 46.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.68 -179.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.21 -56.13 26.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.724 0.297 . . . . 10.0 110.717 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.8 mt -65.78 -38.22 88.44 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.917 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.64 -51.62 69.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.798 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -70.47 -31.48 68.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.039 0.447 . . . . 10.0 110.693 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 138' ' ' ARG . 1.7 ttp180 -63.08 -57.51 10.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.806 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.23 -32.65 73.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.888 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.502 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -59.38 -39.4 83.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.903 0.382 . . . . 10.0 111.042 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -90.4 -28.5 18.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.209 -0.45 . . . . 10.0 111.391 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -73.17 -43.95 60.71 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.537 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -89.2 -1.36 58.05 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.865 0.364 . . . . 10.0 111.15 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 58.4 ttm-85 -61.62 -49.23 87.63 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' PRO . . . . . 0.465 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 18.3 Cg_exo -66.93 -1.26 5.77 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 122.163 1.909 . . . . 10.0 112.621 -179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.8 tp -101.93 -52.33 3.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.202 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' PHE . . . . . 0.412 ' CZ ' HG22 ' A' ' 113' ' ' THR . 24.3 m-85 -69.47 -45.49 68.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.165 -0.471 . . . . 10.0 111.586 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -70.1 -15.35 62.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.111 0.481 . . . . 10.0 110.941 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -73.78 -27.39 61.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.344 178.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 66.8 mt -98.93 -11.03 22.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.384 -0.825 . . . . 10.0 110.823 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 115.19 -5.64 21.71 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.293 -0.956 . . . . 10.0 114.149 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 82.7 mt -82.29 131.19 35.23 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.339 0.57 . . . . 10.0 110.639 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 11.0 p -86.3 134.42 33.75 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.217 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' VAL . . . . . 0.404 HG21 ' HA ' ' A' ' 144' ' ' ARG . 40.4 t -106.83 127.34 62.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.409 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -123.22 134.89 9.67 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.764 -0.731 . . . . 10.0 111.969 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 5.4 tp -108.91 130.57 61.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.898 0.38 . . . . 10.0 110.305 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -111.89 102.3 10.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.111 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' A' ' 161' ' ' MET . 97.0 mt -90.9 141.99 27.16 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.451 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 159' ' ' PRO . . . . . 0.423 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 32.2 Cg_exo -59.12 112.0 1.08 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.85 2.366 . . . . 10.0 112.41 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 100.12 18.68 21.32 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.995 -0.621 . . . . 10.0 112.447 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' MET . . . . . 0.52 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 8.2 ttp -82.07 140.13 46.14 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 109.881 -0.415 . . . . 10.0 109.881 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.88 153.17 32.4 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.509 2.139 . . . . 10.0 112.832 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 163' ' ' ALA . . . . . 0.472 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -54.2 -49.0 92.67 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.939 0.718 . . . . 10.0 112.939 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.472 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 50.5 Cg_exo -55.67 -36.35 94.68 Favored 'Trans proline' 0 C--N 1.36 1.158 0 C-N-CA 121.824 1.683 . . . . 10.0 112.155 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -70.63 -43.1 69.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.41 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.52 ' HE2' ' O ' ' A' ' 161' ' ' MET . 62.5 mttm -61.34 -46.26 90.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.568 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -57.87 -39.34 77.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.059 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -68.91 -37.31 78.87 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.839 0.352 . . . . 10.0 111.204 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -74.09 -39.19 63.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.454 -179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -75.8 -25.06 56.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.442 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.84 -5.97 54.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.872 0.368 . . . . 10.0 110.591 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -78.78 175.7 10.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.127 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -74.12 -44.42 53.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.821 0.344 . . . . 10.0 110.537 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 70.4 mt -126.69 123.87 63.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.931 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.2 m -112.92 128.12 56.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.998 0.428 . . . . 10.0 111.448 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -104.24 135.24 46.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.752 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.19 173.34 44.19 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.304 -0.951 . . . . 10.0 112.826 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.1 m -92.35 151.81 20.08 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.151 0.18 . . . . 10.0 110.538 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -56.85 -43.44 81.17 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -59.08 -51.94 67.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.687 0.28 . . . . 10.0 111.532 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.423 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 4.0 tp10 -66.14 -37.4 85.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.986 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -59.67 -39.78 85.61 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.88 0.372 . . . . 10.0 110.913 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -74.97 -41.8 31.7 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.738 -0.744 . . . . 10.0 111.548 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -62.95 -36.76 84.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.033 0.445 . . . . 10.0 110.389 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 185' ' ' ASP . . . . . 0.41 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 11.3 m-20 -60.35 -44.57 95.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.012 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -62.83 -38.14 89.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.339 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 187' ' ' LEU . . . . . 0.403 HD11 HG22 ' A' ' 375' ' ' ILE . 74.8 mt -63.03 -48.16 79.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.776 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 40.9 mtm-85 -67.55 -37.76 83.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.799 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -61.62 -50.36 72.87 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.514 -0.766 . . . . 10.0 111.498 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.01 1.18 28.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.754 -0.657 . . . . 10.0 112.463 -178.195 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 22.5 ttp -108.47 11.01 27.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.113 0.482 . . . . 10.0 110.566 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -79.31 170.67 16.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.869 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -106.34 -30.32 9.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.952 0.406 . . . . 10.0 110.451 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.32 139.65 24.11 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.87 -24.31 78.9 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.831 2.354 . . . . 10.0 113.202 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -76.96 -16.02 59.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.68 0.276 . . . . 10.0 111.125 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -76.88 -9.95 59.04 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.345 -0.389 . . . . 10.0 110.646 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -54.87 155.54 4.31 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.787 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 11.4 m -133.26 -15.4 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.784 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -87.32 -175.2 5.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.305 0.574 . . . . 10.0 111.691 -179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -145.12 -171.23 3.61 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.36 -0.837 . . . . 10.0 108.861 179.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 24.5 tttm -65.44 131.54 46.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.008 0.432 . . . . 10.0 110.637 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 19.9 mt -83.85 60.7 5.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.337 0.589 . . . . 10.0 109.629 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -76.59 -60.22 2.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.512 -0.767 . . . . 10.0 112.868 -178.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -127.83 135.0 49.46 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 111.988 0.366 . . . . 10.0 111.988 -178.181 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.538 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -133.14 126.21 31.21 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.751 178.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 207' ' ' LEU . . . . . 0.439 HD21 ' HB1' ' A' ' 112' ' ' ALA . 59.1 tp -123.07 116.06 22.86 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.117 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 208' ' ' VAL . . . . . 0.507 HG12 ' HB ' ' A' ' 129' ' ' VAL . 15.5 m -99.19 141.54 16.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.204 0.526 . . . . 10.0 111.21 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -64.67 -72.6 0.14 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.127 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 210' ' ' GLU . . . . . 0.47 ' OE1' ' HA ' ' A' ' 391' ' ' THR . 31.1 mm-40 -109.02 109.51 20.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.768 0.318 . . . . 10.0 110.82 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.685 HG11 HD12 ' A' ' 99' ' ' ILE . 34.0 m -69.32 -20.96 24.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.944 0.402 . . . . 10.0 110.653 179.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.98 -46.05 82.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.58 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.33 -39.4 8.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.745 0.646 . . . . 10.0 112.745 -178.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 58.6 mt -74.34 -30.33 26.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 113.225 0.824 . . . . 10.0 113.225 -177.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 215' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 219' ' ' ALA . 42.5 mt -112.7 -45.58 3.21 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.925 0.713 . . . . 10.0 112.925 -178.175 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 37.8 mm -79.02 -65.92 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.736 0.643 . . . . 10.0 112.736 -178.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.72 -61.22 2.75 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.734 0.642 . . . . 10.0 112.734 -177.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -90.78 74.85 6.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.983 0.421 . . . . 10.0 110.724 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 219' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 215' ' ' LEU . . . -109.47 -51.38 2.88 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.251 -0.432 . . . . 10.0 111.575 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.31 3.14 36.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.036 -178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 1.5 m -67.85 112.72 11.35 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.54 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -91.91 126.77 0.93 Allowed 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 122.918 2.412 . . . . 10.0 113.15 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 223' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 374' ' ' SER . 58.1 mt -82.81 88.7 6.76 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.894 -0.593 . . . . 10.0 109.428 178.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 18.3 mt -94.6 113.28 28.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.88 -179.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 4.0 mt . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.426 -179.903 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.225 0 N-CA-C 107.868 -1.16 . . . . 10.0 107.868 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 374' ' ' SER . . . . . 0.45 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 20.1 m -151.23 148.69 28.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.214 0.53 . . . . 10.0 112.228 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.403 HG22 HD11 ' A' ' 187' ' ' LEU . 16.6 tt -162.03 141.12 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.135 -0.939 . . . . 10.0 109.274 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 5.7 p -96.7 148.39 22.93 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.845 -0.428 . . . . 10.0 109.845 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -58.06 -42.08 84.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 10.0 111.094 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 378' ' ' GLN . . . . . 0.538 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 0.0 OUTLIER -60.95 -29.72 69.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.263 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -95.78 -8.66 33.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.763 0.316 . . . . 10.0 111.011 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -83.52 -50.0 8.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.191 0.519 . . . . 10.0 109.719 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -73.91 -4.92 37.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.636 0.731 . . . . 10.0 110.007 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 15.9 ttt180 -82.96 -4.24 58.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.102 -0.953 . . . . 10.0 109.829 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.469 HD11 HH21 ' A' ' 656' ' ' ARG . 29.5 mt -106.87 4.3 27.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.597 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 384' ' ' TYR . . . . . 0.538 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 17.3 m-85 -97.58 143.46 28.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.053 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -70.74 -74.36 0.15 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.295 0.569 . . . . 10.0 110.721 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -95.0 102.89 14.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.734 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 46.5 tp -109.96 118.49 36.59 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.99 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -132.15 161.6 32.94 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.324 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -162.75 163.05 35.02 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.41 -0.9 . . . . 10.0 112.371 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 390' ' ' MET . . . . . 0.632 ' O ' ' HB ' ' A' ' 391' ' ' THR . 27.8 mtm -124.48 178.85 5.19 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 110.096 -0.335 . . . . 10.0 110.096 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 391' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' A' ' 390' ' ' MET . 1.4 t 167.52 -177.75 0.02 OUTLIER 'General case' 0 C--O 1.234 0.276 0 O-C-N 123.774 0.671 . . . . 10.0 109.914 178.319 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -92.04 143.5 16.58 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.389 -0.684 . . . . 10.0 111.389 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 393' ' ' THR . . . . . 0.418 HG23 ' HB3' ' A' ' 101' ' ' GLU . 0.2 OUTLIER -55.4 108.28 0.41 Allowed 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.562 0.345 . . . . 10.0 111.671 -179.634 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -145.86 -19.75 0.46 Allowed 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.062 0.393 . . . . 10.0 112.062 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 31.6 t70 59.41 -101.27 0.12 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 396' ' ' THR . . . . . 0.512 HG23 ' HB3' ' A' ' 565' ' ' ARG . 5.2 m 54.52 -104.28 0.21 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.946 0.498 . . . . 10.0 112.29 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -81.51 32.36 0.35 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.969 0.414 . . . . 10.0 111.518 -179.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 398' ' ' ALA . . . . . 0.563 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -67.1 -18.83 65.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.99 0.424 . . . . 10.0 110.781 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -74.11 -15.29 61.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.883 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -84.74 -24.6 28.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.979 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 401' ' ' PHE . . . . . 0.563 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 22.5 m-85 -56.57 -54.49 45.36 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.741 0.305 . . . . 10.0 111.629 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.7 m -76.47 -8.81 57.94 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 40.7 m -95.47 -47.46 6.26 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -178.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 20.0 mt -86.13 -74.13 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.264 0.468 . . . . 10.0 112.264 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 405' ' ' TYR . . . . . 0.538 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 68.7 m-85 -78.95 -8.04 58.55 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.482 0.549 . . . . 10.0 112.482 -177.616 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm 62.13 58.82 1.75 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.12 0.486 . . . . 10.0 110.763 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 407' ' ' LEU . . . . . 0.48 HD13 HD11 ' A' ' 99' ' ' ILE . 2.4 mt -114.29 156.56 24.15 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.429 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 408' ' ' ASP . . . . . 0.469 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . 20.3 t0 -95.46 147.06 23.94 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.61 -0.885 . . . . 10.0 108.61 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 1.8 m -109.13 104.5 13.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.888 0.375 . . . . 10.0 111.324 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 5.9 t -114.71 129.01 71.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.667 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 61.5 t -90.48 123.59 42.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 110.04 -0.355 . . . . 10.0 110.04 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 50.1 t -90.73 126.65 55.17 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.842 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.17 150.39 88.42 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.556 2.171 . . . . 10.0 111.966 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 16.4 p -77.23 164.24 25.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.015 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -68.63 -35.59 77.5 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.764 -0.828 . . . . 10.0 108.764 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 55.7 mmt-85 -134.69 143.21 45.51 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 114.944 -1.025 . . . . 10.0 108.829 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -60.64 136.63 68.17 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.662 2.241 . . . . 10.0 112.896 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 73.8 mtm -84.92 130.35 34.66 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.324 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.1 mt -111.51 36.13 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.364 0.602 . . . . 10.0 109.962 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 420' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 420' ' ' ARG . 35.4 ttp180 -71.38 123.39 22.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.031 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 14.4 mttm -83.11 99.6 10.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.29 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 422' ' ' ASP . . . . . 0.537 ' OD1' ' HD2' ' A' ' 572' ' ' ARG . 9.0 m-20 -86.46 110.57 19.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.496 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 43.9 mt -94.61 157.28 37.35 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.358 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -71.42 176.29 8.21 Favored 'Trans proline' 0 C--O 1.238 0.489 0 C-N-CA 122.739 2.293 . . . . 10.0 112.894 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -86.63 115.76 24.3 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.445 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 426' ' ' LEU . . . . . 0.502 ' HA ' HD23 ' A' ' 426' ' ' LEU . 9.9 mt -89.7 87.36 6.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.13 0.49 . . . . 10.0 109.792 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 427' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 588' ' ' LEU . 8.9 t -86.3 126.55 40.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.748 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 428' ' ' TYR . . . . . 0.417 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 5.3 m-85 -112.14 177.49 4.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.234 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 84.9 mmm -71.76 -77.04 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.633 0.254 . . . . 10.0 111.396 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 67.0 p -88.12 157.51 18.82 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.96 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -61.27 -30.45 70.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.468 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -60.13 -39.96 88.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.221 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -64.84 -41.2 95.92 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.034 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 434' ' ' LYS . . . . . 0.505 ' O ' HG13 ' A' ' 438' ' ' ILE . 38.8 ttpt -59.19 -51.47 69.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.061 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 435' ' ' ILE . . . . . 0.454 ' O ' HG12 ' A' ' 439' ' ' ILE . 46.5 mm -63.1 -44.25 99.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.593 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 436' ' ' GLN . . . . . 0.483 ' O ' ' HG2' ' A' ' 440' ' ' GLU . 24.7 tp60 -57.65 -45.17 85.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.866 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -63.11 -37.65 88.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.805 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 438' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 434' ' ' LYS . 88.8 mt -59.67 -44.25 93.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.097 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 439' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 435' ' ' ILE . 30.3 mm -62.09 -38.87 81.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.013 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 440' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 436' ' ' GLN . 5.9 mm-40 -65.05 -42.44 94.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.871 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 441' ' ' ASP . . . . . 0.6 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 15.2 t70 -67.71 -42.45 81.96 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 179.371 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.513 HG12 HG11 ' A' ' 452' ' ' VAL . 56.1 mt -58.07 -41.38 80.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.694 179.4 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -59.97 -40.9 90.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.15 0.5 . . . . 10.0 110.596 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.95 -28.12 69.3 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.564 -0.744 . . . . 10.0 111.074 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 14.3 mmt180 -86.11 -43.11 13.33 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.908 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.54 -42.49 98.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.619 -0.264 . . . . 10.0 111.362 -179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -71.83 -9.93 59.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.471 -0.332 . . . . 10.0 111.232 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 4.1 ttmm -104.69 -4.48 22.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.642 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 79.3 30.15 46.97 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.837 -0.697 . . . . 10.0 112.418 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 450' ' ' GLN . . . . . 0.457 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 63.8 tt0 -108.33 131.28 21.86 Favored Pre-proline 0 C--N 1.327 -0.391 0 O-C-N 122.796 -0.238 . . . . 10.0 111.027 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -69.63 143.71 52.36 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.684 2.256 . . . . 10.0 111.442 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 452' ' ' VAL . . . . . 0.513 HG11 HG12 ' A' ' 442' ' ' ILE . 49.0 t -120.42 125.46 74.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.874 0.369 . . . . 10.0 111.676 -178.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 32.5 tp -113.1 105.82 13.92 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 39.6 t -93.4 122.66 45.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.452 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -105.24 91.64 0.78 Allowed Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.14 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.32 140.08 29.9 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.363 -0.236 . . . . 10.0 110.363 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 20.9 pt -77.76 -35.94 21.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 112.506 0.558 . . . . 10.0 112.506 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 7.4 p -122.99 159.45 28.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.95 0.405 . . . . 10.0 112.023 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 74.5 mt -64.72 -36.98 78.96 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -56.52 -46.63 80.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.988 -1.005 . . . . 10.0 110.327 178.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.13 -32.89 72.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.439 179.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 17.2 m -64.39 -44.44 91.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.134 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -68.85 -40.44 79.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.322 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.9 -53.83 54.02 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.417 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.63 -31.59 54.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-O 120.92 0.39 . . . . 10.0 110.877 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 35.4 t -68.63 -41.05 80.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.119 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -59.86 -48.85 80.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.592 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -64.24 -39.51 94.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.866 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 19.8 mt -62.92 -34.43 77.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.986 0.422 . . . . 10.0 110.628 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 7.9 m -71.83 -42.73 66.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.734 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -61.75 -39.5 91.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.372 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -72.76 -18.27 61.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.855 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 79.72 47.93 6.95 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.062 -0.589 . . . . 10.0 112.706 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 65.9 mt -118.77 128.43 75.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 110.396 -0.224 . . . . 10.0 110.396 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 21.5 mmtm -62.24 129.75 42.22 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 54.9 p-80 -161.0 149.49 16.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.759 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -127.53 157.72 39.37 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.209 -0.451 . . . . 10.0 109.842 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.6 t -121.6 130.76 74.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.662 0.268 . . . . 10.0 111.027 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 90.3 mt -83.5 90.08 7.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.599 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -85.16 126.65 33.81 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.433 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -61.23 -22.83 65.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.692 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -85.93 -2.45 58.28 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.066 0.46 . . . . 10.0 110.57 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -130.49 59.41 1.65 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.312 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -61.68 -33.82 74.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.056 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.49 74.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.864 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 486' ' ' ASN . . . . . 0.424 ' O ' HG13 ' A' ' 490' ' ' ILE . 0.2 OUTLIER -88.54 -33.48 17.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.891 179.48 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.5 -57.38 9.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.6 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -54.2 -39.78 66.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.585 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -66.13 -35.75 81.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.246 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 490' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 486' ' ' ASN . 47.9 mt -74.66 -41.99 48.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.493 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 95.6 t -60.41 -34.83 59.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.746 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -59.6 -28.4 67.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.634 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -124.39 26.94 7.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.922 0.391 . . . . 10.0 110.57 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -74.55 -21.9 59.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.17 0.51 . . . . 10.0 110.655 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -94.82 16.23 61.7 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.98 -0.629 . . . . 10.0 111.737 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -74.28 138.01 75.16 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 110.115 -0.328 . . . . 10.0 110.115 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.05 125.84 19.6 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.661 2.24 . . . . 10.0 112.952 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.5 22.33 6.43 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.067 0.766 . . . . 10.0 113.067 178.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -100.95 122.73 44.0 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 121.122 -0.231 . . . . 10.0 110.491 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 35.3 t -97.95 115.64 38.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.912 0.387 . . . . 10.0 110.44 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.9 m -115.33 121.88 44.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.572 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 47.7 mt -101.19 124.36 54.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.271 -0.422 . . . . 10.0 109.94 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -114.44 116.54 29.03 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.817 0.342 . . . . 10.0 111.182 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 21.4 m -81.13 113.94 19.63 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.586 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 63.83 81.46 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.326 -0.852 . . . . 10.0 110.883 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 53.4 tpp -60.95 122.46 14.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.248 -0.887 . . . . 10.0 110.957 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -87.69 166.73 14.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.886 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -65.56 157.7 47.4 Favored Glycine 0 N--CA 1.453 -0.187 0 C-N-CA 121.219 -0.515 . . . . 10.0 112.471 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 68.98 -93.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.977 0.511 . . . . 10.0 110.861 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 88.8 132.78 4.42 Favored Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 121.1 -0.572 . . . . 10.0 111.843 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.62 143.28 25.24 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.499 0.32 . . . . 10.0 110.926 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -64.67 98.6 0.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.646 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 70.4 mt -73.6 101.94 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.129 0.49 . . . . 10.0 109.819 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 514' ' ' VAL . . . . . 0.425 ' HB ' ' O ' ' A' ' 517' ' ' GLY . 6.3 t -71.67 132.02 33.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.865 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.468 HD11 ' OD1' ' A' ' 580' ' ' ASP . 34.0 mt -66.37 125.83 26.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.591 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 93.36 -0.81 68.81 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.101 -0.571 . . . . 10.0 111.847 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 517' ' ' GLY . . . . . 0.425 ' O ' ' HB ' ' A' ' 514' ' ' VAL . . . 106.2 -167.91 14.58 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 110.986 -0.846 . . . . 10.0 110.986 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.9 p -127.06 98.18 5.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 117.278 0.539 . . . . 10.0 110.991 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 52.9 p-90 -58.51 -29.47 66.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.877 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -62.25 -30.01 70.81 Favored 'General case' 0 C--N 1.334 -0.077 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.783 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -86.25 -34.42 20.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.467 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -65.89 -43.95 86.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.612 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 523' ' ' VAL . . . . . 0.406 HG12 HD12 ' A' ' 537' ' ' ILE . 34.1 m -70.48 -20.07 22.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.94 0.4 . . . . 10.0 110.593 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -91.87 -0.1 57.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -90.29 -10.79 42.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.573 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 44.2 mt -96.04 154.0 17.47 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.834 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -72.62 -57.11 4.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.85 0.357 . . . . 10.0 110.152 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -119.2 88.6 37.76 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.975 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.05 103.3 1.16 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.996 2.464 . . . . 10.0 111.515 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 18.8 p -81.56 173.39 12.43 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.358 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.75 -43.23 80.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.484 0.183 . . . . 10.0 111.446 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 532' ' ' GLU . 1.6 mp0 -62.28 -41.02 98.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.887 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -68.24 -44.43 75.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.952 0.406 . . . . 10.0 110.408 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 90.3 mt -64.33 -42.48 95.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.254 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -64.89 -42.52 94.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.481 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -58.32 -51.6 69.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.344 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 537' ' ' ILE . . . . . 0.406 HD12 HG12 ' A' ' 523' ' ' VAL . 96.7 mt -64.83 -37.31 79.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.29 -0.413 . . . . 10.0 110.665 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -62.18 -47.68 83.41 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.977 0.418 . . . . 10.0 110.303 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -69.54 -37.82 77.24 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.504 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 540' ' ' ASP . . . . . 0.576 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 13.2 t70 -61.31 -49.13 78.28 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.238 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -60.43 -39.81 88.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.867 -1.061 . . . . 10.0 110.337 179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 -52.05 -48.61 64.52 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.308 0.38 . . . . 10.0 110.914 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 26.0 t -60.09 -47.44 91.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.91 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 544' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 6.2 mtm180 -67.99 -35.73 78.82 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.925 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -64.29 -48.55 75.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.474 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.37 -31.23 71.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.458 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.5 94.76 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.434 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 548' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 544' ' ' ARG . 99.4 t -65.43 -37.64 80.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.464 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.23 -45.82 89.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.048 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -70.18 -18.41 63.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.022 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 551' ' ' ALA . . . . . 0.457 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -82.92 -28.46 29.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.961 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 129.97 6.34 4.06 Favored Glycine 0 CA--C 1.519 0.324 0 C-N-CA 120.445 -0.883 . . . . 10.0 113.302 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 84.12 -167.6 43.78 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.67 -0.776 . . . . 10.0 112.43 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 36.6 tp -71.67 119.56 16.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.908 0.385 . . . . 10.0 110.879 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -91.45 118.94 30.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.748 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 25.3 mm -103.22 134.99 42.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.289 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 40.6 mt -126.48 121.59 59.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.018 0.437 . . . . 10.0 110.691 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.38 115.71 4.99 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.115 -0.794 . . . . 10.0 111.115 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 20.5 p -71.51 -40.3 70.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.021 0.439 . . . . 10.0 111.266 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -137.55 151.27 48.21 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.036 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 561' ' ' ARG . . . . . 0.588 ' HB2' HD22 ' A' ' 594' ' ' LEU . 3.5 mmt85 -90.88 150.7 21.42 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -94.94 146.24 24.37 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.806 -0.358 . . . . 10.0 110.588 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -59.46 -51.95 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 564' ' ' SER . . . . . 0.408 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.1 OUTLIER -75.05 117.27 16.71 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.233 -0.894 . . . . 10.0 110.127 179.039 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 565' ' ' ARG . . . . . 0.532 ' HA ' ' HB3' ' A' ' 568' ' ' ASP . 17.1 tpt180 -66.33 -26.62 67.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.125 -0.488 . . . . 10.0 110.216 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -58.87 -36.84 75.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.526 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 59.9 mt -92.75 -34.78 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.646 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 568' ' ' ASP . . . . . 0.532 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 2.2 t70 -60.89 -44.81 96.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.101 0.477 . . . . 10.0 110.693 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -69.55 -24.82 63.77 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.933 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -66.52 -26.83 67.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.747 0.308 . . . . 10.0 110.49 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.405 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 57.2 tp -73.13 -33.94 65.82 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 572' ' ' ARG . . . . . 0.537 ' HD2' ' OD1' ' A' ' 422' ' ' ASP . 13.5 ttp180 -76.66 -30.68 56.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.078 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.82 27.77 3.34 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 121.011 -0.614 . . . . 10.0 113.525 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 574' ' ' ARG . . . . . 0.405 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 0.3 OUTLIER -77.46 -54.92 5.85 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 179.075 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.78 172.63 10.65 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.994 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 85.11 47.39 5.27 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.692 -0.766 . . . . 10.0 111.573 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 577' ' ' ARG . . . . . 0.584 ' H ' ' HB3' ' A' ' 580' ' ' ASP . 54.4 mtt180 -108.53 121.16 44.39 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.185 -0.302 . . . . 10.0 110.185 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 59.46 28.99 18.5 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.701 0.63 . . . . 10.0 112.701 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 104.75 4.47 42.54 Favored Glycine 0 N--CA 1.454 -0.111 0 C-N-CA 120.292 -0.956 . . . . 10.0 113.866 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 580' ' ' ASP . . . . . 0.584 ' HB3' ' H ' ' A' ' 577' ' ' ARG . 0.9 OUTLIER -67.79 157.8 33.93 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.942 0.371 . . . . 10.0 110.253 179.23 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -92.7 -103.99 0.12 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.572 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 97.75 175.61 33.78 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.696 -0.764 . . . . 10.0 112.3 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -153.8 120.63 5.63 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.328 -0.249 . . . . 10.0 110.328 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.97 119.64 34.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.818 0.342 . . . . 10.0 110.864 -179.423 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -117.51 113.54 22.15 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.136 -0.483 . . . . 10.0 109.959 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -102.87 147.0 27.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.897 0.379 . . . . 10.0 111.035 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 587' ' ' TYR . . . . . 0.489 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 31.4 m-85 -135.33 158.14 45.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.474 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 588' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 427' ' ' VAL . 10.1 tp -165.78 163.26 18.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.239 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 589' ' ' SER . . . . . 0.517 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.6 OUTLIER -124.1 159.48 29.88 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.558 -0.292 . . . . 10.0 110.33 179.275 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 590' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 77.9 mmm -74.7 -17.95 60.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.222 0.534 . . . . 10.0 110.282 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -111.03 24.17 13.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.275 -0.875 . . . . 10.0 109.088 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 592' ' ' ASP . . . . . 0.517 ' HB2' ' O ' ' A' ' 589' ' ' SER . 0.9 OUTLIER -76.32 176.82 7.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.127 -0.942 . . . . 10.0 111.954 -178.71 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -82.32 -28.65 31.54 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.661 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 594' ' ' LEU . . . . . 0.588 HD22 ' HB2' ' A' ' 561' ' ' ARG . 9.3 tp -70.62 -13.42 62.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.142 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 16.3 mmt -76.06 12.08 1.26 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.969 0.414 . . . . 10.0 111.559 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.516 ' NH1' ' HA ' ' A' ' 596' ' ' ARG . 10.9 mmm180 -110.87 -4.03 15.4 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.572 -0.286 . . . . 10.0 111.059 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 597' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 594' ' ' LEU . 28.0 pt -82.82 -10.16 11.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 121.22 0.533 . . . . 10.0 110.459 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -87.8 3.85 46.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.53 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.42 -83.2 0.03 OUTLIER 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.281 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 3.2 m -69.96 125.47 26.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.864 0.364 . . . . 10.0 110.825 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -69.36 -15.95 63.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.984 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 602' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 602' ' ' ARG . 4.5 mmt180 -64.94 -32.48 74.22 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.051 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.5 t -61.95 -55.35 24.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.21 0.528 . . . . 10.0 109.69 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 3.6 m -66.19 -35.52 80.65 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.675 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -65.57 -38.01 94.24 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.453 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 29.9 tpp -73.13 -26.07 61.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.098 0.475 . . . . 10.0 110.757 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 51.9 mtt -72.35 -12.6 61.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.73 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -76.13 -7.19 54.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.019 0.438 . . . . 10.0 110.725 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -83.25 9.37 10.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.085 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 6.3 mp -80.9 -16.01 54.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.014 0.435 . . . . 10.0 110.478 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 89.97 -48.61 3.25 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.0 -0.619 . . . . 10.0 112.562 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 69.3 -66.65 0.25 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.394 0.677 . . . . 10.0 111.387 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt 66.32 94.23 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.249 0 O-C-N 123.527 0.517 . . . . 10.0 110.686 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 614' ' ' PRO . . . . . 0.417 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 65.1 Cg_exo -50.29 107.85 0.19 Allowed 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 123.26 2.64 . . . . 10.0 112.994 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 118.82 -17.47 10.88 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.734 -0.746 . . . . 10.0 112.288 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -93.8 132.68 37.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.953 0.406 . . . . 10.0 110.788 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -102.9 91.6 4.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.475 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 6.4 tp -66.75 -35.69 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.548 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 47.45 66.7 0.95 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.576 -0.738 . . . . 10.0 112.193 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 3.3 m170 -109.04 114.73 57.88 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.606 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.86 -15.88 40.85 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.158 2.572 . . . . 10.0 114.207 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -63.58 -29.02 70.33 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.75 -0.38 . . . . 10.0 110.494 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 23.4 t -69.44 -46.16 76.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 87.9 m -59.21 -44.08 92.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.015 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.47 -31.7 72.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.97 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -70.9 -40.84 71.94 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.944 -0.391 . . . . 10.0 109.944 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 97.2 mt -66.53 -49.11 77.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.434 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -58.66 -35.88 73.27 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.968 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -64.92 -41.05 95.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.935 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -69.53 -40.63 76.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.894 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -60.17 -44.17 95.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.314 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 52.9 ttt85 -65.67 -32.6 74.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.35 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 55.4 mttt -65.27 -35.95 82.6 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.649 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.47 -44.17 98.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 109.253 -0.647 . . . . 10.0 109.253 178.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.408 ' OE2' ' HA ' ' A' ' 564' ' ' SER . 6.8 mm-40 -66.0 -39.12 90.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.383 -0.826 . . . . 10.0 110.096 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 19.7 m -64.62 -33.52 76.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.048 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -66.94 -36.5 82.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.28 0.562 . . . . 10.0 109.532 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -64.7 -36.83 85.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.309 -0.86 . . . . 10.0 110.007 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -59.04 -40.29 84.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.467 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -61.28 -41.35 96.81 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.077 0.465 . . . . 10.0 110.185 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 43.2 mt -66.35 -42.46 90.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.986 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 642' ' ' ARG . . . . . 0.606 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 2.1 mmm180 -62.68 -42.06 99.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.98 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -59.64 -40.7 88.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.336 -0.847 . . . . 10.0 110.687 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -63.17 -39.31 94.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.281 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 78.6 mt -69.5 -38.62 77.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.38 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 646' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 89.9 mt -60.1 -36.33 77.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.881 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -68.13 -20.65 64.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.494 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -96.02 -44.15 7.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.19 0.519 . . . . 10.0 110.361 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -69.18 -27.86 65.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.839 -0.619 . . . . 10.0 112.026 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -65.28 -30.92 71.83 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.146 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 651' ' ' VAL . . . . . 0.557 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 30.1 t -62.7 -46.7 95.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.57 -30.44 68.23 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.152 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 653' ' ' ASN . . . . . 0.472 ' HA ' ' NH1' ' A' ' 656' ' ' ARG . 13.9 t30 -66.67 -48.0 70.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.539 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.81 -47.24 85.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.869 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 655' ' ' GLN . . . . . 0.557 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 41.4 mt-30 -64.51 -38.69 91.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.257 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 656' ' ' ARG . . . . . 0.472 ' NH1' ' HA ' ' A' ' 653' ' ' ASN . 18.9 ttp-105 -63.7 -48.46 77.0 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.506 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -61.83 -43.92 97.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.537 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -62.93 -50.89 69.06 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.869 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 659' ' ' ILE . . . . . 0.455 HG13 HD21 ' A' ' 771' ' ' LEU . 7.5 tp -69.49 -34.97 64.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 111.984 0.364 . . . . 10.0 111.984 -178.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -68.1 -36.35 79.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.567 0.222 . . . . 10.0 110.584 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 51.3 m -62.0 -48.09 81.89 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -63.6 -45.24 91.27 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.675 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 34.6 ttt-85 -60.4 -35.47 75.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.821 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -71.04 -38.02 72.55 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.686 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -61.93 -49.4 76.3 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 666' ' ' LEU . . . . . 0.471 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 49.4 mt -66.78 -18.25 65.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.795 -0.638 . . . . 10.0 110.713 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 39.5 tp -81.28 -41.57 21.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.008 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -78.65 -40.08 35.19 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.563 0.579 . . . . 10.0 112.563 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 27.4 m -59.68 140.0 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 121.403 0.621 . . . . 10.0 111.58 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 4.1 m -92.8 -10.08 38.14 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.823 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -130.28 160.97 32.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.946 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.01 14.41 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.877 0.37 . . . . 10.0 111.017 -178.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 5.7 m -54.21 -58.73 6.26 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.851 0.358 . . . . 10.0 111.827 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 674' ' ' GLU . . . . . 0.415 ' HA ' ' OE2' ' A' ' 674' ' ' GLU . 5.0 mm-40 -63.52 -34.83 78.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 10.0 112.018 -179.045 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -45.92 87.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.794 0.331 . . . . 10.0 110.272 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 676' ' ' ILE . . . . . 0.493 ' O ' ' HB2' ' A' ' 680' ' ' ARG . 36.0 mm -67.43 -37.68 79.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.142 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -63.71 -47.75 79.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.216 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 44.8 m -55.42 -48.29 74.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.745 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 679' ' ' ILE . . . . . 0.435 ' O ' HG23 ' A' ' 683' ' ' VAL . 42.5 pt -75.71 -25.49 17.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.732 -0.387 . . . . 10.0 111.291 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 680' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 676' ' ' ILE . 27.4 ttm-85 -61.66 -45.51 93.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.989 0.423 . . . . 10.0 110.396 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 681' ' ' GLU . . . . . 0.54 ' HG2' HD21 ' A' ' 740' ' ' LEU . 30.0 mt-10 -68.14 -26.89 66.0 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.644 -0.707 . . . . 10.0 111.0 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -80.45 -48.42 12.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.026 -0.533 . . . . 10.0 111.35 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 683' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 679' ' ' ILE . 79.1 t -59.84 -47.93 89.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.44 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -60.86 -39.72 90.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.17 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -61.71 -48.93 78.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.413 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.84 -39.72 82.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.158 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 10.5 m -64.72 -39.47 93.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.374 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -70.47 -48.02 62.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.621 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 689' ' ' ASP . . . . . 0.409 ' HA ' ' O ' ' A' ' 692' ' ' ILE . 4.5 m-20 -58.36 -29.08 65.7 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.873 -179.26 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -65.13 -26.97 68.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.806 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -115.81 -17.23 11.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.824 0.345 . . . . 10.0 111.457 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 692' ' ' ILE . . . . . 0.506 HG23 ' CD1' ' A' ' 701' ' ' TRP . 67.0 mt -128.21 105.53 19.84 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.432 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.16 138.64 52.5 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.46 2.107 . . . . 10.0 111.422 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -51.18 108.69 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 123.056 2.504 . . . . 10.0 113.465 -179.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 59.17 80.78 0.18 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.678 -0.692 . . . . 10.0 111.482 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 3.5 p -137.23 -164.35 1.57 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.434 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 89.9 mt -85.69 146.79 26.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.709 -0.223 . . . . 10.0 110.917 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 698' ' ' GLU . . . . . 0.452 ' HA ' ' CE3' ' A' ' 701' ' ' TRP . 19.5 tt0 -58.07 -39.11 77.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.434 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.17 -16.93 64.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.957 0.408 . . . . 10.0 111.422 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 24.2 ttt -87.0 -14.47 41.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.229 0.538 . . . . 10.0 110.115 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 701' ' ' TRP . . . . . 0.506 ' CD1' HG23 ' A' ' 692' ' ' ILE . 43.8 m0 -84.5 120.22 26.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.617 -0.719 . . . . 10.0 110.28 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -85.9 81.72 8.43 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 703' ' ' ILE . . . . . 0.482 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.9 mm -60.98 -48.82 91.45 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.872 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 704' ' ' PRO . . . . . 0.482 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.9 Cg_exo -54.94 -49.12 17.73 Favored 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 122.091 1.861 . . . . 10.0 112.192 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -63.9 -43.18 97.91 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.89 -0.671 . . . . 10.0 112.223 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.517 ' O ' ' HG ' ' A' ' 710' ' ' LEU . 54.0 tp -63.94 -42.13 97.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.547 0.213 . . . . 10.0 110.847 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 707' ' ' GLN . . . . . 0.48 ' O ' ' HD3' ' A' ' 711' ' ' LYS . 9.3 mt-30 -62.03 -50.73 70.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.759 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.98 -36.17 78.74 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -62.31 -48.23 80.75 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.278 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 710' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 706' ' ' LEU . 88.0 mt -64.33 -34.69 78.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.787 0.327 . . . . 10.0 111.219 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 711' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 707' ' ' GLN . 8.6 mtpp -74.89 -14.91 60.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.261 -0.427 . . . . 10.0 112.125 -179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -110.15 -45.17 3.63 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.743 0.306 . . . . 10.0 111.618 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -73.06 -41.99 63.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.322 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -109.66 -8.51 14.95 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.988 -0.285 . . . . 10.0 111.7 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 715' ' ' ASP . . . . . 0.485 ' HB2' ' HA ' ' A' ' 828' ' ' LYS . 0.2 OUTLIER 61.64 29.74 18.3 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.098 179.741 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 36.7 tp -117.01 127.73 54.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.861 0.362 . . . . 10.0 110.721 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -90.1 106.38 18.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.39 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 41.7 mt -118.26 119.58 33.09 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.918 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.13 71.38 6.71 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.948 2.432 . . . . 10.0 112.254 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 58.0 mt -64.34 -42.37 95.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.843 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -63.38 -27.88 69.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.963 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -73.69 -47.24 41.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.309 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -66.7 -40.44 88.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.18 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 35.5 tp -58.94 -24.24 62.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.506 -0.77 . . . . 10.0 112.88 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.17 -28.95 13.87 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.814 0.302 . . . . 10.0 111.814 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -86.8 -36.82 18.32 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.178 0.436 . . . . 10.0 112.178 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -120.83 90.07 46.15 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-O 120.739 0.304 . . . . 10.0 110.916 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.31 -14.57 34.48 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.506 2.138 . . . . 10.0 111.663 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.17 -6.59 53.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.388 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 50.0 mt -68.79 -37.56 79.36 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.801 0.334 . . . . 10.0 110.458 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 54.57 -101.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.461 -0.791 . . . . 10.0 111.806 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.84 -55.35 0.77 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.322 . . . . 10.0 111.296 -178.497 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -56.4 -54.91 40.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.542 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 1.8 m -63.11 -28.61 70.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.996 0.426 . . . . 10.0 110.982 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 5.5 tp -65.24 -43.23 92.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 179.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -60.57 -46.92 88.41 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.441 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -58.44 -46.0 87.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.535 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 26.4 mmm-85 -56.92 -41.46 78.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.071 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 96.3 mt -66.9 -47.32 82.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.723 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 740' ' ' LEU . . . . . 0.54 HD21 ' HG2' ' A' ' 681' ' ' GLU . 60.1 tp -62.8 -51.4 67.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.815 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -60.49 -44.19 96.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.739 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -59.82 -35.62 75.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.626 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 20.3 m -69.16 -40.57 78.07 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.454 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 744' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 740' ' ' LEU . 76.3 mt -64.46 -38.59 82.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.312 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.18 -53.79 54.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.756 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 48.5 t -61.45 -37.29 77.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.422 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -60.63 -46.01 91.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.624 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -61.52 -39.84 92.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.847 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -62.1 -37.13 83.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.615 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -70.41 -39.56 74.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.096 0.474 . . . . 10.0 110.1 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 51.2 tt0 -59.89 -37.98 80.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.41 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -61.19 -24.61 66.44 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.888 0.329 . . . . 10.0 111.888 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 34.1 t -88.44 -46.08 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.84 0.352 . . . . 10.0 111.374 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.0 -39.17 50.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.91 0.386 . . . . 10.0 111.327 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.64 138.24 5.14 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.169 -0.772 . . . . 10.0 111.169 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 756' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -58.51 -60.63 3.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.86 0.362 . . . . 10.0 111.811 -178.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -66.71 -34.24 77.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.908 0.385 . . . . 10.0 110.74 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 8.4 tpt -63.68 -42.52 98.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.484 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 59.3 mmm -62.75 -41.72 99.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.331 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.3 mmp_? -58.2 -39.03 77.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.084 0.469 . . . . 10.0 110.3 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.89 -37.11 72.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.175 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -66.7 -48.81 68.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.024 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -58.42 -46.3 86.73 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.155 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 764' ' ' LYS . . . . . 0.471 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 79.2 tttt -59.48 -45.17 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.989 -0.551 . . . . 10.0 110.108 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.53 -43.28 99.25 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.758 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.1 -42.96 97.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.615 0.245 . . . . 10.0 110.416 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 31.3 mtp -61.43 -50.79 71.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.363 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 97.2 mt -61.04 -45.15 95.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.897 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -59.53 -52.18 66.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.025 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 13.5 m -58.6 -45.94 88.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.758 0.313 . . . . 10.0 111.024 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 771' ' ' LEU . . . . . 0.455 HD21 HG13 ' A' ' 659' ' ' ILE . 7.1 tt -62.11 -46.05 90.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.466 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -62.75 -45.67 91.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.094 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 15.7 m -63.44 -44.41 94.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.718 -0.674 . . . . 10.0 111.094 -179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 22.8 mt -65.73 -40.07 91.79 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.841 0.353 . . . . 10.0 110.838 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -59.9 -39.25 84.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.927 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 25.1 mttp -61.39 -48.67 80.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.289 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 12.6 tm-20 -65.87 -44.23 85.99 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -57.32 -33.5 67.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.471 -0.786 . . . . 10.0 111.426 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.6 mt -61.91 -53.67 52.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.745 0.307 . . . . 10.0 110.593 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -66.91 -40.31 87.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.801 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.04 -43.95 91.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.762 -0.654 . . . . 10.0 111.495 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 63.2 mmm -61.38 -49.25 77.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.427 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 783' ' ' ASP . . . . . 0.539 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 10.4 t70 -66.19 -39.11 89.43 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.924 -0.31 . . . . 10.0 111.099 -179.15 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -61.05 -34.52 75.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.87 0.367 . . . . 10.0 110.92 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.3 tp -79.52 -33.98 41.58 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 178.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -62.68 -40.77 98.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.921 -1.036 . . . . 10.0 110.999 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 787' ' ' GLN . . . . . 0.539 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 10.7 pt20 . . . . . 0 C--N 1.325 -0.482 0 CA-C-O 121.148 0.499 . . . . 10.0 110.474 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo . . . . . 0 C--O 1.233 0.266 0 CA-C-O 120.937 0.307 . . . . 10.0 112.074 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.76 154.56 33.91 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 74.87 -52.58 0.67 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.945 0.498 . . . . 10.0 109.786 -178.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -62.03 -51.37 68.27 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.157 -0.474 . . . . 10.0 109.955 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -62.31 -31.41 72.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.378 0.608 . . . . 10.0 109.972 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -67.4 -32.69 73.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.72 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 38.2 mtm105 -57.3 -47.52 81.28 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.251 0.548 . . . . 10.0 109.734 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.48 -43.69 76.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.389 -0.823 . . . . 10.0 110.756 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 17.2 m -60.29 -44.19 95.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.737 -0.665 . . . . 10.0 112.01 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -69.27 -43.17 74.45 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.159 -0.216 . . . . 10.0 110.89 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 19.4 m -61.73 -39.06 90.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.946 0.403 . . . . 10.0 110.261 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 37.4 ttm -64.01 -40.38 96.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.168 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -68.02 -40.35 82.95 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.387 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.19 91.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.369 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -63.03 -36.12 82.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.368 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 12.8 ttt -62.9 -45.47 92.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.446 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.9 -42.43 97.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.541 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -63.84 -37.39 87.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.432 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 37.4 m -72.3 -30.7 65.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.617 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 24.6 tp -56.97 -57.61 11.76 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.99 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 40.9 pttt -65.26 -32.48 74.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.959 0.409 . . . . 10.0 110.513 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -61.82 -58.4 8.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.934 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -62.9 -36.62 83.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.852 -178.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 39.9 t -61.58 -54.62 32.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 120.643 0.259 . . . . 10.0 110.655 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 41.1 mm -63.42 -38.99 83.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.698 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 40.7 t -60.23 -50.69 72.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.738 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 28.5 m -59.43 -45.76 90.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.703 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 92.8 mt -62.32 -24.86 67.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 10.0 112.047 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 6.6 m -94.59 -37.86 11.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.687 0.279 . . . . 10.0 111.403 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 828' ' ' LYS . . . . . 0.485 ' HA ' ' HB2' ' A' ' 715' ' ' ASP . 29.4 mtpp -69.29 -25.42 64.24 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.536 0.569 . . . . 10.0 112.536 -178.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.08 115.34 9.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.43 0.634 . . . . 10.0 110.404 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -100.97 140.15 35.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.898 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 C--N 1.324 -0.523 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.081 -179.804 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.6 t80 . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 120.892 0.377 . . . . 10.0 110.728 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 142.43 163.26 9.6 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.804 -0.713 . . . . 10.0 112.157 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.94 160.57 9.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.795 0.331 . . . . 10.0 110.692 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.566 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 3.9 mmp_? -77.05 146.52 37.26 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 60.63 -89.88 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.93 -1.032 . . . . 10.0 113.685 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -46.22 -62.9 1.14 Allowed 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.905 1.076 . . . . 10.0 113.905 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 16' ' ' ARG . 4.9 tpt180 -66.17 -31.67 72.66 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -178.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.403 ' O ' ' HG3' ' A' ' 21' ' ' MET . 0.2 OUTLIER -66.46 -48.77 68.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.726 0.298 . . . . 10.0 110.899 -179.835 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.92 -36.18 78.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.364 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -47.01 87.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.86 0.362 . . . . 10.0 110.375 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 20' ' ' ARG . 2.6 ttp85 -67.21 -33.85 76.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.095 0.474 . . . . 10.0 110.354 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.683 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 62.1 mtt -69.86 -37.4 76.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.334 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.7 tpp180 -62.07 -33.73 74.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.111 -0.495 . . . . 10.0 109.996 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -63.21 -41.14 99.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.766 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.6 t -68.2 -36.65 76.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.659 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.434 HG13 HD12 ' A' ' 88' ' ' LEU . 46.2 t -60.24 -37.59 74.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.078 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -62.55 -38.92 91.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.581 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.9 mt -68.12 -42.54 85.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.938 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 79.1 mt -60.78 -39.55 82.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.288 0.565 . . . . 10.0 109.843 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -67.86 -21.97 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.819 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -86.45 -23.1 26.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.58 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.9 mmt -84.77 -23.01 29.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.616 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.61 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 16.3 tt0 -55.84 -52.11 75.0 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 112.423 0.527 . . . . 10.0 112.423 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 75.8 Cg_exo -52.23 -37.41 70.24 Favored 'Trans proline' 0 C--N 1.361 1.195 0 C-N-CA 121.957 1.771 . . . . 10.0 112.399 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -72.32 -39.06 68.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.393 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 22.7 mmt -65.42 -39.29 91.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.593 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.61 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 28.7 mt-10 -63.92 -25.22 68.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.257 0.551 . . . . 10.0 110.06 178.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -82.33 -30.68 30.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.078 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.3 mp -73.25 148.42 43.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.474 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.6 p -75.45 167.42 21.93 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.387 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.9 -37.51 87.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.53 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -68.92 -32.52 72.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.511 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -66.37 -33.72 76.35 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.508 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.32 -46.12 88.15 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.7 ttpt -61.92 -34.13 75.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.08 -0.964 . . . . 10.0 109.481 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.06 -34.37 86.47 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.684 -0.689 . . . . 10.0 111.421 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -66.54 -36.2 82.09 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.024 -0.362 . . . . 10.0 110.024 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.7 m -61.7 -45.68 92.93 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.158 0.504 . . . . 10.0 109.647 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.11 -33.41 75.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.775 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -60.7 -47.7 85.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.292 -0.867 . . . . 10.0 110.284 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -61.42 -41.12 96.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.976 0.417 . . . . 10.0 109.979 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -59.06 -40.27 84.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.529 -0.759 . . . . 10.0 110.402 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -77.59 -36.47 51.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.368 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.42 HH12 ' CD ' ' A' ' 66' ' ' GLU . 63.2 mtp180 -64.68 -31.19 72.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.519 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.1 mt -60.4 -31.99 70.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.844 0.354 . . . . 10.0 110.8 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.5 -28.43 66.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.502 . . . . 10.0 110.479 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -76.23 -14.53 60.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.658 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 110.32 22.36 6.51 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.805 -0.712 . . . . 10.0 112.287 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -73.22 144.43 46.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.785 0.326 . . . . 10.0 110.153 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.0 t -86.86 136.72 22.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.164 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.42 HD11 ' O ' ' A' ' 118' ' ' LEU . 13.9 tp -62.34 -39.64 93.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.108 0.48 . . . . 10.0 110.1 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -69.87 -16.48 63.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.21 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -90.9 -15.3 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.403 0.62 . . . . 10.0 110.259 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.0 mt -86.42 -11.98 50.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.104 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.504 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 85.0 mt -50.38 -51.89 59.72 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 113.459 0.911 . . . . 10.0 113.459 -178.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.504 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 52.2 Cg_exo -53.12 -35.89 74.62 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 122.164 1.91 . . . . 10.0 113.488 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.488 ' O ' HG23 ' A' ' 70' ' ' VAL . 44.5 mt-10 -89.74 -45.45 9.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.724 0.297 . . . . 10.0 111.507 -179.027 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.496 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -60.1 -47.88 84.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.232 -0.44 . . . . 10.0 112.142 -178.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -64.12 -30.67 71.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.721 0.296 . . . . 10.0 110.67 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.13 -43.95 81.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 10.0 109.965 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 66' ' ' GLU . 47.5 t -61.33 -43.58 96.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.827 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 67' ' ' ALA . 45.9 t -62.01 -46.19 97.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.318 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.438 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 11.6 ttm180 -60.64 -41.54 95.14 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.18 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.511 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 18.9 tp10 -63.95 -50.87 66.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.575 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.49 -33.33 71.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.035 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 46.3 m -59.32 -42.82 92.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.282 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.511 ' HE2' ' HA ' ' A' ' 73' ' ' GLU . 40.1 mtmt -73.19 -16.98 61.41 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.299 0.481 . . . . 10.0 112.299 -178.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 -100.13 -37.13 9.08 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.993 -0.283 . . . . 10.0 111.636 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 85.5 t -82.96 -51.45 14.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 120.785 0.326 . . . . 10.0 111.796 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -99.71 -38.31 8.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.928 0.394 . . . . 10.0 111.206 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.39 4.43 49.95 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.94 -0.648 . . . . 10.0 111.517 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 63.9 mtt -111.26 138.13 48.11 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -90.48 135.32 33.77 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.857 0.36 . . . . 10.0 110.673 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.68 112.15 4.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.854 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -59.14 152.83 19.47 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.25 0.547 . . . . 10.0 111.778 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -61.82 -36.55 81.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.286 -0.87 . . . . 10.0 111.644 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.6 m -64.67 -31.62 54.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.06 0.457 . . . . 10.0 110.894 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -73.21 -27.9 61.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.281 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.434 HD12 HG13 ' A' ' 25' ' ' VAL . 97.7 mt -66.28 -33.88 76.73 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.718 -0.475 . . . . 10.0 109.718 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.91 -50.07 67.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.471 178.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -62.56 -32.5 83.48 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.317 -0.856 . . . . 10.0 112.066 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -60.21 -36.4 90.62 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 121.06 -0.591 . . . . 10.0 112.196 179.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.683 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 25.0 ttm -74.9 -36.15 62.23 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.4 t -64.41 -41.74 93.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.152 0.501 . . . . 10.0 109.958 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 91.4 mt -73.95 -4.43 35.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.672 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -91.43 -21.36 21.0 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.242 0.544 . . . . 10.0 109.948 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -105.47 -174.26 2.49 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.827 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -83.56 67.59 9.46 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.135 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 74.2 m -149.2 166.86 27.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.138 0.494 . . . . 10.0 111.731 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.586 HD12 HG11 ' A' ' 211' ' ' VAL . 35.8 mm -113.26 135.5 52.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.173 178.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -110.3 124.8 52.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.923 0.392 . . . . 10.0 111.824 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.31 129.26 36.56 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 108' ' ' LYS . 2.9 ttt -136.12 135.98 39.73 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.895 0.378 . . . . 10.0 111.082 -179.134 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.435 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 13.6 mmm180 -67.96 152.37 45.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.088 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.68 96.33 1.58 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.762 -0.653 . . . . 10.0 111.509 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 138.88 -15.5 3.31 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.382 -0.913 . . . . 10.0 113.537 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -84.23 27.22 0.7 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.978 0.362 . . . . 10.0 111.978 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.71 56.06 16.79 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.561 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.458 ' HA ' ' SD ' ' A' ' 102' ' ' MET . 50.6 tttm -55.38 -50.83 68.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.853 0.358 . . . . 10.0 111.745 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -24.65 63.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.947 0.403 . . . . 10.0 111.829 -179.154 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 21.2 tp -72.52 -31.64 65.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.867 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 19.0 m -71.41 -28.56 64.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.851 0.358 . . . . 10.0 111.7 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.81 66.13 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.771 1.026 . . . . 10.0 113.771 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 17.0 p -75.46 -22.39 57.32 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.319 0.489 . . . . 10.0 112.319 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 48.4 mt -68.26 -57.68 8.59 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 112.338 0.496 . . . . 10.0 112.338 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -64.63 -28.39 60.85 Favored 'Trans proline' 0 C--N 1.356 0.965 0 C-N-CA 122.055 1.837 . . . . 10.0 112.032 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.34 -49.26 67.54 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.458 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -62.43 -45.88 91.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.896 0.379 . . . . 10.0 110.685 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.42 ' O ' HD11 ' A' ' 60' ' ' LEU . 25.8 tp -59.45 -50.27 74.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.788 -0.642 . . . . 10.0 111.842 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -75.71 -19.13 59.3 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.897 0.332 . . . . 10.0 111.897 -178.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.7 -26.73 65.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.889 0.376 . . . . 10.0 110.942 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 47.6 mt -61.2 -23.02 65.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.561 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.2 p -69.74 -24.22 63.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.869 0.366 . . . . 10.0 110.831 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.35 9.7 81.49 Favored Glycine 0 C--N 1.333 0.389 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.656 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -86.59 -11.78 50.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.702 0.287 . . . . 10.0 111.525 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.08 110.84 2.6 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.5 -0.857 . . . . 10.0 113.834 178.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 62.1 t -84.59 114.56 25.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -93.11 104.07 16.3 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.943 0.402 . . . . 10.0 111.034 -178.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 39.2 t -93.48 123.9 45.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.204 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 96.3 t -105.2 121.92 57.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.993 -179.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 2.7 p -108.83 165.36 11.62 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.459 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 15.5 m -75.9 -29.83 20.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.85 0.357 . . . . 10.0 111.529 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -145.04 168.54 20.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.405 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.08 -23.09 63.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.166 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -58.73 -52.5 65.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.569 -0.741 . . . . 10.0 110.646 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 30.5 mt -69.47 -35.68 75.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.716 0.293 . . . . 10.0 110.461 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.43 -50.89 71.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.05 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.29 -36.41 61.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.018 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.44 HH21 ' CG ' ' A' ' 139' ' ' ASP . 5.9 ttp85 -56.33 -58.88 6.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.523 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ASP . . . . . 0.44 ' CG ' HH21 ' A' ' 138' ' ' ARG . 1.5 m-20 -69.36 -31.97 70.73 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.08 -0.509 . . . . 10.0 112.019 -178.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.493 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -60.87 -37.89 83.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.762 0.315 . . . . 10.0 111.214 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.2 mm-40 -91.59 -28.86 17.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.486 -0.325 . . . . 10.0 111.487 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -74.59 -43.86 53.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.827 0.346 . . . . 10.0 111.383 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 40.3 m-20 -88.41 -0.89 57.68 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.072 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 53.3 ttm-85 -61.69 -49.93 84.26 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.591 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' PRO . . . . . 0.47 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 17.2 Cg_exo -68.86 5.02 1.51 Allowed 'Trans proline' 0 C--N 1.361 1.218 0 C-N-CA 122.353 2.035 . . . . 10.0 112.504 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.6 tp -105.93 -52.45 2.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.726 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -73.86 -46.48 44.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.499 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.428 ' HA ' ' O ' ' A' ' 152' ' ' LEU . 82.3 mt-10 -68.91 -19.65 64.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.883 0.373 . . . . 10.0 111.047 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -73.39 -24.24 60.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.302 0.573 . . . . 10.0 109.556 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 71.4 mt -96.56 -11.18 25.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.938 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 114.99 -6.63 21.83 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.509 -0.853 . . . . 10.0 113.592 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 148' ' ' GLU . 92.4 mt -80.89 144.95 31.58 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.167 0.484 . . . . 10.0 110.733 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.1 p -95.39 133.15 39.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.508 -0.315 . . . . 10.0 111.108 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 35.2 t -108.97 130.73 61.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.441 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -124.98 145.53 15.74 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 111.665 -0.574 . . . . 10.0 111.665 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 4.2 tp -119.08 129.16 75.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.962 0.41 . . . . 10.0 110.511 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -114.26 112.67 23.48 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.162 -0.472 . . . . 10.0 109.999 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 49.3 mt -109.46 148.98 39.19 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.384 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' PRO . . . . . 0.486 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 19.0 Cg_endo -58.3 121.24 9.65 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.753 2.302 . . . . 10.0 112.539 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.2 6.74 62.79 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.928 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' MET . . . . . 0.449 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 44.2 ttm -67.31 139.07 94.56 Favored Pre-proline 0 C--N 1.325 -0.473 0 C-N-CA 122.049 0.14 . . . . 10.0 110.96 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 162' ' ' PRO . . . . . 0.408 ' HD2' ' HG3' ' A' ' 161' ' ' MET . 71.9 Cg_exo -52.69 147.32 31.65 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.885 2.39 . . . . 10.0 112.367 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 163' ' ' ALA . . . . . 0.459 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -54.47 -48.75 94.04 Favored Pre-proline 0 CA--C 1.54 0.563 0 N-CA-C 112.785 0.661 . . . . 10.0 112.785 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.459 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.8 Cg_exo -57.65 -42.33 61.36 Favored 'Trans proline' 0 C--N 1.358 1.062 0 C-N-CA 121.946 1.764 . . . . 10.0 112.346 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -64.96 -41.7 95.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.836 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.449 ' HE2' ' O ' ' A' ' 161' ' ' MET . 60.8 mttm -58.91 -43.5 91.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.137 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -58.13 -40.61 81.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.932 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -68.48 -40.65 80.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.682 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -65.86 -43.01 89.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.351 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 170' ' ' TYR . . . . . 0.431 ' HD2' ' O ' ' A' ' 166' ' ' LYS . 42.1 m-85 -74.34 -22.79 59.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.998 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.19 -14.37 59.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.654 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -71.58 173.14 8.43 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.305 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -74.72 -39.43 61.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.286 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.0 mp -127.61 121.35 56.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.883 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 6.4 m -112.36 111.98 23.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.847 0.356 . . . . 10.0 111.359 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -91.34 133.34 35.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.101 -0.5 . . . . 10.0 109.692 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -167.72 179.55 41.03 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.347 -0.93 . . . . 10.0 112.838 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.09 152.16 21.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.541 0.21 . . . . 10.0 110.549 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -60.47 -41.38 94.07 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.953 0.353 . . . . 10.0 111.953 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -56.46 -50.95 70.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.709 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.486 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 3.8 tp10 -70.71 -38.49 73.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.91 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -56.81 -39.44 74.17 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.861 0.363 . . . . 10.0 111.152 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -70.72 -44.33 57.18 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.821 -0.704 . . . . 10.0 112.242 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -67.17 -35.28 79.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.915 0.388 . . . . 10.0 110.738 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 185' ' ' ASP . . . . . 0.435 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 6.8 m-20 -59.16 -44.62 92.14 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.689 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -62.85 -38.22 89.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.466 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 187' ' ' LEU . . . . . 0.471 HD22 ' HB1' ' A' ' 373' ' ' ALA . 54.2 mt -62.65 -47.19 84.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.514 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 188' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 188' ' ' ARG . 42.4 mtm-85 -67.27 -40.7 86.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 10.0 110.491 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.11 -49.12 78.88 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.395 -0.821 . . . . 10.0 111.608 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.66 -3.6 47.98 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.784 -0.644 . . . . 10.0 112.656 -178.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 23.0 ttp -104.21 4.0 33.44 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.879 0.371 . . . . 10.0 110.966 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -69.72 174.01 5.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.82 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -109.34 -21.59 12.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.053 0.454 . . . . 10.0 110.601 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.05 142.33 45.2 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.871 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 195' ' ' PRO . . . . . 0.409 ' HD3' ' O ' ' A' ' 667' ' ' LEU . 13.2 Cg_endo -57.72 -30.18 88.19 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.811 2.341 . . . . 10.0 112.721 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -69.91 -17.5 63.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.963 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -83.14 -13.03 56.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.302 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -56.09 157.74 4.43 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.382 0.426 . . . . 10.0 111.426 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 8.2 m -128.57 -25.26 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.228 -0.442 . . . . 10.0 112.007 -179.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -92.77 -178.2 4.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.065 0.459 . . . . 10.0 111.361 -179.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -134.03 -178.2 4.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.765 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 17.4 ttmm -57.32 131.8 51.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.274 0.559 . . . . 10.0 111.593 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 12.5 mt -82.65 74.57 9.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.158 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -84.33 -63.45 1.34 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.94 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -128.3 137.28 51.88 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.065 0.459 . . . . 10.0 111.731 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.468 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -129.71 127.59 40.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.364 -0.835 . . . . 10.0 109.984 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 61.8 tp -119.79 108.9 14.96 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.08 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.3 p -98.75 131.26 46.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 CA-C-O 121.048 0.452 . . . . 10.0 110.776 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -59.05 -66.21 0.54 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.614 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 210' ' ' GLU . . . . . 0.521 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 34.3 tt0 -112.3 111.05 21.64 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.833 0.349 . . . . 10.0 110.577 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.586 HG11 HD12 ' A' ' 99' ' ' ILE . 34.3 m -82.34 -18.59 10.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.844 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 212' ' ' ASP . . . . . 0.418 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.0 OUTLIER -51.82 -57.49 9.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.173 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 213' ' ' SER . . . . . 0.408 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 4.9 p -88.61 -59.17 2.3 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.965 -0.561 . . . . 10.0 112.051 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 69.2 mt -52.73 -38.31 27.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 113.913 1.079 . . . . 10.0 113.913 -177.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 215' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 211' ' ' VAL . 8.0 mt -96.47 -53.79 3.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.933 0.716 . . . . 10.0 112.933 -178.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 216' ' ' ILE . . . . . 0.418 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 46.7 mm -75.91 -57.15 6.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 113.064 0.764 . . . . 10.0 113.064 -177.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 217' ' ' ASP . . . . . 0.408 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 67.0 m-20 -64.22 -42.7 96.48 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.035 0.383 . . . . 10.0 112.035 -178.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -90.09 16.65 8.04 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 -178.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.88 -38.69 91.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.883 0.373 . . . . 10.0 111.071 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 220' ' ' ARG . . . . . 0.412 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 3.5 mtp-105 -106.13 31.68 4.95 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.308 -0.406 . . . . 10.0 111.488 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 33.9 m -105.12 102.99 39.56 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 222' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 72.5 Cg_endo -94.95 129.38 0.48 Allowed 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.095 2.53 . . . . 10.0 113.473 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 223' ' ' LEU . . . . . 0.475 ' O ' ' HA ' ' A' ' 374' ' ' SER . 86.9 mt -82.91 110.87 18.27 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 77.0 mt -108.33 125.95 65.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 65.8 mt . . . . . 0 C--N 1.326 -0.434 0 N-CA-C 108.578 -0.897 . . . . 10.0 108.578 177.602 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 373' ' ' ALA . . . . . 0.471 ' HB1' HD22 ' A' ' 187' ' ' LEU . . . . . . . . 0 CA--C 1.52 -0.186 0 N-CA-C 110.638 -0.134 . . . . 10.0 110.638 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 374' ' ' SER . . . . . 0.475 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 41.6 m -155.13 135.59 13.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.495 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.415 ' HB ' HD21 ' A' ' 187' ' ' LEU . 18.9 tt -149.73 136.8 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.165 0.507 . . . . 10.0 110.62 178.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.64 143.73 26.45 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.855 -0.612 . . . . 10.0 109.715 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -55.5 -48.42 74.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.835 0.35 . . . . 10.0 110.522 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -57.59 -40.24 78.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.643 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 62.7 m-20 -73.99 -14.94 61.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.981 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -88.63 -42.53 11.96 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.319 -0.622 . . . . 10.0 109.319 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -70.05 -18.41 63.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.769 -0.651 . . . . 10.0 110.7 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -74.3 -11.39 60.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.407 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 43.1 mt -93.49 0.44 56.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.564 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 384' ' ' TYR . . . . . 0.468 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 26.1 m-85 -94.52 142.33 27.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.591 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -75.1 -61.51 1.87 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.196 0.522 . . . . 10.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -102.34 107.68 18.78 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 44.8 tp -120.72 120.02 34.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.971 -0.558 . . . . 10.0 109.911 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -143.04 166.49 24.49 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.524 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.89 173.92 46.06 Favored Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.083 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 13.6 mtm -110.93 146.88 35.8 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.707 0.289 . . . . 10.0 110.232 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 6.7 t -126.63 160.13 31.59 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -84.7 163.11 38.25 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.489 -0.863 . . . . 10.0 111.985 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 393' ' ' THR . . . . . 0.435 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 3.2 m -71.08 73.1 0.62 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.196 0.522 . . . . 10.0 110.482 179.214 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -135.44 -30.54 1.01 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.778 -0.646 . . . . 10.0 111.8 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 19.9 t70 61.51 -114.55 0.56 Allowed 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 14.0 m 65.52 -86.39 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.898 0.703 . . . . 10.0 112.898 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -84.03 30.51 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 10.0 111.456 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -58.13 -45.6 87.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.456 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -65.61 -23.15 66.76 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.628 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -75.86 -29.3 58.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.633 0.254 . . . . 10.0 110.443 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -60.02 -42.52 94.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.994 0.426 . . . . 10.0 110.524 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.4 m -81.84 -5.76 58.49 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.963 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 17.8 m -106.14 -40.85 5.52 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.855 -0.338 . . . . 10.0 111.795 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 53.9 mt -85.99 -46.31 16.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.554 -0.293 . . . . 10.0 111.593 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -108.51 -6.11 16.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.625 0.25 . . . . 10.0 111.316 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 58.96 44.76 15.98 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.017 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 407' ' ' LEU . . . . . 0.431 HD13 HD11 ' A' ' 99' ' ' ILE . 36.1 mt -112.02 138.13 49.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.776 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 408' ' ' ASP . . . . . 0.566 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 28.7 t0 -82.47 142.62 31.75 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.729 -0.471 . . . . 10.0 109.729 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 1.8 m -100.79 106.31 17.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.931 0.396 . . . . 10.0 111.487 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 83.9 t -107.05 132.81 53.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.205 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 60.2 t -96.76 126.55 49.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.52 -0.309 . . . . 10.0 110.398 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 44.8 t -95.73 131.56 29.06 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.548 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -65.17 154.42 73.56 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.645 2.23 . . . . 10.0 112.757 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.5 p -79.91 168.68 18.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.034 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -78.9 -33.41 45.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.436 0.636 . . . . 10.0 109.407 179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -124.22 151.07 65.39 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.401 -0.818 . . . . 10.0 109.557 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.68 110.4 1.44 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.502 2.135 . . . . 10.0 111.999 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 58.8 ttp -72.92 102.52 3.47 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.112 0.482 . . . . 10.0 110.545 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.8 pt -96.14 60.72 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.238 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 -86.25 128.53 34.92 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -93.81 97.97 10.77 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.832 0.348 . . . . 10.0 111.136 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -90.14 122.19 32.88 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.068 -0.715 . . . . 10.0 109.068 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 22.4 mt -104.65 150.78 38.95 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.734 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.98 141.77 98.65 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.945 2.43 . . . . 10.0 112.56 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -60.26 131.91 52.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.976 -0.557 . . . . 10.0 110.907 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.27 106.4 17.59 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.951 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 72.8 t -103.93 123.19 57.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.834 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 428' ' ' TYR . . . . . 0.434 ' HB3' ' HB2' ' A' ' 433' ' ' GLU . 2.5 m-85 -105.91 -175.18 2.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.625 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.54 -77.42 0.25 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.438 -0.505 . . . . 10.0 110.27 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 76.0 p -83.77 156.39 22.56 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.2 -0.296 . . . . 10.0 110.2 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -62.93 -27.07 69.13 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.024 -0.361 . . . . 10.0 110.024 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.12 -45.15 87.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.796 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 433' ' ' GLU . . . . . 0.434 ' HB2' ' HB3' ' A' ' 428' ' ' TYR . 18.8 mt-10 -65.73 -42.22 91.31 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.492 178.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -57.82 -51.59 68.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.803 -1.09 . . . . 10.0 111.344 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 45.7 mm -67.87 -38.46 80.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.682 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.82 -39.59 92.31 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.813 0.34 . . . . 10.0 110.459 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -61.57 -38.11 86.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.24 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 438' ' ' ILE . . . . . 0.427 HG23 HG21 ' A' ' 557' ' ' ILE . 84.4 mt -63.37 -44.46 99.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.648 178.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.99 -43.77 96.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.262 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -60.48 -43.04 97.37 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.44 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 441' ' ' ASP . . . . . 0.616 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 30.2 t70 -66.47 -42.93 86.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.108 179.252 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 75.3 mt -61.14 -39.36 82.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.451 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -59.07 -39.98 83.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.999 0.428 . . . . 10.0 110.44 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.25 -39.69 82.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.221 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.616 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 10.7 mmt180 -66.91 -46.73 73.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.246 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -36.41 82.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.883 0.373 . . . . 10.0 110.597 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.39 -32.9 74.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.33 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -89.89 -5.51 56.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.179 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 77.98 29.17 54.99 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.821 -0.704 . . . . 10.0 111.719 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 450' ' ' GLN . . . . . 0.557 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 62.4 tt0 -99.38 126.96 35.84 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-O 120.401 0.143 . . . . 10.0 111.015 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.15 142.62 56.42 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 122.592 2.195 . . . . 10.0 111.307 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 52.3 t -119.86 131.45 72.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.569 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 43.3 tp -120.18 104.25 9.93 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.396 -0.594 . . . . 10.0 109.396 178.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 32.2 t -90.23 124.07 42.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.789 -0.642 . . . . 10.0 110.256 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -104.37 81.58 0.34 Allowed Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.799 -0.715 . . . . 10.0 111.977 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.13 104.82 13.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.886 0.374 . . . . 10.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 33.9 pt -72.41 -21.52 20.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.194 0.521 . . . . 10.0 110.166 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 458' ' ' SER . . . . . 0.488 ' HB2' ' HB2' ' A' ' 461' ' ' LYS . 1.1 m -99.27 118.98 37.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.483 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 57.2 mt -59.09 -41.35 83.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.945 0.402 . . . . 10.0 111.865 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 27.6 mp0 -63.93 -24.63 67.8 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.186 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 458' ' ' SER . 0.1 OUTLIER -77.69 -31.42 52.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.426 -0.352 . . . . 10.0 110.607 -179.488 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 49.1 m -60.49 -38.91 85.82 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.126 0.488 . . . . 10.0 109.939 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.46 -42.98 82.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.342 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 55.1 tp -64.13 -52.1 60.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.663 -0.698 . . . . 10.0 111.498 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.0 -30.34 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 120.672 0.272 . . . . 10.0 111.013 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 9.1 t -66.75 -40.97 88.48 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.053 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.36 -47.02 83.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.121 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -60.97 -40.49 93.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.141 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 17.0 mt -65.92 -35.81 81.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.951 0.405 . . . . 10.0 110.586 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.0 m -75.04 -33.83 61.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.091 0.472 . . . . 10.0 109.803 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -64.4 -41.17 96.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.111 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -75.86 -31.51 59.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.306 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 94.82 41.38 4.12 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.014 -0.613 . . . . 10.0 112.497 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 35.1 mt -110.53 137.81 41.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 CA-C-O 120.664 0.269 . . . . 10.0 110.999 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -61.57 134.98 57.46 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.477 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -163.68 156.47 18.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.78 0.324 . . . . 10.0 111.177 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -140.33 133.36 29.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 478' ' ' VAL . . . . . 0.559 HG22 HD12 ' A' ' 502' ' ' ILE . 20.1 t -105.0 133.69 48.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.857 0.36 . . . . 10.0 111.426 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.428 ' HB3' ' OE2' ' A' ' 487' ' ' GLU . 80.0 mt -84.93 138.83 32.26 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -144.34 135.94 25.79 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.293 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -59.2 -24.32 63.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 10.0 112.018 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -78.7 -9.27 59.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.605 0.24 . . . . 10.0 110.963 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 483' ' ' PHE . . . . . 0.49 ' O ' ' HG3' ' A' ' 487' ' ' GLU . 59.2 m-85 -131.79 49.95 2.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.992 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 484' ' ' HIS . . . . . 0.447 ' HA ' ' OE1' ' A' ' 487' ' ' GLU . 3.3 m80 -57.46 -33.64 68.16 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.912 0.387 . . . . 10.0 111.26 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.92 -33.57 76.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.103 0.478 . . . . 10.0 110.468 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -77.83 -36.68 49.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.647 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 487' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' A' ' 483' ' ' PHE . 49.4 mt-10 -59.29 -39.01 81.64 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.661 -0.7 . . . . 10.0 110.523 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -59.61 -27.13 66.05 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.297 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -88.51 -38.24 15.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.861 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.87 -48.09 72.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.393 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 81.3 t -60.63 -30.95 47.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.828 0.347 . . . . 10.0 111.062 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -61.83 -28.37 69.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.312 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -120.36 21.58 11.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.824 0.345 . . . . 10.0 110.846 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -67.71 -20.03 65.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.996 0.427 . . . . 10.0 110.911 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -98.01 11.97 64.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.876 -0.678 . . . . 10.0 112.068 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -73.39 140.13 79.03 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 110.088 -0.338 . . . . 10.0 110.088 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -52.3 123.16 12.04 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.701 2.267 . . . . 10.0 113.047 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 73.68 15.99 3.94 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 123.948 0.78 . . . . 10.0 112.921 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -91.56 119.88 31.88 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.567 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 40.2 t -100.15 107.99 22.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.067 0.461 . . . . 10.0 110.374 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 8.0 m -107.39 129.84 54.87 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.528 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 502' ' ' ILE . . . . . 0.559 HD12 HG22 ' A' ' 478' ' ' VAL . 61.1 mt -109.54 114.18 46.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.219 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -97.37 114.93 26.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.817 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 16.0 m -86.48 112.45 21.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.203 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 65.8 t30 58.75 77.18 0.31 Allowed 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.667 0.604 . . . . 10.0 111.204 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.35 141.11 55.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.942 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -91.66 -171.09 2.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.404 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -75.73 153.8 44.5 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.695 -0.764 . . . . 10.0 112.475 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.521 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 59.2 mtt180 66.6 -80.83 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.293 0.637 . . . . 10.0 112.104 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.57 144.76 13.65 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.114 -0.565 . . . . 10.0 111.928 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.03 154.13 41.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.63 0.252 . . . . 10.0 111.206 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -75.71 120.58 21.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.883 0.373 . . . . 10.0 110.961 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 93.4 mt -99.58 108.76 23.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.788 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 6.8 t -78.79 131.07 35.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.92 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 48.9 mt -65.85 127.38 31.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.321 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 95.97 -9.44 68.05 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.084 -0.579 . . . . 10.0 111.672 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 113.72 -176.67 17.39 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.864 -0.894 . . . . 10.0 110.864 -179.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 5.3 p -121.75 93.37 3.98 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.147 0.498 . . . . 10.0 110.642 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 17.9 p-90 -60.35 -27.04 67.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.443 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -62.5 -36.37 82.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.226 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.36 -35.15 35.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.061 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 522' ' ' GLU . . . . . 0.413 ' O ' ' HG ' ' A' ' 526' ' ' LEU . 47.8 mt-10 -62.62 -44.96 94.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.822 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 28.1 m -71.65 -25.95 25.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-O 120.994 0.426 . . . . 10.0 110.809 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -73.7 -25.51 60.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.151 0.5 . . . . 10.0 110.171 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -87.18 -0.83 57.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.491 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 522' ' ' GLU . 88.4 mt -84.24 148.57 26.64 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.886 0.374 . . . . 10.0 111.21 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -69.3 -39.92 77.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.9 -0.591 . . . . 10.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -152.85 88.66 3.85 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.21 104.11 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.057 2.504 . . . . 10.0 112.359 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.17 148.71 29.43 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.722 -0.672 . . . . 10.0 109.875 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -52.41 -50.85 61.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.951 0.405 . . . . 10.0 111.669 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 51.0 mp0 -64.69 -31.87 73.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.629 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -68.99 -44.09 73.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.029 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 79.1 mt -61.59 -42.72 95.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.183 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -61.21 -42.06 97.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.378 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -63.57 -47.33 81.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.552 . . . . 10.0 110.167 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 61.2 mt -63.95 -37.51 79.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.254 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -61.78 -43.29 99.15 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -68.63 -43.43 76.37 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.449 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.67 -47.18 86.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.582 -0.736 . . . . 10.0 109.868 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 61.3 t90 -63.83 -39.5 94.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.335 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -54.04 -48.46 70.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.579 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 39.0 t -61.85 -43.88 98.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.607 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -65.72 -44.11 87.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.95 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -58.94 -50.86 72.47 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.373 -0.83 . . . . 10.0 111.167 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.49 -24.02 63.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.347 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -67.48 -36.82 81.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.273 0.559 . . . . 10.0 109.716 178.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.16 -32.06 55.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.549 -0.75 . . . . 10.0 110.008 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 84.3 mt -64.33 -39.95 94.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.188 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -69.97 -36.26 75.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.918 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 551' ' ' ALA . . . . . 0.557 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -64.94 -49.16 71.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.465 -0.789 . . . . 10.0 110.793 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 141.42 23.43 0.24 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.399 -0.905 . . . . 10.0 113.609 179.179 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 74.47 -166.78 54.81 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.502 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 30.5 tp -75.44 125.84 29.81 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.17 -0.307 . . . . 10.0 110.17 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -98.53 110.61 23.18 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.391 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 27.4 mm -90.24 133.89 30.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.818 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 557' ' ' ILE . . . . . 0.427 HG21 HG23 ' A' ' 438' ' ' ILE . 14.0 mt -124.82 121.34 60.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.264 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -107.42 134.29 12.12 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.834 -0.698 . . . . 10.0 111.496 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 17.3 p -92.57 -57.32 2.71 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.112 0.482 . . . . 10.0 111.362 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -114.31 133.05 55.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.438 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 561' ' ' ARG . . . . . 0.523 ' H ' HD21 ' A' ' 588' ' ' LEU . 16.6 mmt180 -77.36 134.62 38.42 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 178.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -78.26 139.4 38.89 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.201 -0.296 . . . . 10.0 110.201 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -57.14 -48.09 79.52 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 564' ' ' SER . . . . . 0.468 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.3 OUTLIER -77.53 114.94 16.88 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.186 178.121 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -65.8 -24.08 66.84 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.535 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -61.42 -48.86 79.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.961 0.41 . . . . 10.0 110.463 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 69.0 mt -75.83 -34.83 28.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.118 0.485 . . . . 10.0 110.205 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -63.31 -41.1 98.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.35 -0.841 . . . . 10.0 110.621 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -75.59 -35.27 60.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.831 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -62.68 -27.42 69.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.909 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 20.4 tp -71.35 -28.59 64.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.1 0.476 . . . . 10.0 110.218 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -81.25 -30.43 34.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.248 0.547 . . . . 10.0 109.905 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.34 7.41 17.88 Favored Glycine 0 CA--C 1.52 0.382 0 CA-C-N 115.627 -0.715 . . . . 10.0 113.446 -179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -74.16 -30.59 62.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.988 0.394 . . . . 10.0 109.989 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 2.4 t -93.65 162.96 13.73 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.191 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 66.46 51.98 38.64 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.869 -0.681 . . . . 10.0 112.161 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -88.71 146.24 25.17 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.266 -0.272 . . . . 10.0 110.266 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 60.61 20.51 10.4 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 123.544 0.528 . . . . 10.0 110.438 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 75.5 40.4 32.79 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.995 -0.548 . . . . 10.0 112.641 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.33 -163.72 1.01 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.73 0.265 . . . . 10.0 110.963 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -92.33 177.32 6.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.266 0.555 . . . . 10.0 111.981 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 153.42 173.51 22.71 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.583 -0.735 . . . . 10.0 111.664 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 2.6 p -146.96 148.45 31.76 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.005 -0.369 . . . . 10.0 110.005 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.6 137.42 31.89 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.621 0.248 . . . . 10.0 111.137 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -158.91 147.88 18.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.735 178.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -115.19 147.62 40.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.266 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -130.02 111.62 12.68 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 588' ' ' LEU . . . . . 0.523 HD21 ' H ' ' A' ' 561' ' ' ARG . 4.9 mp -122.18 179.39 4.56 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.115 0.483 . . . . 10.0 111.594 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 51.9 p -132.3 179.91 5.83 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.059 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 71.4 mmm -83.46 -8.32 59.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.857 0.361 . . . . 10.0 111.151 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.12 9.74 40.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.196 0.522 . . . . 10.0 110.062 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.67 149.2 38.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.659 -0.7 . . . . 10.0 110.533 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -59.94 -28.17 67.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.164 -0.471 . . . . 10.0 111.603 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 594' ' ' LEU . . . . . 0.654 ' O ' HG12 ' A' ' 597' ' ' ILE . 7.2 tp -63.8 -26.41 68.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.415 -179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 22.4 mmt -77.44 -2.74 36.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.875 0.369 . . . . 10.0 111.286 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -101.92 -1.51 31.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.231 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 597' ' ' ILE . . . . . 0.654 HG12 ' O ' ' A' ' 594' ' ' LEU . 16.6 pt -94.36 4.6 8.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.965 0.412 . . . . 10.0 110.807 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -86.17 19.76 2.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.953 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.44 -59.29 0.55 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.733 0.813 . . . . 10.0 111.997 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 1.7 m -122.1 139.28 53.91 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.304 -0.258 . . . . 10.0 110.304 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -64.93 -26.16 68.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.09 0.471 . . . . 10.0 110.336 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.2 -32.56 70.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.461 179.35 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.8 t -67.35 -45.56 85.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.67 -0.492 . . . . 10.0 109.67 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.01 -22.97 63.06 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.404 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -59.92 -25.95 62.42 Favored Glycine 0 C--N 1.332 0.331 0 CA-C-N 115.912 -0.585 . . . . 10.0 112.715 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -65.41 -18.55 65.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.666 0.269 . . . . 10.0 111.047 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -94.99 -14.57 24.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.907 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -69.01 -30.42 68.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.893 0.378 . . . . 10.0 110.747 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm -98.28 30.2 3.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.912 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 38.8 tp -84.99 -8.47 58.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.618 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 91.42 -57.01 3.13 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.711 -0.756 . . . . 10.0 111.808 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 69.88 -69.26 0.17 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.352 0.661 . . . . 10.0 111.795 179.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp 66.57 93.58 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.277 0 O-C-N 123.563 0.539 . . . . 10.0 110.858 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 614' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.29 101.94 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.96 2.44 . . . . 10.0 112.472 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 123.18 -18.81 7.81 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.036 -0.602 . . . . 10.0 111.86 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -98.55 136.96 37.9 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.123 -0.325 . . . . 10.0 110.123 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -80.45 104.9 11.3 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.331 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -61.8 -35.9 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.046 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 40.22 65.91 0.68 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.72 0.808 . . . . 10.0 112.942 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -117.77 108.97 42.02 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.44 -23.2 44.22 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 123.062 2.508 . . . . 10.0 114.447 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 65.6 p-90 -68.13 -18.93 64.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.749 -0.38 . . . . 10.0 111.433 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 87.5 t -64.5 -49.29 81.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.05 -33.68 75.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.616 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -69.14 -44.72 71.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.51 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -63.17 -43.57 97.87 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.591 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 89.8 mt -63.51 -44.78 98.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.559 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -61.32 -37.58 83.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.988 0.423 . . . . 10.0 110.677 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -66.13 -45.56 80.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.042 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -62.89 -45.71 91.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.638 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 631' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 635' ' ' GLU . 44.1 mt-30 -60.64 -48.63 80.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.778 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -60.92 -34.2 74.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.189 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -64.71 -42.57 95.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.998 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 634' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 637' ' ' ARG . 70.1 t -62.81 -42.39 96.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.025 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.602 ' HA ' ' ND2' ' A' ' 638' ' ' ASN . 4.5 mm-40 -68.26 -28.98 67.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.743 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 51.1 m -67.37 -28.47 67.98 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.461 0.648 . . . . 10.0 109.339 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 637' ' ' ARG . . . . . 0.506 ' HB3' ' O ' ' A' ' 634' ' ' VAL . 16.8 ttp180 -67.31 -38.18 84.55 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.137 -0.938 . . . . 10.0 109.64 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 638' ' ' ASN . . . . . 0.602 ' ND2' ' HA ' ' A' ' 635' ' ' GLU . 12.2 m-20 -60.26 -45.42 93.34 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.579 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -57.53 -46.02 84.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.125 -0.943 . . . . 10.0 111.533 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.51 -43.81 98.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.618 0.247 . . . . 10.0 110.801 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 73.9 mt -64.57 -46.81 91.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.372 -0.377 . . . . 10.0 110.275 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 642' ' ' ARG . . . . . 0.444 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 12.2 mtm-85 -61.1 -42.41 98.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.061 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -58.05 -44.13 87.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.602 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.42 -44.88 95.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.621 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 71.7 mt -66.54 -40.76 89.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.005 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 646' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' A' ' 650' ' ' ASP . 82.6 mt -61.68 -27.92 69.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.115 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -69.0 -20.69 64.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.96 0.41 . . . . 10.0 110.682 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -101.52 -39.7 7.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.658 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -67.19 -34.21 77.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.653 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 650' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 4.4 t0 -65.94 -26.93 67.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.91 0.386 . . . . 10.0 111.153 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 24.3 t -63.07 -44.47 99.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.158 0.504 . . . . 10.0 110.1 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -71.7 -29.13 64.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.701 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -66.91 -46.68 74.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.379 -0.828 . . . . 10.0 110.43 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -57.23 -48.71 78.14 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.516 0.51 . . . . 10.0 110.533 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 655' ' ' GLN . . . . . 0.453 HE22 ' HB2' ' A' ' 807' ' ' SER . 74.2 mt-30 -62.23 -42.53 99.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.792 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 9.8 ttp-105 -63.31 -42.58 99.03 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 120.974 0.416 . . . . 10.0 109.984 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 46.1 ttp180 -59.87 -47.09 87.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.769 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -66.37 -46.66 75.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.046 -179.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 659' ' ' ILE . . . . . 0.41 HD12 ' HA ' ' A' ' 659' ' ' ILE . 10.1 tp -69.07 -33.47 58.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 121.126 -0.23 . . . . 10.0 111.61 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -68.11 -31.42 71.0 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.182 -0.303 . . . . 10.0 110.182 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.3 m -67.55 -45.87 74.4 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.769 -0.456 . . . . 10.0 109.769 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -65.58 -44.84 85.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.442 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -61.27 -37.14 82.09 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.35 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -73.98 -35.94 64.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.203 -0.453 . . . . 10.0 111.19 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -63.5 -49.25 74.31 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.688 -0.486 . . . . 10.0 109.688 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 666' ' ' LEU . . . . . 0.451 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 88.1 mt -59.76 -28.98 67.86 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.169 0.509 . . . . 10.0 110.282 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.409 ' O ' ' HD3' ' A' ' 195' ' ' PRO . 0.9 OUTLIER -74.73 -46.56 36.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.507 -0.77 . . . . 10.0 110.594 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.68 -49.34 59.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.757 -0.656 . . . . 10.0 112.051 -178.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 9.8 m -73.28 150.94 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.065 0.459 . . . . 10.0 111.055 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 11.1 m -101.92 -36.8 8.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.238 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -79.96 90.18 5.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.866 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 672' ' ' VAL . . . . . 0.498 ' O ' HG12 ' A' ' 676' ' ' ILE . 9.6 p -92.87 -9.97 9.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.543 0.687 . . . . 10.0 109.477 178.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.63 -42.35 67.67 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 114.829 -1.078 . . . . 10.0 111.838 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -56.22 -51.44 68.07 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.341 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 675' ' ' THR . . . . . 0.487 ' O ' HG12 ' A' ' 679' ' ' ILE . 2.4 m -60.94 -45.81 93.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.084 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 676' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 672' ' ' VAL . 48.1 mm -55.13 -47.32 77.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.474 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -70.65 -39.72 73.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.586 -0.279 . . . . 10.0 111.436 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 50.0 m -60.99 -46.58 90.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.47 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 679' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 675' ' ' THR . 38.0 pt -76.24 -21.22 15.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.234 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 23.5 ttm-85 -60.01 -46.91 87.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.799 0.333 . . . . 10.0 110.77 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -62.28 -45.16 94.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.64 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -62.05 -52.01 65.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.592 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 683' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 679' ' ' ILE . 88.7 t -57.81 -45.36 87.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.236 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -63.79 -46.04 86.99 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.929 -0.308 . . . . 10.0 110.592 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -61.38 -47.68 84.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.667 -0.242 . . . . 10.0 110.704 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.25 -39.24 78.65 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.195 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 26.8 m -69.42 -39.09 78.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.428 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -67.97 -46.96 80.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.545 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 689' ' ' ASP . . . . . 0.498 ' HA ' ' O ' ' A' ' 692' ' ' ILE . 85.4 m-20 -59.81 -20.84 59.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.959 -178.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -69.46 -41.87 75.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.505 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -105.47 -14.62 15.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.947 0.403 . . . . 10.0 111.489 -179.03 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 692' ' ' ILE . . . . . 0.502 HG23 ' CD1' ' A' ' 701' ' ' TRP . 35.3 mt -132.67 97.66 17.12 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.678 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.12 130.76 37.83 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.333 2.022 . . . . 10.0 111.389 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 694' ' ' PRO . . . . . 0.46 ' HA ' ' NH2' ' A' ' 736' ' ' ARG . 12.1 Cg_endo -56.1 118.44 5.23 Favored 'Trans proline' 0 C--O 1.238 0.499 0 C-N-CA 122.614 2.209 . . . . 10.0 112.508 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 62.12 72.09 0.51 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.438 -0.801 . . . . 10.0 111.257 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 52.0 p -141.84 -167.38 2.43 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.994 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 78.8 mt -83.58 142.79 30.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.473 -0.331 . . . . 10.0 110.578 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 698' ' ' GLU . . . . . 0.505 ' HA ' ' CD2' ' A' ' 701' ' ' TRP . 24.5 tt0 -61.11 -26.32 67.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.212 0.53 . . . . 10.0 111.153 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -71.08 -16.39 62.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.905 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 14.6 mmt -97.35 6.3 48.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.657 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 701' ' ' TRP . . . . . 0.505 ' CD2' ' HA ' ' A' ' 698' ' ' GLU . 49.7 m0 -98.49 114.5 26.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.088 -178.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -86.15 77.74 9.52 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.511 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 703' ' ' ILE . . . . . 0.497 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 36.9 mm -53.52 -48.75 91.86 Favored Pre-proline 0 CA--C 1.537 0.459 0 CA-C-N 115.193 -0.912 . . . . 10.0 112.13 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 704' ' ' PRO . . . . . 0.497 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 47.6 Cg_exo -56.44 -37.4 97.26 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 121.805 1.67 . . . . 10.0 112.303 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -69.45 -40.26 79.35 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 121.246 -0.502 . . . . 10.0 112.344 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 37.8 tp -67.15 -44.59 79.43 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -63.65 -37.2 86.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.966 -0.561 . . . . 10.0 109.926 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.93 -48.49 75.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.516 -0.765 . . . . 10.0 110.611 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -74.77 -34.84 62.53 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.869 -0.605 . . . . 10.0 111.664 -178.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 51.3 mt -68.14 -50.77 52.51 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.729 0.27 . . . . 10.0 111.729 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -66.38 -31.84 72.86 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.028 0.381 . . . . 10.0 112.028 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -87.7 -71.19 0.58 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.748 0.647 . . . . 10.0 112.748 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.28 -58.53 6.83 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.214 0.82 . . . . 10.0 113.214 -176.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -79.06 -11.8 60.0 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.478 0.918 . . . . 10.0 113.478 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 2.2 t70 63.13 24.59 14.5 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.537 0.684 . . . . 10.0 110.051 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 716' ' ' LEU . . . . . 0.438 ' HG ' ' HG ' ' A' ' 718' ' ' LEU . 18.9 tp -104.71 98.74 8.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.34 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -82.99 97.16 8.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.124 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.438 ' HG ' ' HG ' ' A' ' 716' ' ' LEU . 80.3 mt -129.12 119.75 19.87 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.074 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 719' ' ' PRO . . . . . 0.425 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 92.2 Cg_endo -82.09 79.06 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.627 2.218 . . . . 10.0 111.399 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 720' ' ' ILE . . . . . 0.404 HG23 HD11 ' A' ' 735' ' ' LEU . 57.9 mt -60.96 -39.29 81.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.51 -179.116 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -66.04 -13.97 60.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.103 0.478 . . . . 10.0 111.162 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 722' ' ' GLU . . . . . 0.498 ' O ' ' HD2' ' A' ' 726' ' ' LYS . 4.4 tp10 -92.96 -10.4 36.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.701 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 45.2 m0 -96.97 -48.62 5.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.745 0.307 . . . . 10.0 111.643 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 63.2 mt -56.78 -22.63 37.4 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.269 0.84 . . . . 10.0 113.269 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.47 -19.75 21.69 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.794 0.294 . . . . 10.0 111.794 -179.259 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 726' ' ' LYS . . . . . 0.498 ' HD2' ' O ' ' A' ' 722' ' ' GLU . 36.3 mttp -99.93 -38.43 8.61 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.702 0.26 . . . . 10.0 111.702 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -128.74 86.41 57.62 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-O 121.162 0.506 . . . . 10.0 110.796 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -65.93 -13.27 39.08 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.925 2.417 . . . . 10.0 111.749 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 40.2 mp0 -66.02 -15.2 62.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.344 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 35.6 mt -71.74 -40.24 69.51 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 110.078 -0.341 . . . . 10.0 110.078 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 53.35 -88.27 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.053 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -144.31 -49.94 0.28 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.901 -0.32 . . . . 10.0 111.817 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -59.25 -58.89 6.66 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.781 0.325 . . . . 10.0 110.688 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.0 -26.35 68.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.554 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 735' ' ' LEU . . . . . 0.404 HD11 HG23 ' A' ' 720' ' ' ILE . 27.7 tp -65.57 -47.45 75.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.58 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 736' ' ' ARG . . . . . 0.46 ' NH2' ' HA ' ' A' ' 694' ' ' PRO . 73.8 mtt-85 -64.87 -44.9 88.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.266 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -57.08 -40.34 76.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.359 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 15.3 mmm-85 -61.25 -40.19 93.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.937 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 79.6 mt -64.99 -43.71 96.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.399 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 52.1 tp -71.02 -37.45 72.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.415 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -66.87 -40.89 87.99 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.984 0.421 . . . . 10.0 110.599 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 742' ' ' GLN . . . . . 0.414 ' O ' HG23 ' A' ' 746' ' ' VAL . 2.2 tp60 -66.67 -36.08 81.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.361 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.44 -41.57 88.96 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 82.1 mt -65.8 -35.87 76.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 178.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.19 -55.28 26.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.98 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 749' ' ' ARG . 88.1 t -58.24 -35.87 55.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.328 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -59.24 -51.01 71.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.304 179.115 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -64.5 -38.2 90.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.617 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 749' ' ' ARG . . . . . 0.415 ' HD3' ' HA ' ' A' ' 746' ' ' VAL . 77.2 mtp180 -61.07 -36.75 80.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.403 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -80.34 -36.93 33.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.589 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -60.32 -42.84 96.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.597 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -65.22 -12.63 53.36 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 84.3 t -79.58 -43.34 23.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.725 0.298 . . . . 10.0 111.326 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 15.1 m -99.54 -20.21 5.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 112.066 0.395 . . . . 10.0 112.066 -179.013 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 110.04 144.35 10.23 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.707 -0.759 . . . . 10.0 112.002 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 756' ' ' ALA . . . . . 0.44 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -60.16 -43.75 95.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.732 0.301 . . . . 10.0 110.899 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -58.99 -43.72 91.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.843 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.9 tpt -65.2 -44.25 88.96 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.383 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 50.9 mmm -63.02 -46.95 85.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.621 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -56.48 -39.73 73.72 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.916 0.389 . . . . 10.0 110.8 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -70.94 -40.8 71.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.142 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -63.69 -44.31 94.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.869 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -57.35 -45.47 84.31 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.028 0.442 . . . . 10.0 110.503 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 764' ' ' LYS . . . . . 0.451 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 72.4 tttt -62.17 -45.47 93.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.005 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -61.72 -44.18 98.26 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.833 -0.621 . . . . 10.0 112.309 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 65.3 t -63.47 -44.59 98.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.392 0.139 . . . . 10.0 110.906 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.69 -49.05 77.79 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.838 0.351 . . . . 10.0 110.583 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 73.3 mt -64.85 -39.93 94.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.15 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -58.89 -57.57 12.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.199 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 770' ' ' THR . . . . . 0.489 HG21 ' HB3' ' A' ' 821' ' ' GLU . 17.1 m -60.4 -41.05 93.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.369 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.45 -47.15 85.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.924 0.393 . . . . 10.0 109.991 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 772' ' ' ASP . . . . . 0.461 ' O ' ' HD3' ' A' ' 776' ' ' LYS . 9.9 t70 -64.82 -41.67 95.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.773 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 23.2 m -62.04 -45.03 95.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.129 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 35.8 mt -69.53 -32.34 71.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.737 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -63.1 -40.01 96.39 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 772' ' ' ASP . 14.4 mptt -63.2 -42.79 99.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.861 -0.608 . . . . 10.0 110.268 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 14.2 tm-20 -65.58 -49.5 68.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.712 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 778' ' ' HIS . . . . . 0.535 ' O ' ' HG2' ' A' ' 782' ' ' MET . 43.3 t60 -58.48 -34.23 70.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.339 -0.846 . . . . 10.0 111.276 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.5 mt -62.08 -42.12 98.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.882 0.372 . . . . 10.0 110.275 179.22 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -73.05 -41.45 64.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.447 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.18 -32.01 71.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.695 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 782' ' ' MET . . . . . 0.535 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 84.8 mmm -62.68 -35.2 78.89 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.08 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -63.25 -50.55 69.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.854 0.359 . . . . 10.0 110.086 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -62.13 -27.07 68.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.24 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 9.5 mt -75.21 -45.86 37.64 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.28 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -60.69 -51.96 67.15 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.628 -179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.235 0.333 0 CA-C-O 120.778 0.323 . . . . 10.0 110.375 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo . . . . . 0 CA--C 1.533 0.448 0 N-CA-C 112.869 0.296 . . . . 10.0 112.869 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 800' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 801' ' ' GLN . 34.3 mtmm -79.59 162.58 25.24 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 801' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 800' ' ' LYS . 8.4 mm100 72.62 -53.53 0.7 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.536 0.522 . . . . 10.0 110.803 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -59.92 -47.87 84.03 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -54.91 -35.51 64.23 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.738 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -69.3 -47.01 65.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.373 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -61.16 -41.35 96.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.538 -0.301 . . . . 10.0 111.026 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.82 -51.05 68.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.266 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 807' ' ' SER . . . . . 0.453 ' HB2' HE22 ' A' ' 655' ' ' GLN . 6.2 p -67.6 -38.71 84.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.395 -0.366 . . . . 10.0 111.742 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -63.34 -34.23 77.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.538 0.209 . . . . 10.0 110.814 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 57.9 m -62.53 -38.41 89.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.138 0.494 . . . . 10.0 110.19 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 46.8 ttm -71.95 -34.14 68.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.112 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -62.63 -41.28 98.92 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.539 -0.541 . . . . 10.0 109.539 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -66.21 -44.33 84.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.166 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -64.16 -32.09 73.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.5 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 28.7 ttp -63.18 -41.88 99.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.467 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 49.1 mt -68.06 -35.55 78.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.915 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -65.13 -45.3 85.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.059 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 7.3 m -71.75 -27.95 63.32 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.002 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 29.4 tp -54.76 -58.81 6.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.348 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 12.9 pttp -67.99 -26.35 65.87 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.348 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -61.17 -48.25 82.44 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.862 0.363 . . . . 10.0 110.364 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 821' ' ' GLU . . . . . 0.489 ' HB3' HG21 ' A' ' 770' ' ' THR . 0.8 OUTLIER -70.83 -46.69 62.3 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.332 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 54.1 t -51.08 -52.52 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.807 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 823' ' ' ILE . . . . . 0.444 HD11 HG13 ' A' ' 679' ' ' ILE . 27.8 mm -64.65 -43.79 96.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.591 -0.277 . . . . 10.0 111.427 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 30.9 m -62.88 -45.9 90.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.735 0.302 . . . . 10.0 110.859 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 95.1 m -61.61 -41.87 98.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.606 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 57.0 mt -71.96 -37.19 69.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.433 -0.348 . . . . 10.0 111.816 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 15.6 m -75.41 -32.83 60.87 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.81 0.338 . . . . 10.0 110.908 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -86.47 15.47 5.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.401 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.2 p -62.46 128.79 24.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -93.82 96.11 9.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.957 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 23.3 m . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.489 179.664 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.8 t80 . . . . . 0 C--O 1.234 0.268 0 N-CA-C 110.157 -0.312 . . . . 10.0 110.157 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 98.67 -151.2 19.5 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.869 -0.682 . . . . 10.0 111.617 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.96 175.33 10.14 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.585 0.231 . . . . 10.0 110.406 179.464 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.437 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 15.7 mmt85 -116.24 172.49 7.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.731 0.301 . . . . 10.0 111.286 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.6 t30 62.95 -90.1 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.391 -0.822 . . . . 10.0 111.36 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -59.39 -50.4 74.09 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.124 0.487 . . . . 10.0 111.4 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -68.15 -35.31 77.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.537 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.416 ' OG1' ' HA ' ' A' ' 13' ' ' ARG . 18.5 m -62.13 -46.63 88.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.814 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.2 mt -59.72 -40.73 88.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.879 0.371 . . . . 10.0 110.797 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.7 OUTLIER -65.28 -49.61 68.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.006 -179.801 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -63.4 -38.22 90.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.947 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.546 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -66.6 -42.11 87.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.711 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -58.39 -37.11 74.61 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.555 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -62.64 -37.35 86.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.355 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.3 t -75.48 -37.57 37.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.739 179.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.424 ' HA ' HD12 ' A' ' 28' ' ' ILE . 46.8 t -58.49 -36.59 59.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.927 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -59.42 -41.21 89.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.801 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.5 mt -65.2 -43.41 95.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.876 -0.602 . . . . 10.0 109.954 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.424 HD12 ' HA ' ' A' ' 25' ' ' VAL . 64.1 mt -61.94 -41.77 92.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.204 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -63.39 -36.1 82.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.733 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.37 -24.26 50.67 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.33 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 35.6 mtt -86.2 -16.51 37.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.45 -0.341 . . . . 10.0 111.382 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.486 ' OE1' ' HD2' ' A' ' 82' ' ' ARG . 3.9 tt0 -57.88 -53.56 64.52 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-O 119.485 -0.293 . . . . 10.0 111.537 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.455 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 31.2 Cg_exo -60.52 -25.89 81.62 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.647 1.565 . . . . 10.0 111.86 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -71.84 -45.35 61.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.243 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.2 mmt -66.06 -26.01 67.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.663 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -67.95 -15.2 63.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.004 -0.543 . . . . 10.0 110.994 179.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -93.07 -5.0 51.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.322 0.582 . . . . 10.0 110.038 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.7 mp -98.1 145.15 26.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.29 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.5 p -77.66 170.55 16.38 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.171 -0.468 . . . . 10.0 109.862 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.83 -43.5 90.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.149 0.5 . . . . 10.0 110.364 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -65.55 -30.53 71.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.652 -0.704 . . . . 10.0 111.043 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -70.05 -33.91 72.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.622 0.249 . . . . 10.0 110.409 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 73.3 mt -65.45 -42.24 92.58 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -64.81 -31.3 72.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.261 -0.881 . . . . 10.0 109.417 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.6 -34.47 89.11 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.412 -0.813 . . . . 10.0 112.144 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -65.3 -36.16 83.21 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.979 -0.378 . . . . 10.0 109.979 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.9 m -61.74 -43.67 98.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.269 0.557 . . . . 10.0 109.66 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.9 -30.29 68.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.774 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -68.2 -45.89 72.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.592 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -58.53 -42.84 88.68 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.178 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -60.51 -46.63 89.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.914 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.21 -32.72 73.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.352 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 43.4 mtp180 -68.24 -49.35 61.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.857 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 82.6 mt -61.05 -31.96 71.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.006 0.432 . . . . 10.0 110.535 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -62.22 -44.99 95.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.902 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -83.08 -48.99 9.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.07 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 163.53 111.48 0.26 Allowed Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.51 -0.636 . . . . 10.0 111.51 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -166.66 154.68 9.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 43.9 t -99.83 131.67 46.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 118' ' ' LEU . 14.8 tp -60.09 -42.72 95.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.193 0.521 . . . . 10.0 110.269 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.6 mp0 -65.4 -19.68 66.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.014 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -87.21 -18.58 29.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.356 0.598 . . . . 10.0 110.176 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.7 mt -83.06 -13.68 55.3 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.951 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 89.3 mt -48.69 -53.41 36.69 Favored Pre-proline 0 CA--C 1.542 0.652 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -178.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.1 Cg_exo -53.38 -47.34 27.93 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.021 1.814 . . . . 10.0 113.098 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.49 ' O ' HG23 ' A' ' 70' ' ' VAL . 42.0 mt-10 -74.9 -46.45 35.9 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.813 -178.611 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.47 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -58.83 -49.97 75.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.977 -178.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -62.18 -34.73 76.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.85 -179.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.8 -44.38 85.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.192 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 66' ' ' GLU . 95.7 t -62.44 -45.69 98.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.237 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 67' ' ' ALA . 59.1 t -61.8 -44.94 99.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.127 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.7 ttm180 -60.26 -42.87 96.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.116 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.411 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 30.1 tp10 -61.36 -48.67 80.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.379 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.97 73.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.911 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.7 m -62.08 -35.11 77.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.952 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 73' ' ' GLU . 24.5 mtmt -78.36 -18.2 55.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.527 -179.264 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -98.42 -45.9 5.97 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 111.782 0.29 . . . . 10.0 111.782 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 76.5 t -76.05 -54.92 12.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.687 0.28 . . . . 10.0 111.639 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -90.11 -43.05 10.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.714 0.292 . . . . 10.0 111.205 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.2 16.62 24.75 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.806 -0.711 . . . . 10.0 111.591 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.6 mtm -131.04 124.18 30.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.754 0.311 . . . . 10.0 110.191 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.486 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 9.5 ttp180 -71.07 133.35 46.21 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.875 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.95 117.5 7.09 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.422 ' HB2' ' HG3' ' A' ' 87' ' ' GLN . 33.1 m-85 -56.66 149.56 17.52 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.451 0.469 . . . . 10.0 111.278 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -61.71 -34.08 75.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.037 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.55 ' HA ' HD12 ' A' ' 89' ' ' LEU . 20.6 m -68.1 -29.96 46.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 10.0 110.79 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.458 HE22 HD23 ' A' ' 110' ' ' LEU . 96.3 mt-30 -70.64 -31.09 67.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.07 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 74.6 mt -64.29 -34.19 77.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.793 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.55 HD12 ' HA ' ' A' ' 86' ' ' VAL . 14.5 mt -66.85 -49.75 64.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.684 178.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -63.58 -46.25 92.72 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.629 -0.714 . . . . 10.0 112.501 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.29 -31.93 78.92 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.996 -0.621 . . . . 10.0 112.213 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' MET . . . . . 0.546 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 14.9 ttm -72.6 -35.44 67.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.993 0.425 . . . . 10.0 110.44 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 89' ' ' LEU . 58.7 t -70.31 -36.33 66.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.127 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 93.8 mt -72.92 3.08 5.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.713 -0.676 . . . . 10.0 112.091 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -80.04 -30.08 39.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.336 0.589 . . . . 10.0 109.485 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -104.75 -167.22 1.32 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.409 -0.814 . . . . 10.0 111.051 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 -86.38 57.58 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.065 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 408' ' ' ASP . 31.4 m -127.9 147.79 50.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.957 -0.565 . . . . 10.0 112.05 -178.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.565 HD11 HD13 ' A' ' 407' ' ' LEU . 43.5 mm -100.16 123.85 53.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 108.745 -0.835 . . . . 10.0 108.745 177.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.69 134.45 51.96 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.05 0.452 . . . . 10.0 112.056 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 102' ' ' MET . 0.0 OUTLIER -97.21 158.72 15.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.61 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.449 ' SD ' ' HB2' ' A' ' 106' ' ' GLU . 49.2 ttm -171.69 134.97 0.84 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.836 -0.801 . . . . 10.0 108.836 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -62.06 151.6 34.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.239 0.542 . . . . 10.0 111.476 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.0 m -71.51 92.74 1.14 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.929 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 152.7 -28.85 0.84 Allowed Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.783 -0.722 . . . . 10.0 112.205 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.449 ' HB2' ' SD ' ' A' ' 102' ' ' MET . 5.5 mm-40 -66.96 -17.26 64.83 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.769 0.319 . . . . 10.0 111.135 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.28 67.21 0.64 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.744 -0.741 . . . . 10.0 112.429 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -61.07 -58.84 6.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.84 0.352 . . . . 10.0 111.049 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.1 -36.29 81.26 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.969 -179.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.458 HD23 HE22 ' A' ' 87' ' ' GLN . 31.6 tp -67.81 -27.2 66.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.271 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 95.7 m -80.19 -30.4 38.72 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.013 0.435 . . . . 10.0 111.252 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.554 ' HB1' HD21 ' A' ' 207' ' ' LEU . . . -67.29 -12.3 59.76 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.072 0.767 . . . . 10.0 113.072 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 31.8 p -75.63 -24.41 56.45 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.02 0.378 . . . . 10.0 112.02 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.406 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 52.4 mt -65.95 -56.23 18.29 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.098 0.407 . . . . 10.0 112.098 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 38.3 Cg_endo -65.06 -26.16 58.25 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.891 1.727 . . . . 10.0 111.881 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.28 -52.71 44.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.526 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.412 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 68.8 t80 -60.41 -43.9 96.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.082 0.467 . . . . 10.0 110.688 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.43 ' O ' HD11 ' A' ' 60' ' ' LEU . 34.7 tp -60.55 -51.07 71.0 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.638 -0.71 . . . . 10.0 112.009 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -73.31 -24.11 60.36 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.839 0.311 . . . . 10.0 111.839 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.457 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -67.12 -24.07 65.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.711 0.291 . . . . 10.0 110.975 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 71.6 mt -59.9 -26.46 65.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.609 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.0 p -66.48 -29.39 69.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.895 0.378 . . . . 10.0 111.171 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.96 14.14 67.78 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.782 -0.723 . . . . 10.0 112.602 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -93.06 -12.5 30.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.838 0.351 . . . . 10.0 111.165 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 88.85 119.49 1.67 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.783 -0.723 . . . . 10.0 113.012 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.1 t -80.41 115.54 23.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -86.16 92.0 8.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.004 0.43 . . . . 10.0 110.339 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 28.3 t -84.65 122.97 38.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.153 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 208' ' ' VAL . 87.1 t -109.7 122.47 64.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.363 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.22 148.16 39.45 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.831 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.599 ' HA ' HD11 ' A' ' 214' ' ' ILE . 4.1 m -54.17 -37.84 36.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 O-C-N 123.486 0.492 . . . . 10.0 112.029 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -141.44 168.53 19.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.561 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -75.17 -26.74 59.3 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.145 -0.48 . . . . 10.0 111.532 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -56.66 -52.88 63.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.892 0.377 . . . . 10.0 110.544 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 98.3 mt -70.76 -34.64 72.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.582 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.61 -52.6 64.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.687 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -67.81 -35.54 78.8 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.999 0.428 . . . . 10.0 110.339 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 138' ' ' ARG . 4.5 ttp180 -58.0 -59.03 5.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.061 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ASP . . . . . 0.405 ' CG ' HH21 ' A' ' 138' ' ' ARG . 2.2 m-20 -70.86 -27.98 64.23 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.597 0.592 . . . . 10.0 112.597 -178.269 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -59.81 -44.28 94.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.861 0.362 . . . . 10.0 110.906 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -88.89 -25.44 22.13 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.429 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -71.86 -46.92 56.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.916 0.388 . . . . 10.0 111.241 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -89.36 0.34 56.89 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.438 -0.347 . . . . 10.0 111.046 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 58.3 ttm-85 -60.69 -49.67 88.66 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' PRO . . . . . 0.485 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 28.0 Cg_exo -62.96 -10.57 20.88 Favored 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 122.178 1.919 . . . . 10.0 112.888 -179.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.0 tp -92.66 -50.17 5.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.052 0.453 . . . . 10.0 110.288 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -71.79 -45.87 60.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.007 -0.542 . . . . 10.0 112.004 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.94 -24.75 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.982 0.42 . . . . 10.0 110.792 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -70.37 -33.15 71.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.764 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 60.1 mt -84.29 -14.91 48.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.811 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 109.94 16.97 10.01 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.798 -0.715 . . . . 10.0 112.951 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 37.2 mt -102.58 134.08 46.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.795 0.331 . . . . 10.0 110.435 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.03 126.69 34.34 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.567 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 46.9 t -106.06 128.63 60.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.908 0.385 . . . . 10.0 110.828 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -124.13 146.99 16.49 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.075 -0.583 . . . . 10.0 111.773 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.6 tp -118.56 125.8 74.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.062 0.458 . . . . 10.0 110.44 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -101.68 113.38 26.49 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.054 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 36.0 mt -100.37 141.71 23.23 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.742 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' PRO . . . . . 0.462 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 24.0 Cg_endo -61.07 107.21 0.44 Allowed 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.962 2.441 . . . . 10.0 112.854 -179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.69 16.3 46.17 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.021 -0.609 . . . . 10.0 113.372 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 12.4 ptm -77.64 159.58 76.54 Favored Pre-proline 0 CA--C 1.535 0.393 0 CA-C-N 117.26 0.53 . . . . 10.0 109.9 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -52.06 143.52 40.74 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.062 2.508 . . . . 10.0 113.291 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' ALA . . . . . 0.483 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -57.89 -49.11 95.53 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.794 -0.639 . . . . 10.0 112.422 -179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 41.9 Cg_exo -58.69 -36.31 97.36 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.599 1.533 . . . . 10.0 112.046 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.02 -39.25 90.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.513 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.411 ' HZ2' ' CG ' ' A' ' 185' ' ' ASP . 57.5 mttm -60.95 -43.58 98.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.155 179.011 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -59.8 -39.37 84.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.667 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -68.16 -39.32 82.63 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.988 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -73.08 -38.87 66.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.011 -0.541 . . . . 10.0 111.501 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -75.54 -26.29 57.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.686 0.279 . . . . 10.0 111.564 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 171' ' ' ALA . . . . . 0.403 ' HA ' ' NE ' ' A' ' 201' ' ' ARG . . . -80.34 1.48 28.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.048 0.452 . . . . 10.0 110.756 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -81.61 176.32 9.75 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.802 -0.636 . . . . 10.0 109.722 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 173' ' ' ASP . . . . . 0.457 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 16.0 m-20 -78.24 -33.42 49.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.881 0.372 . . . . 10.0 110.522 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 88.0 mt -136.79 122.16 26.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.121 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.1 m -115.51 122.73 46.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.833 0.349 . . . . 10.0 111.194 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -97.95 136.2 38.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.898 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.81 170.32 43.08 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.441 -0.885 . . . . 10.0 112.817 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.5 m -88.48 151.12 22.75 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 122.43 0.292 . . . . 10.0 110.679 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -57.62 -42.31 83.09 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 -179.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -58.21 -54.26 48.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.615 -0.266 . . . . 10.0 111.421 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 181' ' ' GLU . . . . . 0.462 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.4 tp10 -65.27 -37.67 87.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.091 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.81 -39.24 80.56 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.897 0.379 . . . . 10.0 110.701 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -76.13 -42.64 23.57 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.85 -0.69 . . . . 10.0 111.596 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -37.97 86.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.89 0.376 . . . . 10.0 110.429 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 185' ' ' ASP . . . . . 0.411 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 8.3 m-20 -59.5 -44.06 93.21 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.429 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.64 -38.78 91.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.47 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 187' ' ' LEU . . . . . 0.462 HD11 HG22 ' A' ' 375' ' ' ILE . 47.5 mt -64.58 -46.62 81.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.819 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 28.3 mtm180 -69.68 -35.86 75.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.124 0.488 . . . . 10.0 110.545 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.03 -50.65 71.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.483 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.3 -0.9 30.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.732 -0.667 . . . . 10.0 112.438 -178.178 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 25.7 ttp -105.39 10.77 33.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.193 0.521 . . . . 10.0 110.403 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 192' ' ' ALA . . . . . 0.441 ' HB1' ' HB2' ' A' ' 197' ' ' GLU . . . -78.05 166.07 23.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.254 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -103.83 -26.24 12.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.078 0.466 . . . . 10.0 110.227 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -118.05 138.52 25.56 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.49 -23.94 76.59 Favored 'Trans proline' 0 CA--C 1.53 0.284 0 C-N-CA 122.614 2.209 . . . . 10.0 112.534 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 37.8 mp0 -78.44 -13.01 60.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.464 -0.334 . . . . 10.0 111.079 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 197' ' ' GLU . . . . . 0.441 ' HB2' ' HB1' ' A' ' 192' ' ' ALA . 67.6 mt-10 -82.39 -4.99 58.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.549 -0.296 . . . . 10.0 110.902 -179.676 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 198' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' A' ' 198' ' ' ARG . 45.6 mtt85 -62.68 157.78 20.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.284 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 12.2 m -133.29 -14.63 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.057 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -91.79 163.79 13.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.179 0.514 . . . . 10.0 111.558 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 201' ' ' ARG . . . . . 0.403 ' NE ' ' HA ' ' A' ' 171' ' ' ALA . 4.6 mtm180 -122.76 174.86 6.86 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.679 -0.86 . . . . 10.0 108.679 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -55.23 124.67 17.74 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.122 0.487 . . . . 10.0 111.182 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 10.4 mt -79.82 72.32 6.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.307 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 9.7 t-160 -88.49 -53.57 4.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.733 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -128.78 138.68 52.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.916 0.388 . . . . 10.0 111.789 -178.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 206' ' ' ALA . . . . . 0.575 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -129.97 135.84 48.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.552 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 207' ' ' LEU . . . . . 0.554 HD21 ' HB1' ' A' ' 112' ' ' ALA . 35.7 tp -131.69 109.92 10.52 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.354 -179.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 208' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 2.9 p -104.97 140.55 22.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.67 0.272 . . . . 10.0 110.98 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.34 -40.59 70.6 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 210' ' ' GLU . . . . . 0.425 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 7.5 tt0 -135.27 113.72 11.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.036 0.446 . . . . 10.0 111.029 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 211' ' ' VAL . . . . . 0.495 HG11 HD12 ' A' ' 99' ' ' ILE . 34.2 m -84.54 -14.88 11.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.111 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 212' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 0.9 OUTLIER -55.53 -71.13 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.729 -179.18 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.1 m -76.13 -38.09 57.23 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.473 0.546 . . . . 10.0 112.473 -178.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 214' ' ' ILE . . . . . 0.599 HD11 ' HA ' ' A' ' 131' ' ' VAL . 45.5 mt -71.55 -43.54 71.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 113.993 1.108 . . . . 10.0 113.993 -177.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 215' ' ' LEU . . . . . 0.407 HD22 ' CE2' ' A' ' 405' ' ' TYR . 17.0 mt -93.74 -50.68 5.26 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.929 0.714 . . . . 10.0 112.929 -177.639 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 216' ' ' ILE . . . . . 0.421 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 48.6 mm -73.14 -56.68 8.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -70.97 -39.49 72.48 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 218' ' ' GLU . . . . . 0.51 ' HB2' ' O ' ' A' ' 214' ' ' ILE . 6.0 mm-40 -91.61 19.27 6.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.89 -51.4 69.44 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 220' ' ' ARG . . . . . 0.433 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -96.85 32.36 2.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.96 0.409 . . . . 10.0 111.392 -178.571 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 17.4 m -101.86 105.02 39.24 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-O 120.92 0.39 . . . . 10.0 110.197 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 222' ' ' PRO . . . . . 0.433 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 73.1 Cg_endo -91.33 132.25 1.44 Allowed 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.939 2.426 . . . . 10.0 112.778 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 223' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 374' ' ' SER . 69.2 mt -78.22 105.65 9.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.156 -0.474 . . . . 10.0 109.768 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 59.0 mt -86.49 122.88 39.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.775 -0.648 . . . . 10.0 112.18 -178.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 59.8 mt . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.273 178.223 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.394 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 374' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 58.1 m -156.01 146.13 21.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.009 0.433 . . . . 10.0 111.478 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 375' ' ' ILE . . . . . 0.462 HG22 HD11 ' A' ' 187' ' ' LEU . 16.5 tt -145.96 141.0 21.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.752 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.63 145.43 25.68 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.318 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -56.8 -41.14 77.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.774 0.321 . . . . 10.0 110.314 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 378' ' ' GLN . . . . . 0.518 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.4 tm0? -55.96 -41.9 75.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.902 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -78.06 -30.66 49.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.054 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -68.1 -49.05 63.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.989 0.423 . . . . 10.0 110.304 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -72.78 -17.31 61.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.758 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.63 -25.27 63.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.348 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 73.9 mt -78.92 -12.87 60.05 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.806 -0.633 . . . . 10.0 111.753 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 384' ' ' TYR . . . . . 0.575 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 30.1 m-85 -80.81 138.75 36.25 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.799 0.333 . . . . 10.0 110.875 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -72.95 -73.48 0.2 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.186 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -91.41 90.55 7.73 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.47 HD23 HD21 ' A' ' 407' ' ' LEU . 66.2 tp -99.46 106.34 18.37 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.58 -0.737 . . . . 10.0 109.705 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -122.74 161.44 23.92 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.801 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -179.3 172.64 44.66 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.136 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 65.2 mtm -112.71 152.46 29.04 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.951 0.405 . . . . 10.0 110.576 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 9.6 t -122.04 -176.69 3.4 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.076 -0.713 . . . . 10.0 109.076 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -106.43 165.18 13.53 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.623 -0.799 . . . . 10.0 111.584 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 4.7 m -71.08 74.52 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.399 0.618 . . . . 10.0 109.99 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 394' ' ' ALA . . . . . 0.468 ' HB1' ' HA ' ' A' ' 566' ' ' ARG . . . -131.39 -48.72 0.99 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.992 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 395' ' ' ASP . . . . . 0.461 ' CG ' ' H ' ' A' ' 396' ' ' THR . 21.0 t70 66.38 -140.54 0.16 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 -178.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 396' ' ' THR . . . . . 0.461 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 4.8 m 70.0 -77.72 0.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 122.777 0.431 . . . . 10.0 111.652 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -81.72 15.15 2.28 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.2 0.524 . . . . 10.0 111.191 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 398' ' ' ALA . . . . . 0.448 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -66.99 -23.43 65.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.714 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -75.74 -10.92 59.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.906 0.384 . . . . 10.0 111.091 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 400' ' ' GLU . . . . . 0.445 ' HG2' ' CD1' ' A' ' 639' ' ' PHE . 43.0 mt-10 -89.27 -14.27 36.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.506 -0.316 . . . . 10.0 111.085 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 401' ' ' PHE . . . . . 0.448 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 18.7 m-85 -60.9 -51.7 68.17 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.961 0.41 . . . . 10.0 110.553 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 402' ' ' SER . . . . . 0.411 ' O ' ' HA ' ' A' ' 406' ' ' LYS . 0.7 OUTLIER -75.62 -21.0 58.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.418 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 29.1 m -81.84 -47.17 13.16 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.5 mt -88.68 -60.2 2.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 112.709 0.633 . . . . 10.0 112.709 -177.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 405' ' ' TYR . . . . . 0.518 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 68.8 m-85 -90.98 -4.78 56.18 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.635 0.606 . . . . 10.0 112.635 -177.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 406' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 402' ' ' SER . 67.4 mmtt 59.82 53.6 4.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.072 0.463 . . . . 10.0 110.205 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 407' ' ' LEU . . . . . 0.565 HD13 HD11 ' A' ' 99' ' ' ILE . 34.9 mt -111.47 144.17 41.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.257 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 408' ' ' ASP . . . . . 0.571 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . 36.8 t0 -78.87 167.95 20.42 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.884 -0.784 . . . . 10.0 108.884 178.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 19.6 m -138.72 121.82 16.84 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 121.963 -0.46 . . . . 10.0 112.123 -178.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 85.7 t -132.39 131.31 60.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.934 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.2 t -94.11 119.62 42.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.222 -0.288 . . . . 10.0 110.222 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 41.1 t -93.56 132.66 29.61 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 116.405 -0.362 . . . . 10.0 110.587 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -67.96 159.25 53.78 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.763 2.309 . . . . 10.0 112.548 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 15.2 p -82.84 166.5 18.92 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.914 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -63.11 -37.23 86.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.421 0.629 . . . . 10.0 109.685 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 416' ' ' ARG . . . . . 0.404 ' HB2' ' HA3' ' A' ' 579' ' ' GLY . 26.4 mtm180 -136.86 147.88 60.93 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.913 178.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.52 135.6 50.27 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 122.297 1.998 . . . . 10.0 111.942 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 56.8 mtm -71.86 138.65 48.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.869 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.3 mt -104.17 10.74 8.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.61 0.719 . . . . 10.0 109.431 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 15.7 ttp-105 -66.62 124.99 24.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.095 -0.957 . . . . 10.0 110.928 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.543 ' O ' ' HA ' ' A' ' 583' ' ' SER . 89.4 mttt -105.89 136.25 45.87 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -104.82 148.98 26.05 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.864 0.364 . . . . 10.0 111.014 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 423' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 424' ' ' PRO . 72.5 mt -125.25 148.04 59.44 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.941 179.495 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 424' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 423' ' ' LEU . 39.4 Cg_exo -61.47 164.31 15.75 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.914 2.409 . . . . 10.0 113.986 -178.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -84.24 116.96 23.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.018 -0.992 . . . . 10.0 109.608 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 59.0 mt -96.22 102.72 14.55 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.3 0.571 . . . . 10.0 110.256 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 427' ' ' VAL . . . . . 0.483 HG22 ' HB2' ' A' ' 588' ' ' LEU . 42.9 t -93.19 129.44 43.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.199 -0.909 . . . . 10.0 110.772 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 428' ' ' TYR . . . . . 0.469 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 79.3 m-85 -112.39 -178.6 3.45 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.078 179.025 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 429' ' ' MET . . . . . 0.572 ' HB2' ' OE2' ' A' ' 433' ' ' GLU . 20.1 mmt -74.21 -76.7 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.879 0.371 . . . . 10.0 111.112 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 59.4 p -89.72 160.45 16.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.162 -0.472 . . . . 10.0 111.052 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 431' ' ' GLU . . . . . 0.451 ' OE1' ' HD3' ' A' ' 434' ' ' LYS . 9.5 tp10 -60.85 -27.26 67.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.717 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -59.47 -48.47 81.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.895 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 433' ' ' GLU . . . . . 0.572 ' OE2' ' HB2' ' A' ' 429' ' ' MET . 14.3 mt-10 -62.68 -39.17 93.12 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.079 0.466 . . . . 10.0 110.29 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 434' ' ' LYS . . . . . 0.513 ' O ' HG13 ' A' ' 438' ' ' ILE . 63.9 tttt -60.67 -51.45 69.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.311 -0.859 . . . . 10.0 110.798 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 435' ' ' ILE . . . . . 0.497 ' O ' HG12 ' A' ' 439' ' ' ILE . 49.4 mm -66.4 -42.79 91.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.982 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -60.3 -37.39 80.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.78 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.99 -37.4 85.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.444 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 438' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 434' ' ' LYS . 76.8 mt -62.95 -42.95 98.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.922 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 439' ' ' ILE . . . . . 0.497 HG12 ' O ' ' A' ' 435' ' ' ILE . 41.6 mm -56.89 -42.36 78.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.674 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -64.54 -47.28 79.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.165 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -59.89 -39.09 84.16 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.079 0.466 . . . . 10.0 110.411 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.504 HG12 HG11 ' A' ' 452' ' ' VAL . 78.7 mt -71.38 -45.74 67.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.547 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -50.03 -49.68 50.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.836 -0.62 . . . . 10.0 111.468 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -58.93 -44.04 91.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.672 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.44 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 38.3 mtt-85 -75.17 -22.0 58.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.316 -178.209 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 29.7 m -68.34 -36.62 79.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.128 0.49 . . . . 10.0 110.163 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.9 -25.55 30.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.999 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 34.8 mttp -79.14 -31.36 44.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.209 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 101.57 35.64 4.03 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.429 -0.891 . . . . 10.0 112.698 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 450' ' ' GLN . . . . . 0.646 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 59.7 tt0 -112.8 125.6 29.63 Favored Pre-proline 0 C--N 1.323 -0.561 0 O-C-N 122.673 -0.31 . . . . 10.0 110.825 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -65.36 136.88 48.93 Favored 'Trans proline' 0 C--O 1.237 0.447 0 C-N-CA 122.497 2.131 . . . . 10.0 111.153 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 452' ' ' VAL . . . . . 0.504 HG11 HG12 ' A' ' 442' ' ' ILE . 60.9 t -123.04 122.96 66.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.505 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 45.7 tp -109.7 112.22 24.15 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 41.5 t -96.06 121.31 46.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.13 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -103.93 105.01 2.55 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.713 -0.756 . . . . 10.0 112.175 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 17.2 p -103.02 139.51 38.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.754 0.312 . . . . 10.0 110.529 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 457' ' ' ILE . . . . . 0.444 HG12 ' HB2' ' A' ' 560' ' ' GLU . 7.5 pt -100.88 3.89 10.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.378 0.609 . . . . 10.0 110.051 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 3.5 p -133.82 128.8 35.48 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.978 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 28.8 mt -62.12 -36.7 75.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.025 0.44 . . . . 10.0 110.587 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.417 ' H ' ' CD ' ' A' ' 460' ' ' GLU . 1.6 mp0 -57.95 -41.59 83.17 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.582 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -36.74 77.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.844 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 3.8 m -58.98 -46.07 89.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.951 0.405 . . . . 10.0 110.402 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -71.86 -32.32 67.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.66 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 61.4 tp -68.43 -54.88 14.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.616 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.9 p -63.48 -30.16 49.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.904 0.383 . . . . 10.0 110.336 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 10.5 t -64.5 -43.91 92.6 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -65.45 -42.43 92.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.33 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -63.28 -43.51 97.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.619 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 47.0 mt -62.88 -42.03 99.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.246 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 35.3 m -64.41 -34.89 79.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.045 0.45 . . . . 10.0 110.017 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -63.29 -39.8 95.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.049 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.09 -4.88 56.75 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.295 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 75.88 26.78 63.92 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.025 -0.607 . . . . 10.0 112.378 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 71.3 mt -94.35 116.13 34.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.916 0.388 . . . . 10.0 110.803 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -64.2 131.67 48.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.202 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -155.93 157.89 37.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.992 -178.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -121.41 134.54 55.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.933 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 11.0 t -110.6 132.63 58.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.681 0.277 . . . . 10.0 110.809 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.09 164.66 22.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.529 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -157.1 117.9 3.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.144 -0.48 . . . . 10.0 109.834 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -59.57 -21.31 60.13 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.911 -0.586 . . . . 10.0 112.27 -179.044 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -76.38 -19.78 57.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.684 0.278 . . . . 10.0 111.113 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -127.18 64.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.473 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -59.59 -30.4 68.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.232 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.55 -28.89 69.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.583 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -84.56 -33.9 23.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.02 0.438 . . . . 10.0 109.898 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -58.37 -36.91 74.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.723 -0.672 . . . . 10.0 110.966 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -53.62 -35.6 61.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 10.0 111.974 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -83.01 -35.16 26.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.917 0.389 . . . . 10.0 110.675 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 75.8 mt -66.86 -54.0 29.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.297 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 49.4 t -61.54 -30.67 48.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.16 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -60.69 -29.96 69.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.607 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 71.4 mm-40 -114.27 21.38 14.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.773 0.321 . . . . 10.0 110.942 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.68 -17.63 62.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.028 0.442 . . . . 10.0 111.069 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -101.27 15.27 57.82 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.046 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -79.33 142.09 58.18 Favored Pre-proline 0 C--N 1.324 -0.542 0 N-CA-C 110.075 -0.342 . . . . 10.0 110.075 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.93 123.3 12.14 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.539 2.16 . . . . 10.0 112.789 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 71.5 16.68 5.88 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.615 -0.721 . . . . 10.0 112.751 178.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.74 110.23 21.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.984 0.421 . . . . 10.0 110.605 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 20.4 t -92.74 114.44 29.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.983 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 2.0 m -115.95 134.3 55.12 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.02 -179.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 62.7 mt -110.61 120.75 62.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 120.85 0.357 . . . . 10.0 110.069 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -111.29 124.25 51.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.605 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 14.5 m -103.56 119.65 39.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.54 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 14.1 m120 54.98 48.14 20.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.619 -0.718 . . . . 10.0 111.956 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 49.2 ttm -74.72 121.2 21.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.099 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -69.66 -174.16 0.69 Allowed 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.608 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -73.89 -178.13 37.2 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.065 -0.588 . . . . 10.0 112.587 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.425 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 52.6 mtt180 63.98 -95.52 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.83 0.452 . . . . 10.0 110.504 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 81.21 167.04 37.4 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.929 -0.653 . . . . 10.0 113.096 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.59 167.81 21.2 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.618 0.247 . . . . 10.0 111.087 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -85.53 106.76 17.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.747 0.308 . . . . 10.0 110.339 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 65.9 mt -80.62 108.95 14.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.257 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 19.6 t -88.12 127.78 40.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.638 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 50.3 mt -71.6 132.3 44.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.162 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 90.72 11.52 61.9 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.743 -0.741 . . . . 10.0 111.751 -179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 94.68 179.45 37.7 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.891 -0.671 . . . . 10.0 111.774 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 2.6 p -117.45 96.0 5.21 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.805 0.336 . . . . 10.0 110.976 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 18.0 p-90 -59.84 -25.81 65.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.795 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -66.72 -34.26 77.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.656 -0.702 . . . . 10.0 110.48 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.34 -31.15 38.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.262 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.14 -46.08 75.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.686 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.0 m -69.02 -27.2 34.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.846 0.355 . . . . 10.0 110.754 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -78.84 -9.11 59.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.982 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -93.56 -7.54 43.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.144 0.497 . . . . 10.0 110.483 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 60.3 mt -99.01 134.65 41.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.936 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -65.63 -49.7 67.74 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.191 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -126.63 88.55 54.14 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.703 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -83.29 112.99 2.01 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.972 2.448 . . . . 10.0 111.591 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 530' ' ' THR . . . . . 0.547 ' H ' ' NE2' ' A' ' 533' ' ' GLN . 16.7 p -87.82 176.52 7.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.581 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -58.96 -44.93 91.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.947 0.403 . . . . 10.0 111.054 -179.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.485 ' OE1' ' HB ' ' A' ' 530' ' ' THR . 1.2 mp0 -63.61 -36.23 83.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.651 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 533' ' ' GLN . . . . . 0.547 ' NE2' ' H ' ' A' ' 530' ' ' THR . 31.9 mt-30 -65.97 -49.87 66.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.953 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 74.2 mt -60.33 -45.32 96.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.605 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -64.54 -44.13 91.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.795 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -60.43 -50.02 75.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.691 -0.231 . . . . 10.0 110.811 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 85.0 mt -62.64 -45.07 99.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.607 -0.27 . . . . 10.0 110.67 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 5.5 ttmt -60.75 -45.16 95.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.887 0.375 . . . . 10.0 110.782 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.18 95.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.259 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 540' ' ' ASP . . . . . 0.59 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 0.1 OUTLIER -67.64 -40.43 84.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.389 -0.368 . . . . 10.0 110.057 179.617 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 44.3 t90 -59.8 -42.15 92.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.142 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -53.37 -44.0 68.23 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.79 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 59.6 t -65.47 -47.61 86.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.739 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 544' ' ' ARG . . . . . 0.59 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 13.4 mtm180 -63.72 -33.27 75.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.346 0.593 . . . . 10.0 110.272 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -65.52 -50.59 64.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.186 -0.915 . . . . 10.0 111.063 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.79 -26.81 64.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.298 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.2 -39.45 92.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.189 0.519 . . . . 10.0 109.88 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 86.2 t -65.85 -37.34 79.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.994 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 98.5 mt -66.09 -32.74 74.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.202 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -69.97 -38.98 76.22 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.275 179.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 551' ' ' ALA . . . . . 0.646 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -69.0 -44.24 73.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.125 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 145.26 18.56 0.17 Allowed Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.075 -1.06 . . . . 10.0 113.684 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 77.54 -169.75 54.85 Favored Glycine 0 C--N 1.328 0.13 0 C-N-CA 120.668 -0.777 . . . . 10.0 112.352 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 63.8 tp -72.2 125.53 27.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.0 0.428 . . . . 10.0 110.409 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -94.31 123.62 37.83 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.786 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 40.8 mm -105.43 128.19 59.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.343 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 557' ' ' ILE . . . . . 0.408 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.2 mt -120.77 123.2 69.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 120.989 0.423 . . . . 10.0 110.49 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.53 122.08 7.05 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 111.321 -0.712 . . . . 10.0 111.321 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 18.3 p -82.51 -56.27 3.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.143 0.497 . . . . 10.0 111.113 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 560' ' ' GLU . . . . . 0.444 ' HB2' HG12 ' A' ' 457' ' ' ILE . 14.4 mp0 -110.73 141.46 44.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.617 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 561' ' ' ARG . . . . . 0.484 ' HG2' HD21 ' A' ' 588' ' ' LEU . 15.1 mmt180 -87.13 123.49 32.24 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.149 -0.685 . . . . 10.0 109.149 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -67.19 143.72 56.4 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.704 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -57.15 -66.12 0.51 Allowed 'General case' 0 N--CA 1.462 0.154 0 O-C-N 123.431 0.457 . . . . 10.0 109.99 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.58 121.62 20.01 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 565' ' ' ARG . . . . . 0.442 ' HB2' ' HB3' ' A' ' 631' ' ' GLN . 16.9 tpt180 -60.5 -21.2 62.16 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 123.457 0.473 . . . . 10.0 111.659 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 566' ' ' ARG . . . . . 0.468 ' HA ' ' HB1' ' A' ' 394' ' ' ALA . 11.2 ttm180 -55.43 -61.4 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.962 0.41 . . . . 10.0 110.749 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 30.0 mt -71.31 -24.51 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.032 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 568' ' ' ASP . . . . . 0.426 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 4.8 t70 -63.08 -49.34 74.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.485 0.659 . . . . 10.0 109.523 178.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 569' ' ' ASN . . . . . 0.439 ' HB3' ' HA ' ' A' ' 394' ' ' ALA . 50.2 t30 -67.58 -38.55 84.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.954 -1.021 . . . . 10.0 110.676 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 570' ' ' GLN . . . . . 0.452 ' HG3' ' HB2' ' A' ' 394' ' ' ALA . 94.3 mt-30 -67.12 -30.95 71.1 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.799 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.532 HD12 HH21 ' A' ' 574' ' ' ARG . 44.4 tp -66.82 -32.78 74.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.988 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -85.64 -33.77 21.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.485 -0.78 . . . . 10.0 110.995 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.63 54.81 2.49 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 121.235 -0.507 . . . . 10.0 113.902 -179.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 574' ' ' ARG . . . . . 0.532 HH21 HD12 ' A' ' 571' ' ' LEU . 29.9 mmt180 -92.15 -51.46 5.17 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.46 -167.87 2.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.173 179.178 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 73.92 39.11 47.58 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.475 -0.869 . . . . 10.0 112.238 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 577' ' ' ARG . . . . . 0.549 ' H ' ' HB3' ' A' ' 580' ' ' ASP . 51.3 mtt180 -97.58 122.45 40.65 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 58.73 41.17 22.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.015 0.436 . . . . 10.0 111.793 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 579' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 416' ' ' ARG . . . 82.16 32.33 29.14 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 121.039 -0.601 . . . . 10.0 113.096 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 580' ' ' ASP . . . . . 0.549 ' HB3' ' H ' ' A' ' 577' ' ' ARG . 6.1 t70 -81.11 163.65 22.98 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -89.47 -139.49 0.13 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.905 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 120.65 167.41 13.36 Favored Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 120.666 -0.778 . . . . 10.0 112.326 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 583' ' ' SER . . . . . 0.543 ' HA ' ' O ' ' A' ' 421' ' ' LYS . 1.3 p -149.19 122.27 8.86 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.442 0.163 . . . . 10.0 110.619 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.49 125.81 39.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.721 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 585' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 4.3 tpm_? -132.99 124.83 28.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.539 -0.3 . . . . 10.0 110.192 179.201 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -116.43 140.01 49.82 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.9 0.381 . . . . 10.0 111.114 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -132.18 122.97 26.12 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.104 -0.702 . . . . 10.0 109.104 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 588' ' ' LEU . . . . . 0.484 HD21 ' HG2' ' A' ' 561' ' ' ARG . 5.3 mt -130.39 179.25 6.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.829 0.347 . . . . 10.0 111.286 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 38.8 p -142.55 178.6 7.5 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.803 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 74.7 mmm -85.31 -4.32 59.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.09 0.471 . . . . 10.0 110.271 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -105.33 0.58 27.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.507 -0.769 . . . . 10.0 109.9 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.57 154.86 41.08 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.76 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -69.59 -24.71 63.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.256 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 594' ' ' LEU . . . . . 0.62 ' O ' HG12 ' A' ' 597' ' ' ILE . 10.1 tp -59.42 -34.23 72.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.295 -0.411 . . . . 10.0 111.342 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 14.8 mmt -64.38 -16.72 62.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.764 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -82.73 -10.66 58.79 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 597' ' ' ILE . . . . . 0.62 HG12 ' O ' ' A' ' 594' ' ' LEU . 17.2 pt -82.15 -8.85 11.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.225 -0.59 . . . . 10.0 110.201 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -84.39 -13.9 50.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.26 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.85 -68.36 0.16 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.419 -0.81 . . . . 10.0 111.954 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 28.1 m -71.52 115.78 11.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.35 -0.386 . . . . 10.0 111.233 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -68.45 -19.71 64.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.138 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -38.4 79.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.188 179.227 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.7 t -63.08 -51.84 66.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.011 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 604' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 1.2 m -63.08 -34.5 77.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.446 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -63.21 -39.14 97.56 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.138 -0.553 . . . . 10.0 111.756 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 14.1 tpt -70.02 -29.04 66.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.134 0.492 . . . . 10.0 110.267 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 63.0 mtt -70.66 -21.47 62.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.784 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 608' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 604' ' ' SER . 48.9 mtt180 -73.1 -6.46 45.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.101 0.477 . . . . 10.0 110.409 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -79.97 -4.07 50.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.501 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 31.3 tp -65.75 -39.31 90.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.109 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 109.73 -40.77 2.43 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.916 -0.659 . . . . 10.0 111.458 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 612' ' ' MET . . . . . 0.463 ' CG ' ' HA ' ' A' ' 428' ' ' TYR . 1.7 mpt? 60.63 -106.47 0.26 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.028 0.531 . . . . 10.0 111.677 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.94 109.88 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.326 0 O-C-N 123.666 0.603 . . . . 10.0 111.283 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 614' ' ' PRO . . . . . 0.469 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 37.8 Cg_endo -66.3 85.5 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.61 2.207 . . . . 10.0 112.491 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 162.44 -44.2 0.36 Allowed Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.902 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.43 54.71 3.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.118 0.485 . . . . 10.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -81.47 84.89 6.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.578 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 14.9 tt -86.56 1.87 5.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.936 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 71.75 141.47 0.05 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.435 0.694 . . . . 10.0 111.462 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -147.36 92.89 4.76 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.122 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -61.49 -28.33 83.34 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 123.407 2.738 . . . . 10.0 114.115 -178.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 37.8 p-90 -61.0 -25.3 66.79 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 111.852 0.316 . . . . 10.0 111.852 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.94 -50.12 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.725 0.298 . . . . 10.0 110.232 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 68.0 m -59.6 -38.5 81.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.859 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -63.84 -39.54 94.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.862 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -69.57 -43.61 72.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.175 179.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.13 -44.02 99.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.585 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -61.28 -40.4 94.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.596 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -66.21 -45.04 82.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.199 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 630' ' ' ALA . . . . . 0.456 ' O ' HG23 ' A' ' 634' ' ' VAL . . . -61.67 -46.64 88.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.993 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 631' ' ' GLN . . . . . 0.442 ' HB3' ' HB2' ' A' ' 565' ' ' ARG . 56.5 mt-30 -58.83 -43.15 90.63 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.961 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 51.2 mtp85 -71.08 -33.85 70.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.279 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -63.29 -38.79 92.52 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.007 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 634' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 630' ' ' ALA . 69.6 t -58.63 -47.67 88.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.241 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -73.21 -23.5 60.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.704 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.0 m -67.66 -29.65 69.0 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -78.12 -32.63 50.56 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.846 -1.07 . . . . 10.0 108.526 177.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -60.3 -49.92 75.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.128 -0.942 . . . . 10.0 109.802 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 639' ' ' PHE . . . . . 0.445 ' CD1' ' HG2' ' A' ' 400' ' ' GLU . 32.2 t80 -56.62 -38.22 71.79 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.56 179.087 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 640' ' ' ASP . . . . . 0.472 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 32.4 t70 -59.34 -35.49 73.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.602 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 24.9 mt -82.75 -38.97 15.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.119 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 642' ' ' ARG . . . . . 0.501 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 5.5 mtm180 -61.03 -39.16 88.72 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.666 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 643' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 18.8 pttm -66.31 -25.32 66.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.016 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 644' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 15.8 mm100 -66.95 -39.65 87.33 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.621 -0.511 . . . . 10.0 109.621 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 33.1 mt -66.94 -39.69 87.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.629 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 646' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 46.9 mt -63.42 -35.55 80.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.733 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -63.62 -24.11 67.66 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.115 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 648' ' ' TYR . . . . . 0.423 ' CZ ' ' HG3' ' A' ' 800' ' ' LYS . 48.1 m-85 -97.28 -39.95 8.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.132 0.491 . . . . 10.0 110.979 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -75.21 -27.02 59.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.713 0.634 . . . . 10.0 112.713 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 650' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 5.4 t0 -68.16 -21.56 64.89 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.216 0.531 . . . . 10.0 110.368 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 17.8 t -68.23 -49.45 66.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -68.49 -25.51 65.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.054 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -61.5 -54.24 45.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 10.0 111.043 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -61.9 -42.98 99.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.912 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -64.89 -38.66 91.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.652 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 14.0 ttp-105 -65.25 -45.88 82.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.788 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -61.35 -40.28 93.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.487 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.4 -54.18 36.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.764 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.2 tp -67.09 -35.29 74.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 116.64 -0.255 . . . . 10.0 111.603 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -64.27 -41.71 96.78 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 110.356 -0.239 . . . . 10.0 110.356 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 15.0 t -61.9 -50.3 72.73 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -57.56 -45.95 84.53 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.779 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 19.3 ttt-85 -62.19 -36.98 83.56 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.931 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -74.36 -37.12 63.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.754 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.01 -41.44 96.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 10.0 110.65 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 77.2 mt -83.15 -5.03 58.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.393 0.616 . . . . 10.0 110.499 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 52.1 tp -91.26 -47.19 7.64 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.351 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -65.69 -41.26 92.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.502 -0.772 . . . . 10.0 112.046 -179.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 34.0 m -73.35 145.59 11.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.9 0.381 . . . . 10.0 111.302 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.66 -27.17 29.28 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.974 0.416 . . . . 10.0 110.055 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -81.48 -178.04 6.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.486 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 672' ' ' VAL . . . . . 0.465 ' O ' HG12 ' A' ' 676' ' ' ILE . 7.4 p -179.82 -24.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.392 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -37.29 63.59 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.412 -0.813 . . . . 10.0 111.329 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.96 -53.98 52.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.641 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 675' ' ' THR . . . . . 0.482 ' O ' HG12 ' A' ' 679' ' ' ILE . 0.2 OUTLIER -62.55 -41.92 99.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.837 -0.619 . . . . 10.0 110.564 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 676' ' ' ILE . . . . . 0.465 HG12 ' O ' ' A' ' 672' ' ' VAL . 29.5 mm -57.91 -51.44 70.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.663 -0.698 . . . . 10.0 111.56 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 -68.68 -32.2 71.85 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 49.8 m -65.8 -49.63 67.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.741 0.305 . . . . 10.0 110.548 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 679' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 675' ' ' THR . 42.8 pt -73.83 -21.49 18.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 120.826 -0.35 . . . . 10.0 111.084 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 49.2 ttm-85 -59.58 -38.67 81.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.795 0.331 . . . . 10.0 110.536 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.99 -34.85 79.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.82 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -80.39 -41.95 23.71 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.457 -178.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 64.7 t -59.63 -47.6 90.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-O 120.941 0.4 . . . . 10.0 110.76 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -64.71 -38.52 91.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.07 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.1 tttm -59.95 -51.48 69.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.504 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.85 -36.86 77.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.232 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 25.8 m -68.81 -43.73 75.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.702 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.4 mt -66.74 -47.24 83.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.412 . . . . 10.0 110.394 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -58.32 -24.46 59.72 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.915 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -74.06 -18.28 60.85 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 691' ' ' TYR . . . . . 0.434 ' OH ' ' HD3' ' A' ' 709' ' ' ARG . 97.5 m-85 -122.53 -25.82 4.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.937 0.399 . . . . 10.0 111.071 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 51.4 mt -126.06 102.46 27.74 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.866 -0.607 . . . . 10.0 109.701 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -60.99 132.49 42.3 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.499 2.132 . . . . 10.0 111.594 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -44.3 104.92 0.06 OUTLIER 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 123.654 2.903 . . . . 10.0 113.653 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 53.75 80.98 0.1 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.008 -0.996 . . . . 10.0 111.802 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 8.8 p -137.27 -163.1 1.37 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.98 -0.554 . . . . 10.0 110.604 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 5.1 mt -78.05 128.79 34.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.278 179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 698' ' ' GLU . . . . . 0.588 ' HA ' ' CD2' ' A' ' 701' ' ' TRP . 11.4 pm0 -55.57 -28.14 53.29 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.41 -22.52 61.85 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.074 0.464 . . . . 10.0 110.59 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 22.9 ttt -92.87 11.24 27.86 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.181 0.515 . . . . 10.0 110.797 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 701' ' ' TRP . . . . . 0.588 ' CD2' ' HA ' ' A' ' 698' ' ' GLU . 53.8 m0 -97.77 126.18 42.99 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.227 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -85.38 79.44 9.47 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 703' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.3 mm -62.16 -50.39 80.34 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.318 -0.855 . . . . 10.0 111.461 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 704' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 35.6 Cg_exo -58.24 -46.11 27.11 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.886 1.724 . . . . 10.0 112.189 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -61.03 -44.64 97.94 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.007 -0.616 . . . . 10.0 112.583 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 40.0 tp -66.73 -42.63 85.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.511 0.196 . . . . 10.0 111.053 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -60.6 -50.9 71.65 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.473 -0.33 . . . . 10.0 110.651 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -62.92 -37.22 86.14 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.573 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 709' ' ' ARG . . . . . 0.434 ' HD3' ' OH ' ' A' ' 691' ' ' TYR . 7.1 tpt180 -61.48 -48.64 80.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.502 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 89.4 mt -63.28 -35.59 80.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.292 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -70.49 -41.4 72.75 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.266 0.469 . . . . 10.0 112.266 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -85.31 -44.15 13.08 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 113.051 0.76 . . . . 10.0 113.051 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 713' ' ' ASP . . . . . 0.412 ' O ' ' HE3' ' A' ' 828' ' ' LYS . 1.2 m-20 -83.36 -34.59 25.58 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.444 0.905 . . . . 10.0 113.444 -176.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -115.97 -1.26 12.56 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.735 1.013 . . . . 10.0 113.735 -177.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 33.0 t70 60.72 35.0 19.8 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.672 0.749 . . . . 10.0 109.952 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 13.8 tp -123.2 108.1 12.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.136 -179.06 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -90.92 103.69 16.37 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.109 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 80.6 mt -122.16 123.84 27.1 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.897 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 719' ' ' PRO . . . . . 0.454 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 87.8 Cg_endo -82.08 70.5 7.08 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.762 2.308 . . . . 10.0 111.233 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 91.7 mt -56.42 -39.6 62.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.295 -0.866 . . . . 10.0 111.649 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -58.49 -47.95 82.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.606 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 722' ' ' GLU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 719' ' ' PRO . 27.0 mm-40 -64.92 -34.59 78.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.428 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -63.19 -49.95 72.22 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.972 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 35.6 tp -75.74 -24.79 56.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.063 0.459 . . . . 10.0 110.736 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -69.17 -50.92 43.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.846 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -81.25 -34.54 32.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.13 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -119.44 90.29 42.21 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.617 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -70.39 -15.68 34.77 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.116 1.877 . . . . 10.0 111.63 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -72.49 -7.88 52.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.303 -0.862 . . . . 10.0 110.918 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 730' ' ' LEU . . . . . 0.45 HD22 ' HA ' ' A' ' 730' ' ' LEU . 0.3 OUTLIER -65.92 -35.56 80.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.301 179.587 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 51.92 -102.18 0.12 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.426 -0.807 . . . . 10.0 111.066 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -141.64 -53.07 0.44 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.017 0.437 . . . . 10.0 110.465 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -56.26 -48.7 76.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.637 -0.71 . . . . 10.0 111.385 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 2.4 m -66.25 -28.4 68.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.239 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 48.1 tp -66.46 -41.95 88.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.462 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 736' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 736' ' ' ARG . 55.9 mtt-85 -60.82 -39.65 89.78 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.815 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -60.75 -42.79 98.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.604 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 738' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 738' ' ' ARG . 7.6 mmm-85 -64.45 -43.41 94.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.561 -0.745 . . . . 10.0 111.388 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 94.1 mt -62.7 -48.71 86.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.976 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 34.3 tp -64.42 -46.23 84.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.054 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.71 88.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 10.0 111.433 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -66.06 -36.06 82.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.554 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 54.1 p -63.79 -37.72 88.41 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.814 0.34 . . . . 10.0 110.2 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 744' ' ' ILE . . . . . 0.409 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 30.6 mt -72.58 -38.21 58.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.079 -0.51 . . . . 10.0 109.882 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -58.97 -49.66 77.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.131 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 60.3 t -66.57 -36.07 76.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.102 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -60.08 -48.2 82.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.414 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 748' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 27.2 mt-30 -60.61 -40.82 93.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.806 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 749' ' ' ARG . . . . . 0.431 HH11 ' HD3' ' A' ' 749' ' ' ARG . 19.8 ttp-105 -63.05 -43.39 98.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.349 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -70.09 -37.33 75.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.134 0.492 . . . . 10.0 109.988 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.9 -42.08 98.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.64 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -62.33 -19.95 63.85 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.235 0.458 . . . . 10.0 112.235 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.6 t -82.99 -43.58 18.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.131 0.491 . . . . 10.0 110.68 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 17.4 t -81.84 -37.49 15.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.244 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 119.81 134.25 4.75 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 110.706 -0.957 . . . . 10.0 110.706 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 756' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -54.03 -59.58 4.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.727 0.299 . . . . 10.0 111.789 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 26.3 mp0 -63.51 -36.13 82.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.085 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 16.1 tpt -65.15 -41.46 94.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.688 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 47.3 mmm -62.18 -40.22 95.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.727 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.499 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -59.58 -39.62 84.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.367 0.604 . . . . 10.0 110.027 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -70.59 -36.93 73.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.677 -0.692 . . . . 10.0 109.735 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -66.5 -47.56 72.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.294 -0.866 . . . . 10.0 110.245 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -58.15 -45.33 87.61 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.39 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -60.9 -45.54 94.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.385 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.34 -47.25 90.92 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 121.086 -0.578 . . . . 10.0 112.454 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.28 -44.41 95.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.703 0.287 . . . . 10.0 110.556 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -56.83 -50.4 72.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.119 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.28 -45.94 91.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.579 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.98 -44.25 96.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.591 -0.277 . . . . 10.0 110.979 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 11.1 m -62.64 -38.91 92.1 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.478 -0.328 . . . . 10.0 110.557 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 17.8 mt -59.87 -52.1 66.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.519 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -61.86 -42.02 98.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.718 -0.674 . . . . 10.0 111.303 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 44.1 m -58.95 -54.21 49.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.561 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 6.1 mp -67.7 -27.66 67.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.669 -0.242 . . . . 10.0 111.366 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 15.5 t-105 -62.53 -41.75 99.07 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.47 ' C ' ' HD2' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -61.12 -47.31 86.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.685 -0.688 . . . . 10.0 109.628 178.967 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -42.62 76.4 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.205 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 778' ' ' HIS . . . . . 0.658 ' O ' ' HG2' ' A' ' 782' ' ' MET . 59.2 t60 -65.01 -46.46 81.27 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.445 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 779' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 779' ' ' LEU . 25.6 mt -59.57 -46.42 88.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.873 0.368 . . . . 10.0 111.01 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.54 90.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.766 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.99 -34.38 76.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.623 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 782' ' ' MET . . . . . 0.658 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 97.3 mmm -58.0 -50.95 71.63 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.176 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 783' ' ' ASP . . . . . 0.539 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 8.1 t70 -73.24 -36.3 66.39 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-O 120.651 0.262 . . . . 10.0 110.417 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -56.98 -36.87 70.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.605 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 57.3 tp -88.62 -30.93 18.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.499 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -56.76 -45.96 81.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.683 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 787' ' ' GLN . . . . . 0.539 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 10.0 pt20 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.158 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo . . . . . 0 CA--C 1.529 0.253 0 N-CA-C 113.321 0.47 . . . . 10.0 113.321 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 800' ' ' LYS . . . . . 0.475 ' HB2' ' NZ ' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -67.97 -43.5 78.83 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 -179.755 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -64.21 -39.36 93.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.526 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.36 -46.53 79.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.929 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 803' ' ' TYR . . . . . 0.408 ' CD2' ' HD1' ' A' ' 648' ' ' TYR . 72.6 t80 -59.29 -38.92 81.42 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.125 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -59.24 -46.12 89.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.931 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 34.8 mtm105 -58.9 -46.93 86.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.236 0.541 . . . . 10.0 110.077 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -59.42 -43.86 92.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.563 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 14.3 m -67.36 -38.78 85.34 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.446 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -67.21 -41.04 86.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.732 0.301 . . . . 10.0 110.4 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 10.9 m -65.77 -39.35 90.92 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 22.9 ttm -63.73 -34.9 78.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.278 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -69.54 -45.72 68.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.543 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.8 -50.55 71.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.972 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -60.1 -32.38 70.93 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.074 0.464 . . . . 10.0 110.861 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 40.8 ttp -65.64 -49.22 69.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.029 179.012 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.26 -40.57 94.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 816' ' ' GLU . . . . . 0.435 ' HA ' ' HE2' ' A' ' 819' ' ' LYS . 34.6 mm-40 -61.11 -41.88 97.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.083 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 4.8 m -75.78 -28.34 58.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.569 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 31.0 tp -61.08 -60.38 3.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.857 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 819' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 816' ' ' GLU . 44.7 pttt -59.16 -32.97 70.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.692 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -62.82 -57.41 10.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.679 -0.692 . . . . 10.0 111.31 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -65.39 -34.11 77.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.911 -178.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 822' ' ' VAL . . . . . 0.417 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 39.6 t -58.62 -53.27 49.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.712 0.291 . . . . 10.0 110.511 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 33.9 mm -64.66 -39.76 86.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.535 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 36.2 m -62.37 -50.64 70.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.05 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 29.0 m -58.26 -41.77 85.0 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 111.961 0.356 . . . . 10.0 111.961 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 826' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 98.9 mt -65.55 -23.98 67.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.936 0.398 . . . . 10.0 111.343 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 4.5 m -95.34 -21.19 18.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.365 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 828' ' ' LYS . . . . . 0.412 ' HE3' ' O ' ' A' ' 713' ' ' ASP . 88.0 mttt -74.49 -9.92 59.05 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.565 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.4 p -56.97 125.79 13.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 121.198 0.523 . . . . 10.0 110.439 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -104.7 115.71 30.79 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.193 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 3.4 m . . . . . 0 C--N 1.321 -0.637 0 CA-C-N 115.322 -0.854 . . . . 10.0 109.089 179.267 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 109.813 -0.44 . . . . 10.0 109.813 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -137.77 144.48 41.62 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.848 0.356 . . . . 10.0 110.191 179.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 114.52 137.27 6.42 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 121.102 -0.57 . . . . 10.0 111.853 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.88 128.2 20.51 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.028 0.442 . . . . 10.0 111.223 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.494 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 1.2 mmp_? -63.19 142.76 58.26 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.668 -0.696 . . . . 10.0 111.492 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.438 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 0.9 OUTLIER 71.89 -81.99 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.302 -0.863 . . . . 10.0 112.232 179.129 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -49.65 -66.16 0.44 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.92 0.711 . . . . 10.0 112.92 -178.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 19' ' ' ARG . 7.8 ttm105 -71.02 -27.63 63.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.679 0.276 . . . . 10.0 111.454 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.9 m -61.88 -38.08 86.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.371 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 14' ' ' ASN . 90.1 mt -59.55 -49.83 76.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.678 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 16' ' ' ARG . 26.8 ptt-85 -75.62 -29.34 59.17 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.813 -0.355 . . . . 10.0 111.383 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -63.93 -40.68 97.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.094 0.473 . . . . 10.0 109.736 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.444 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -68.49 -35.46 77.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.124 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.7 tpp180 -61.26 -35.62 77.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.617 -0.72 . . . . 10.0 110.783 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.89 -40.82 85.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.654 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.0 t -74.78 -39.81 46.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.448 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.8 t -57.57 -37.92 61.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.658 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -62.64 -44.73 95.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.498 . . . . 10.0 110.206 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.1 mt -60.77 -45.11 98.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.345 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 61.9 mt -59.56 -43.16 90.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.513 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -66.68 -33.18 75.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.488 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.496 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -76.81 -34.11 57.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.155 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 16.4 ttt -83.18 -9.66 59.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.361 -0.382 . . . . 10.0 111.295 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.435 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 19.3 tt0 -58.72 -51.74 79.67 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-O 119.39 -0.338 . . . . 10.0 111.885 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.496 ' HD2' ' O ' ' A' ' 30' ' ' ALA . 60.3 Cg_exo -53.87 -33.37 71.3 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.082 1.854 . . . . 10.0 111.772 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -71.37 -39.54 71.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.275 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 20.0 mmt -65.73 -33.59 76.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.621 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -66.5 -14.02 61.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.057 0.456 . . . . 10.0 110.813 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -94.81 -8.09 38.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.362 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.9 mp -88.45 142.0 28.07 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.675 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 p -75.15 167.07 22.62 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.725 0.297 . . . . 10.0 110.529 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.83 -42.98 90.52 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.384 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -69.8 -19.7 63.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.507 -0.315 . . . . 10.0 111.423 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -75.43 -36.76 60.72 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 110.293 -0.262 . . . . 10.0 110.293 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.7 mt -61.79 -41.41 97.7 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -64.74 -35.11 80.01 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.58 -1.191 . . . . 10.0 109.416 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.63 -28.83 70.36 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.341 -0.845 . . . . 10.0 112.295 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -71.83 -37.19 70.36 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 33.1 m -60.87 -45.25 95.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 10.0 109.959 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.62 -33.09 73.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.011 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -63.34 -43.62 97.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.573 -0.74 . . . . 10.0 110.304 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.7 m-30 -61.38 -37.26 82.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.284 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 9.4 tpp180 -60.54 -45.4 93.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.729 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.57 -44.3 74.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.896 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 -61.09 -37.11 81.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.279 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.0 mt -59.93 -38.04 81.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.389 -0.368 . . . . 10.0 111.077 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -86.56 -14.34 43.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.066 0.46 . . . . 10.0 110.706 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -77.69 -52.57 8.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.71 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 157.45 45.93 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.398 -0.819 . . . . 10.0 111.594 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -117.63 139.01 51.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.706 0.289 . . . . 10.0 110.338 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 42.6 t -85.51 138.66 18.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.813 -0.439 . . . . 10.0 109.813 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.46 HD11 ' O ' ' A' ' 118' ' ' LEU . 22.6 tp -57.74 -45.0 86.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.985 0.421 . . . . 10.0 110.836 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 25.7 mp0 -64.7 -16.97 63.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.835 -0.62 . . . . 10.0 111.433 179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -91.95 -14.7 29.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.07 0.462 . . . . 10.0 110.298 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.2 mt -87.61 -8.91 55.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.144 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.481 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 69.8 mt -50.16 -50.92 66.97 Favored Pre-proline 0 CA--C 1.543 0.699 0 N-CA-C 113.387 0.884 . . . . 10.0 113.387 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.481 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.7 Cg_exo -52.05 -48.39 21.85 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 122.251 1.967 . . . . 10.0 113.199 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.5 ' O ' HG23 ' A' ' 70' ' ' VAL . 48.1 mt-10 -77.04 -43.99 32.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.621 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.502 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -59.15 -51.6 69.31 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.184 0.438 . . . . 10.0 112.184 -178.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -63.74 -32.38 73.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.661 0.267 . . . . 10.0 111.178 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.23 -43.37 91.64 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.855 -0.424 . . . . 10.0 109.855 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 66' ' ' GLU . 96.9 t -62.36 -43.05 97.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.127 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 67' ' ' ALA . 46.2 t -62.01 -44.32 98.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.565 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.427 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 9.8 ttm180 -62.02 -40.87 97.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.393 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -67.57 -52.9 33.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.267 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.72 -41.72 77.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.712 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.1 m -62.59 -31.38 72.19 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -179.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -72.46 -20.43 61.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.662 0.268 . . . . 10.0 111.195 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -100.55 -27.53 13.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.826 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 90.1 t -89.82 -51.45 12.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.688 0.28 . . . . 10.0 111.725 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -104.84 -26.88 12.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.041 0.448 . . . . 10.0 111.124 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 85.66 11.67 73.82 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.862 -0.685 . . . . 10.0 111.499 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 68.3 mtt -112.2 122.02 46.57 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.803 0.335 . . . . 10.0 110.603 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.411 ' HD2' ' OE2' ' A' ' 32' ' ' GLU . 12.7 ttp180 -84.03 134.32 34.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.111 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -70.38 115.66 9.82 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -60.97 156.21 18.19 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.369 0.418 . . . . 10.0 111.254 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -60.12 -37.14 79.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.144 -179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.3 m -65.13 -32.28 57.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.902 0.382 . . . . 10.0 110.57 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -73.77 -33.54 64.3 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.079 -0.509 . . . . 10.0 109.74 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.56 -39.03 92.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.57 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.447 ' O ' HG23 ' A' ' 93' ' ' VAL . 67.8 mt -62.2 -53.05 60.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.198 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.76 -45.95 95.18 Favored Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 115.745 -0.661 . . . . 10.0 112.444 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.22 -32.49 82.78 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.284 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.444 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 25.9 ttm -71.88 -38.95 69.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.826 0.346 . . . . 10.0 110.343 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 89' ' ' LEU . 90.7 t -67.6 -30.96 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.398 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.0 mt -69.2 -3.67 14.57 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.675 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -83.26 -20.85 33.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.527 0.68 . . . . 10.0 109.369 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -93.39 -162.92 0.98 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.538 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.7 ttt180 -107.38 58.64 0.62 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.56 -0.904 . . . . 10.0 108.56 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 3.1 m -130.58 164.52 24.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.295 -0.866 . . . . 10.0 111.224 -178.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.513 HD12 HG11 ' A' ' 211' ' ' VAL . 44.4 mm -109.88 127.36 66.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.692 -0.685 . . . . 10.0 109.24 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.83 127.94 53.84 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.995 0.369 . . . . 10.0 111.995 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -82.07 124.49 29.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.64 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 19.0 ttm -120.03 124.32 45.59 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.76 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.589 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 8.8 mmm180 -70.24 152.33 44.34 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.675 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.05 106.12 1.53 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.788 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 124.74 -18.96 7.08 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.618 -0.801 . . . . 10.0 113.884 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.649 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 10.2 mm-40 -58.82 -41.47 86.92 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 117.112 0.456 . . . . 10.0 112.095 -178.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.48 85.87 1.28 Allowed Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.523 -0.846 . . . . 10.0 112.324 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -65.43 -47.76 75.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.7 0.286 . . . . 10.0 111.551 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 55.7 m -63.55 -29.27 70.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.914 0.387 . . . . 10.0 111.559 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.2 tp -87.4 6.92 31.39 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.956 0.408 . . . . 10.0 111.154 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 40.8 m -120.83 -43.09 2.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.877 0.37 . . . . 10.0 110.597 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.67 -15.63 63.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.405 0.521 . . . . 10.0 112.405 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.6 -21.83 61.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.821 0.343 . . . . 10.0 111.921 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 11.6 mt -74.43 -57.57 2.09 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.58 -28.22 69.82 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 122.005 1.803 . . . . 10.0 112.156 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -64.96 -50.28 67.02 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.505 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.403 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 58.6 t80 -61.87 -44.37 96.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.952 0.405 . . . . 10.0 110.797 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.46 ' O ' HD11 ' A' ' 60' ' ' LEU . 49.6 tp -59.47 -54.31 48.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.83 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -71.0 -22.8 62.12 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.024 -0.27 . . . . 10.0 111.629 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.485 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -67.43 -27.71 67.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.817 0.342 . . . . 10.0 111.121 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 73.7 mt -60.17 -25.16 65.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.605 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.3 p -71.66 -20.46 61.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.018 0.437 . . . . 10.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.47 6.39 76.0 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.161 -0.542 . . . . 10.0 112.986 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 46.2 mmtt -79.2 -24.22 43.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.921 0.36 . . . . 10.0 110.778 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 106.05 117.01 4.24 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.629 -0.796 . . . . 10.0 113.559 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 74.1 t -87.82 115.05 27.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.1 m170 -94.03 101.39 13.43 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.084 0.468 . . . . 10.0 111.17 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 40.7 t -89.94 122.75 41.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.924 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.2 t -101.84 119.98 50.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.669 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.05 158.0 18.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.674 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.4 m -72.3 -31.12 37.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.977 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -145.79 172.04 13.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.584 0.231 . . . . 10.0 110.922 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -73.96 -26.81 60.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.198 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -58.67 -58.68 7.52 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.665 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.28 -35.6 80.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.912 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.58 -50.07 74.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.107 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.64 -25.3 49.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.879 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -66.22 -60.29 2.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.754 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.58 -29.63 69.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.057 -0.519 . . . . 10.0 111.475 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.52 -49.77 76.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.82 0.343 . . . . 10.0 111.237 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -79.36 -27.86 41.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.151 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ASN . . . . . 0.432 ' O ' ' HD2' ' A' ' 145' ' ' PRO . 8.2 t30 -71.55 -45.42 62.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.298 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -86.68 -3.26 59.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.209 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.515 ' HA ' HG21 ' A' ' 154' ' ' VAL . 59.6 ttm-85 -59.81 -50.08 88.42 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' PRO . . . . . 0.496 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 24.5 Cg_exo -64.56 -5.22 9.7 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 122.201 1.934 . . . . 10.0 112.701 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 23.9 tp -96.7 -54.65 3.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.955 0.407 . . . . 10.0 110.224 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -67.81 -44.34 77.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.265 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.462 ' HA ' ' O ' ' A' ' 152' ' ' LEU . 3.7 mt-10 -70.69 -16.7 62.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.918 0.389 . . . . 10.0 111.135 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.468 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 73.3 t80 -73.03 -27.43 61.76 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.422 0.629 . . . . 10.0 109.588 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 30.5 mt -95.55 -8.03 36.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.206 -0.907 . . . . 10.0 110.94 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 112.96 -14.85 23.8 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.559 -0.829 . . . . 10.0 113.454 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 148' ' ' GLU . 85.3 mt -71.41 156.27 39.67 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.951 0.405 . . . . 10.0 111.021 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 16.2 p -107.51 136.41 47.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.336 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.515 HG21 ' HA ' ' A' ' 144' ' ' ARG . 45.1 t -110.27 122.4 64.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.135 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -117.31 139.34 14.91 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 121.119 -0.562 . . . . 10.0 112.002 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 5.5 tp -112.89 130.45 66.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.05 0.452 . . . . 10.0 110.688 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -115.57 107.35 15.03 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.003 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 94.0 mt -102.36 145.44 30.52 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.495 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' PRO . . . . . 0.428 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 19.7 Cg_endo -59.02 113.94 1.79 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.612 2.208 . . . . 10.0 112.049 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 105.81 0.45 39.35 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.801 -0.714 . . . . 10.0 112.433 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' MET . . . . . 0.599 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 39.4 ttm -66.22 137.87 95.79 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 110.396 -0.224 . . . . 10.0 110.396 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.97 152.38 71.43 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.491 2.128 . . . . 10.0 112.371 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' ALA . . . . . 0.415 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.45 -47.39 96.45 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.862 0.69 . . . . 10.0 112.862 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.415 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 77.6 Cg_exo -52.26 -49.42 17.46 Favored 'Trans proline' 0 C--N 1.361 1.218 0 C-N-CA 121.831 1.687 . . . . 10.0 112.645 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.59 -38.06 86.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.088 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 161' ' ' MET . 59.1 mttm -59.92 -45.09 93.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.48 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -59.62 -35.32 74.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.845 -0.616 . . . . 10.0 111.124 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -70.15 -39.0 75.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.052 0.453 . . . . 10.0 110.422 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -73.6 -38.43 65.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.74 -0.663 . . . . 10.0 111.551 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -74.9 -25.2 58.76 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.524 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -84.34 -1.84 56.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.114 0.483 . . . . 10.0 110.712 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -79.9 168.35 19.35 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.45 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' ASP . . . . . 0.485 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 18.3 m-20 -71.04 -40.59 71.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.16 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.2 mp -127.01 127.23 69.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.168 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 5.2 m -117.33 125.37 50.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.884 0.373 . . . . 10.0 111.244 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -103.28 129.57 50.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -165.95 172.15 41.27 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.103 -1.046 . . . . 10.0 113.171 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.95 151.84 19.69 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.466 -0.198 . . . . 10.0 110.466 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -61.57 -36.42 80.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.755 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -58.26 -54.91 41.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.255 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.428 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 3.7 tp10 -67.72 -35.71 79.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.959 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -55.03 -40.99 70.8 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.385 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -74.68 -40.97 36.32 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.008 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -63.92 -39.28 93.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.75 0.31 . . . . 10.0 110.573 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 185' ' ' ASP . . . . . 0.411 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 19.6 m-20 -60.86 -41.98 96.97 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.98 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -62.73 -39.62 94.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.197 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 75.3 mt -66.86 -45.95 76.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.883 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 68.5 mtm-85 -63.82 -38.54 91.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.888 0.375 . . . . 10.0 110.969 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -64.45 -46.39 83.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.616 -0.72 . . . . 10.0 111.087 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -73.24 -20.98 60.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.622 -0.717 . . . . 10.0 112.064 -178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 22.9 ttp -99.87 26.57 6.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.112 0.482 . . . . 10.0 110.9 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -87.89 161.53 17.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.537 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -102.56 -29.06 11.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.083 0.468 . . . . 10.0 110.484 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.09 140.56 31.24 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.02 -26.28 81.98 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.693 2.262 . . . . 10.0 112.638 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -75.62 -11.09 59.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.542 -0.299 . . . . 10.0 111.305 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.78 -13.81 58.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.629 -0.26 . . . . 10.0 110.672 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -53.45 155.23 3.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.951 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 14.7 m -130.93 -20.81 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.374 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -89.31 -179.09 5.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.753 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -133.44 -79.87 0.48 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.534 -0.303 . . . . 10.0 110.974 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 19.5 ttmm -151.93 142.27 22.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.8 0.334 . . . . 10.0 110.562 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 9.9 mt -93.04 60.41 3.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.343 0.592 . . . . 10.0 109.752 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -81.01 -56.71 3.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.623 -0.717 . . . . 10.0 112.285 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -132.69 137.36 46.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.033 0.445 . . . . 10.0 111.623 -178.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.497 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -134.01 129.43 36.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.427 -0.806 . . . . 10.0 109.741 178.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 55.0 tp -124.07 108.49 12.4 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.176 -0.465 . . . . 10.0 109.808 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -96.82 132.1 42.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.184 0.516 . . . . 10.0 111.254 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -60.98 -53.84 52.29 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.368 -0.833 . . . . 10.0 112.352 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 210' ' ' GLU . . . . . 0.55 ' HB2' HH21 ' A' ' 509' ' ' ARG . 34.4 tt0 -123.97 108.3 12.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.005 0.431 . . . . 10.0 111.027 -179.147 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.513 HG11 HD12 ' A' ' 99' ' ' ILE . 32.9 m -84.47 -21.11 8.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.6 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 212' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.0 OUTLIER -53.77 -34.56 59.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.703 -0.68 . . . . 10.0 111.379 -179.703 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 8.9 p -107.2 -57.16 2.11 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.923 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.66 -37.91 68.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 113.485 0.92 . . . . 10.0 113.485 -177.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 215' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 219' ' ' ALA . 10.9 mt -94.19 -28.79 15.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.773 0.657 . . . . 10.0 112.773 -178.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 216' ' ' ILE . . . . . 0.404 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 40.3 mm -92.1 -63.05 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 112.406 0.521 . . . . 10.0 112.406 -178.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -69.65 -47.47 63.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.857 0.317 . . . . 10.0 111.857 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 218' ' ' GLU . . . . . 0.439 ' HA ' ' OG1' ' A' ' 221' ' ' THR . 6.1 mm-40 -80.3 12.31 3.02 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.682 0.623 . . . . 10.0 112.682 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 219' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 215' ' ' LEU . . . -63.92 -42.83 97.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.773 0.32 . . . . 10.0 111.515 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 7.1 mtp-105 -102.39 28.24 6.11 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 221' ' ' THR . . . . . 0.439 ' OG1' ' HA ' ' A' ' 218' ' ' GLU . 4.5 m -96.44 110.29 52.0 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 120.712 0.291 . . . . 10.0 110.232 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -90.54 125.53 1.15 Allowed 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.901 2.401 . . . . 10.0 112.795 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 223' ' ' LEU . . . . . 0.603 ' O ' ' HA ' ' A' ' 374' ' ' SER . 80.8 mt -78.79 90.65 4.67 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.343 -0.614 . . . . 10.0 109.343 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.487 HG23 HG22 ' A' ' 371' ' ' THR . 90.1 mt -88.95 117.49 32.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.801 -178.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 58.7 mt -96.44 113.03 29.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 6.3 m -99.33 76.3 2.04 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.212 0.53 . . . . 10.0 110.395 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -114.89 89.16 0.49 Allowed Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.66 -0.781 . . . . 10.0 112.14 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 228' ' ' PRO . . . . . 0.405 ' HB2' ' HB3' ' A' ' 367' ' ' ASN . 74.3 Cg_endo -78.21 169.86 19.55 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.659 2.239 . . . . 10.0 112.216 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -94.74 -2.11 51.67 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.622 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 230' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' A' ' 367' ' ' ASN . 94.2 mt-10 58.12 -115.15 0.81 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.581 -0.736 . . . . 10.0 111.168 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 13.6 t70 54.58 -130.7 2.06 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 123.552 0.533 . . . . 10.0 110.483 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 7.0 m -147.84 99.96 3.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.952 0.406 . . . . 10.0 110.3 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.09 65.65 7.31 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.179 0.514 . . . . 10.0 110.76 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 234' ' ' GLU . . . . . 0.846 ' HA ' HD12 ' A' ' 365' ' ' ILE . 39.3 mm-40 -67.09 -5.91 15.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.666 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -59.51 -32.05 69.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.175 -0.466 . . . . 10.0 111.239 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.07 -32.99 74.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.624 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 237' ' ' LYS . . . . . 0.776 ' HB2' HD11 ' A' ' 365' ' ' ILE . 14.3 ttmt -67.98 -21.13 65.08 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.007 0.432 . . . . 10.0 111.186 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 238' ' ' ARG . . . . . 0.445 ' NH1' ' HB3' ' A' ' 234' ' ' GLU . 1.4 mpt_? -79.58 -18.86 50.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.051 0.453 . . . . 10.0 110.091 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 21.3 t -82.2 -47.99 18.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.035 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 240' ' ' ASN . . . . . 0.464 ' ND2' ' HA ' ' A' ' 360' ' ' LYS . 14.3 t30 -69.06 -13.4 62.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.688 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -66.39 -17.42 64.77 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.198 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 12.4 tt -87.93 -16.39 9.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.836 0.35 . . . . 10.0 111.531 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 243' ' ' ILE . . . . . 0.559 ' N ' ' HD2' ' A' ' 244' ' ' PRO . 25.3 mm -67.09 -45.57 52.06 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 113.201 0.815 . . . . 10.0 113.201 -178.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 244' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 243' ' ' ILE . 16.1 Cg_endo -58.77 -6.96 3.8 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 122.426 2.084 . . . . 10.0 113.561 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 19.3 t60 -87.41 -6.06 58.59 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 246' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 252' ' ' GLU . 2.8 mt -113.72 168.7 9.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.02 -178.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 51.8 mt -125.72 129.4 72.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.168 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 248' ' ' ARG . . . . . 0.668 ' HA ' ' O ' ' A' ' 253' ' ' ASP . 2.4 ptm180 -67.0 87.21 0.14 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.539 0.685 . . . . 10.0 111.06 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? 179.45 -41.62 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 250' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' ' 251' ' ' LYS . 4.2 mt-10 -160.14 157.25 28.08 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 114.692 -1.14 . . . . 10.0 108.738 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 250' ' ' GLU . 62.4 mttm 71.37 82.23 0.15 Allowed 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.871 0.732 . . . . 10.0 110.671 -179.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 252' ' ' GLU . . . . . 0.731 ' OE2' ' HA ' ' A' ' 282' ' ' ILE . 4.9 mm-40 67.75 -85.94 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.165 0.802 . . . . 10.0 113.165 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 253' ' ' ASP . . . . . 0.668 ' O ' ' HA ' ' A' ' 248' ' ' ARG . 43.8 t0 -53.35 104.87 0.11 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.97 0.414 . . . . 10.0 111.93 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 254' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 257' ' ' PHE . 73.7 m -165.28 123.88 1.67 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.754 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 255' ' ' GLU . . . . . 0.431 ' CD ' HH21 ' A' ' 248' ' ' ARG . 1.0 OUTLIER -73.94 89.2 1.88 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.189 0.519 . . . . 10.0 110.434 179.273 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 5.8 m 74.75 -64.1 0.4 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.244 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 257' ' ' PHE . . . . . 0.408 ' HB2' ' HB3' ' A' ' 254' ' ' SER . 9.8 t80 64.24 -86.68 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.299 0.64 . . . . 10.0 111.508 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 56.94 34.15 24.4 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.876 0.369 . . . . 10.0 111.138 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 93.59 -45.94 2.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.808 -0.71 . . . . 10.0 112.435 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -129.25 -76.73 0.55 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.949 0.404 . . . . 10.0 110.941 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 91.74 -71.71 1.74 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.047 -0.597 . . . . 10.0 111.964 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -165.66 175.24 9.02 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.2 165.14 25.68 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.933 -0.395 . . . . 10.0 109.933 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 2.6 m -77.12 68.9 3.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.027 0.442 . . . . 10.0 111.794 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -146.96 71.34 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.033 -0.53 . . . . 10.0 109.954 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 1.2 t70 56.57 68.49 0.85 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.975 0.893 . . . . 10.0 108.816 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 267' ' ' GLU . . . . . 0.552 ' CD ' ' H ' ' A' ' 267' ' ' GLU . 0.6 OUTLIER -83.46 23.38 0.94 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.354 -1.294 . . . . 10.0 112.955 -177.318 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 268' ' ' LYS . . . . . . . . . . . . . 3.8 ptpp? -65.11 104.82 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.45 0.643 . . . . 10.0 110.838 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 269' ' ' SER . . . . . 0.495 ' HB3' ' OE1' ' A' ' 271' ' ' GLN . 19.7 m -79.62 85.8 5.31 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.464 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 270' ' ' ARG . . . . . 0.589 ' HA ' HD13 ' A' ' 319' ' ' LEU . 43.2 mtm180 -77.66 10.95 2.32 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -178.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 271' ' ' GLN . . . . . 0.495 ' OE1' ' HB3' ' A' ' 269' ' ' SER . 4.2 pm0 -90.79 8.68 33.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.392 0.615 . . . . 10.0 109.785 178.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 13.9 t 63.45 -101.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.129 0 CA-C-N 114.963 -1.017 . . . . 10.0 110.812 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 65.57 -78.18 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.224 0.61 . . . . 10.0 112.13 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 63.6 mt 71.25 141.44 0.05 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.726 0.641 . . . . 10.0 109.983 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 3.7 m -152.14 -75.14 0.14 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.416 0.895 . . . . 10.0 113.416 -178.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.91 68.1 0.71 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 -176.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.39 14.95 13.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.346 -0.843 . . . . 10.0 110.877 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . -94.63 -33.79 6.59 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.878 -0.889 . . . . 10.0 110.878 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 64.54 26.87 13.39 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.382 0.611 . . . . 10.0 110.341 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 10.9 p -124.78 -15.55 4.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.424 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 64.5 mt -87.89 -43.77 11.56 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 282' ' ' ILE . . . . . 0.731 ' HA ' ' OE2' ' A' ' 252' ' ' GLU . 19.8 tt -60.4 -21.36 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.489 -0.778 . . . . 10.0 111.024 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -68.36 -9.53 48.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.606 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -87.9 -28.95 21.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.584 -0.28 . . . . 10.0 110.906 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.37 -44.89 20.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.96 0.409 . . . . 10.0 109.971 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 286' ' ' LEU . . . . . 0.408 HD21 ' HB2' ' A' ' 298' ' ' LEU . 26.9 mt -65.1 152.62 43.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.585 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 287' ' ' VAL . . . . . 0.554 ' HA ' ' HA ' ' A' ' 293' ' ' ASP . 26.5 t 71.32 151.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 O-C-N 123.642 0.589 . . . . 10.0 111.543 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 288' ' ' LYS . . . . . 0.531 ' N ' ' HB2' ' A' ' 293' ' ' ASP . 0.0 OUTLIER 74.39 163.03 0.26 Allowed 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.893 0.877 . . . . 10.0 112.099 179.063 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 289' ' ' GLU . . . . . 0.476 ' OE2' ' HA ' ' A' ' 289' ' ' GLU . 2.8 mm-40 73.76 -74.82 0.08 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.094 -0.957 . . . . 10.0 111.54 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 290' ' ' GLY . . . . . 0.53 ' O ' ' HB ' ' A' ' 291' ' ' ILE . . . 156.17 131.57 1.41 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.372 -0.918 . . . . 10.0 112.473 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 291' ' ' ILE . . . . . 0.53 ' HB ' ' O ' ' A' ' 290' ' ' GLY . 1.5 mp 78.23 125.95 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 N-CA-C 108.435 -0.95 . . . . 10.0 108.435 -178.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 292' ' ' MET . . . . . 0.558 ' SD ' HD13 ' A' ' 298' ' ' LEU . 48.1 ttp 69.78 21.03 6.61 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.904 -1.147 . . . . 10.0 107.904 -177.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 293' ' ' ASP . . . . . 0.554 ' HA ' ' HA ' ' A' ' 287' ' ' VAL . 0.7 OUTLIER -125.43 4.3 7.66 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.212 -1.358 . . . . 10.0 110.847 -179.209 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -80.21 -29.63 38.59 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.244 0.545 . . . . 10.0 109.842 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 139.75 15.9 0.53 Allowed Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.306 -0.861 . . . . 10.0 111.892 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -83.01 155.66 23.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.837 0.351 . . . . 10.0 110.734 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.78 153.54 19.38 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 179.032 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.558 HD13 ' SD ' ' A' ' 292' ' ' MET . 10.5 tp -89.1 -4.56 58.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.963 0.411 . . . . 10.0 111.122 -179.327 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 12.7 p90 -110.5 40.3 2.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.551 0.691 . . . . 10.0 110.106 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 43.5 m -124.23 148.4 57.7 Favored Pre-proline 0 C--N 1.32 -0.713 0 CA-C-N 115.357 -0.838 . . . . 10.0 109.776 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -60.66 -16.09 41.14 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.82 2.347 . . . . 10.0 112.73 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -92.93 8.33 40.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.146 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -151.49 35.84 0.57 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.344 0.592 . . . . 10.0 110.35 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 8.5 tp -81.95 -25.7 9.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.042 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 305' ' ' MET . . . . . 0.448 ' HG3' ' HG2' ' A' ' 777' ' ' GLU . 8.1 tmm? -66.13 -47.45 74.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.492 -0.322 . . . . 10.0 111.189 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 50.7 mt -68.57 -34.45 75.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.673 0.273 . . . . 10.0 110.553 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 10.5 tpt -57.25 -40.39 77.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.043 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -82.16 -2.05 50.95 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.229 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 43.2 m170 -102.31 -42.24 6.08 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 121.084 -0.246 . . . . 10.0 110.98 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 310' ' ' VAL . . . . . 0.546 HG21 HD21 ' A' ' 298' ' ' LEU . 23.1 m -69.03 -36.51 74.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.84 0.352 . . . . 10.0 111.108 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 3.0 p -67.83 -24.76 65.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.597 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 312' ' ' ALA . . . . . . . . . . . . . . . -65.41 -39.97 92.82 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.176 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -69.08 -33.14 73.06 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.536 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 35.0 tp -69.94 -45.77 66.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.049 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 315' ' ' ARG . . . . . . . . . . . . . 39.8 ptt180 -80.0 18.23 0.86 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.245 0.545 . . . . 10.0 110.866 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -124.78 3.34 8.16 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.459 0.647 . . . . 10.0 109.553 178.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -101.79 -77.69 0.54 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.957 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -88.33 -10.13 50.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.903 0.382 . . . . 10.0 111.275 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 319' ' ' LEU . . . . . 0.589 HD13 ' HA ' ' A' ' 270' ' ' ARG . 0.2 OUTLIER -80.16 -47.32 14.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.571 179.87 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -114.06 105.64 13.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.903 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 321' ' ' THR . . . . . 0.577 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 0.2 OUTLIER -84.81 136.79 33.53 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.425 0.631 . . . . 10.0 111.304 -179.314 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 322' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 5.2 tpt180 -66.83 140.7 57.83 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.807 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 323' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 0.5 OUTLIER 78.95 -15.39 0.77 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.157 0.983 . . . . 10.0 113.492 177.372 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 324' ' ' VAL . . . . . 0.577 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 2.6 p -115.86 -44.79 3.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 120.529 -0.468 . . . . 10.0 111.53 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -92.3 -25.45 18.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.335 0.588 . . . . 10.0 110.039 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 37.7 p90 -161.75 154.82 20.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.905 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 17.7 tt -136.71 132.61 48.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.904 0.383 . . . . 10.0 110.238 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 17.5 t -116.25 115.77 50.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.246 -0.65 . . . . 10.0 109.246 179.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 329' ' ' LYS . . . . . 0.42 ' O ' ' HD3' ' A' ' 329' ' ' LYS . 0.0 OUTLIER -124.21 117.47 24.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.822 -179.253 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 59.19 34.06 23.01 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.338 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 88.7 -8.93 78.03 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.661 -0.78 . . . . 10.0 112.845 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -89.08 116.09 27.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.942 0.401 . . . . 10.0 110.27 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 48.1 t -89.05 120.28 37.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.755 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 65.4 mt -124.09 130.48 73.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.953 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 53.4 mt -79.85 131.02 35.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.976 -0.379 . . . . 10.0 109.976 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 41.3 t -105.13 119.06 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.072 0.463 . . . . 10.0 110.241 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -86.5 123.92 32.24 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.312 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -90.27 -6.62 54.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.513 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -81.58 -48.54 11.64 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.032 0.382 . . . . 10.0 112.032 -178.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.99 2.58 8.69 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 69.02 54.41 14.18 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.567 -0.825 . . . . 10.0 111.859 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -114.0 150.91 33.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.64 0.257 . . . . 10.0 110.534 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.65 121.01 41.27 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.946 0.403 . . . . 10.0 111.12 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 49.2 mtt -107.45 99.24 8.77 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.861 -0.422 . . . . 10.0 109.861 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 345' ' ' GLN . . . . . 0.402 ' CD ' ' H ' ' A' ' 345' ' ' GLN . 0.0 OUTLIER -93.92 -8.3 40.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.678 -178.813 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -117.08 30.35 6.34 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.655 -0.784 . . . . 10.0 111.852 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -143.56 149.61 37.65 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.133 -0.321 . . . . 10.0 110.133 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -152.94 132.27 12.83 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.206 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -62.75 120.1 10.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.443 . . . . 10.0 111.334 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.6 m -71.63 -161.46 0.07 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.845 -0.616 . . . . 10.0 111.926 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 33.7 t70 64.12 23.36 13.17 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.755 0.788 . . . . 10.0 110.403 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 74.38 5.65 73.09 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.554 -0.748 . . . . 10.0 113.537 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 18.5 tp -64.24 -50.18 69.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 117.179 0.489 . . . . 10.0 110.602 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 354' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -61.95 -33.31 74.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.085 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 355' ' ' GLN . . . . . 0.577 ' HA ' ' NE2' ' A' ' 355' ' ' GLN . 0.8 OUTLIER -67.39 -34.9 78.23 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.155 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -66.56 -38.62 87.48 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.165 0.507 . . . . 10.0 110.004 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 85.4 t -68.32 -44.51 83.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.041 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -66.97 -19.31 65.7 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 115.683 -0.69 . . . . 10.0 110.876 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -95.46 -15.45 22.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.224 -0.444 . . . . 10.0 111.252 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 360' ' ' LYS . . . . . 0.464 ' HA ' ' ND2' ' A' ' 240' ' ' ASN . 35.9 ttpt -78.46 -49.07 14.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.269 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -93.11 179.95 5.28 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.4 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -78.46 55.14 4.07 Favored Glycine 0 CA--C 1.517 0.198 0 C-N-CA 121.134 -0.555 . . . . 10.0 112.774 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 2.9 t -108.54 155.2 9.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 110.024 -0.362 . . . . 10.0 110.024 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.27 110.42 11.97 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 365' ' ' ILE . . . . . 0.846 HD12 ' HA ' ' A' ' 234' ' ' GLU . 27.8 mt -66.77 130.85 32.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.812 -179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -84.75 -169.78 2.8 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.608 -0.724 . . . . 10.0 110.17 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 367' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 230' ' ' GLU . 5.5 t-20 -106.11 20.33 19.12 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.123 0.487 . . . . 10.0 110.305 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 60.06 -163.68 0.23 Allowed 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.224 -0.898 . . . . 10.0 111.639 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -159.65 81.91 0.74 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.816 -0.809 . . . . 10.0 108.816 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -123.33 -165.3 1.31 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.601 -179.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 371' ' ' THR . . . . . 0.487 HG22 HG23 ' A' ' 224' ' ' ILE . 1.7 p -73.4 103.67 4.14 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.14 0.793 . . . . 10.0 113.14 -178.072 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 5.9 tp -86.33 -30.48 22.19 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.698 -0.853 . . . . 10.0 108.698 177.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -166.07 133.74 2.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.482 -1.235 . . . . 10.0 108.136 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 374' ' ' SER . . . . . 0.603 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 24.3 m -152.4 148.16 27.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.051 0.453 . . . . 10.0 111.769 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 16.7 tt -155.41 139.53 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.504 -0.771 . . . . 10.0 109.977 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.1 143.98 26.76 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -57.21 -41.37 79.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.672 0.272 . . . . 10.0 110.983 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 378' ' ' GLN . . . . . 0.429 ' HA ' ' CE1' ' A' ' 405' ' ' TYR . 1.5 tm0? -59.89 -39.92 86.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.174 0.511 . . . . 10.0 110.359 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -81.71 -0.85 44.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.311 -179.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -102.59 -48.04 4.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.173 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -71.04 -21.58 62.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.123 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -72.43 -12.17 60.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.882 0.372 . . . . 10.0 110.999 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 42.7 mt -84.91 -18.38 34.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.798 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.497 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 39.0 m-85 -77.03 142.41 39.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.169 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -73.96 -64.31 1.04 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.95 0.405 . . . . 10.0 110.347 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -95.5 98.24 10.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.669 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 52.0 tp -107.41 110.03 21.9 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.072 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -130.21 163.99 25.49 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.206 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.35 168.89 41.97 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.422 -0.894 . . . . 10.0 112.398 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 35.9 mtm -105.75 140.01 39.44 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.211 -0.292 . . . . 10.0 110.211 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 3.4 t -124.27 156.5 36.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -91.22 174.76 38.93 Favored Glycine 0 N--CA 1.441 -0.988 0 C-N-CA 120.622 -0.799 . . . . 10.0 111.599 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 393' ' ' THR . . . . . 0.589 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 1.3 m -74.49 62.95 1.04 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.289 0.566 . . . . 10.0 110.499 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 394' ' ' ALA . . . . . 0.535 ' HB1' ' HG2' ' A' ' 566' ' ' ARG . . . -113.81 -43.18 3.31 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.474 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 395' ' ' ASP . . . . . 0.427 ' CG ' ' H ' ' A' ' 396' ' ' THR . 35.9 t70 59.66 -126.76 1.19 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 396' ' ' THR . . . . . 0.594 ' HB ' ' OE1' ' A' ' 397' ' ' GLU . 1.8 m 59.07 -93.78 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.77 0.428 . . . . 10.0 112.069 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 397' ' ' GLU . . . . . 0.594 ' OE1' ' HB ' ' A' ' 396' ' ' THR . 3.5 mp0 -75.77 2.28 12.59 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.943 0.401 . . . . 10.0 111.206 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -59.17 -26.09 64.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.65 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 399' ' ' PHE . . . . . 0.418 ' HD1' ' O ' ' A' ' 396' ' ' THR . 16.7 p90 -69.16 -23.06 63.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.969 0.414 . . . . 10.0 110.76 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.44 -13.38 60.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.5 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -59.37 -35.99 74.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.846 0.355 . . . . 10.0 110.558 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 402' ' ' SER . . . . . 0.481 ' O ' ' HA ' ' A' ' 406' ' ' LYS . 2.3 m -78.28 -18.23 55.58 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.656 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.2 m -100.36 -32.2 10.96 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.39 0.515 . . . . 10.0 112.39 -178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 55.4 mt -87.82 -49.58 14.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 111.736 0.273 . . . . 10.0 111.736 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 405' ' ' TYR . . . . . 0.429 ' CE1' ' HA ' ' A' ' 378' ' ' GLN . 96.6 m-85 -112.14 -5.73 14.21 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.994 -0.282 . . . . 10.0 111.654 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 406' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 402' ' ' SER . 3.9 mtpp 62.71 48.64 4.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.825 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 407' ' ' LEU . . . . . 0.418 HD13 HD11 ' A' ' 99' ' ' ILE . 16.6 mt -109.76 152.21 25.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.071 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 408' ' ' ASP . . . . . 0.494 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 22.3 t0 -93.52 135.22 34.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.506 -0.315 . . . . 10.0 110.318 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.83 118.65 27.5 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.31 -0.405 . . . . 10.0 111.373 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.26 137.43 57.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.294 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 5.1 m -102.32 140.18 21.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.592 0.235 . . . . 10.0 110.619 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 91.2 t -108.44 131.77 21.55 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.63 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.5 152.56 80.57 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.63 2.22 . . . . 10.0 112.278 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 1.5 p -78.71 157.03 28.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.491 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -64.92 -39.27 93.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.359 0.599 . . . . 10.0 109.835 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 -124.45 157.84 63.64 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.563 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.49 122.24 10.08 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.403 2.069 . . . . 10.0 111.793 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 27.6 mtm -72.47 112.02 8.16 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.851 0.358 . . . . 10.0 111.16 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 4.0 mt -103.84 54.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.562 0.696 . . . . 10.0 109.695 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 420' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 420' ' ' ARG . 33.5 ttp180 -98.38 104.2 16.21 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.358 -0.837 . . . . 10.0 109.905 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.86 98.89 2.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.933 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 422' ' ' ASP . . . . . 0.411 ' OD2' ' HD2' ' A' ' 572' ' ' ARG . 26.4 m-20 -84.02 114.66 21.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.765 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 39.5 mt -98.41 155.73 36.53 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.468 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -66.86 176.73 4.11 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.929 2.419 . . . . 10.0 112.878 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -93.03 130.02 38.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.559 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 64.2 mt -101.19 93.64 5.56 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.01 0.433 . . . . 10.0 109.956 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 427' ' ' VAL . . . . . 0.507 HG22 ' HB3' ' A' ' 588' ' ' LEU . 61.8 t -84.31 125.1 40.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.71 -0.677 . . . . 10.0 111.003 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 428' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 4.6 m-85 -114.45 176.73 4.92 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.85 -0.613 . . . . 10.0 109.942 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.2 mmm -78.55 -75.44 0.23 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.13 -0.228 . . . . 10.0 111.195 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 58.3 p -90.63 162.12 15.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.845 0.355 . . . . 10.0 111.353 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -61.95 -32.93 73.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.527 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 432' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 436' ' ' GLN . . . -57.32 -42.64 82.25 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.728 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -65.37 -46.94 78.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.277 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 434' ' ' LYS . . . . . 0.505 ' O ' HG13 ' A' ' 438' ' ' ILE . 4.7 ttpt -58.95 -54.14 50.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.314 -0.857 . . . . 10.0 111.129 -179.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 435' ' ' ILE . . . . . 0.558 ' O ' HG12 ' A' ' 439' ' ' ILE . 40.3 mm -60.09 -45.64 95.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.388 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 436' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 432' ' ' ALA . 0.2 OUTLIER -60.96 -37.22 81.65 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.218 -179.438 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.98 -36.66 83.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.087 0.47 . . . . 10.0 109.847 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 438' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 434' ' ' LYS . 79.9 mt -65.25 -46.48 90.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.753 178.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 439' ' ' ILE . . . . . 0.558 HG12 ' O ' ' A' ' 435' ' ' ILE . 42.1 mm -57.51 -41.16 78.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.497 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -66.24 -45.07 81.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.174 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.77 -39.14 87.68 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.13 0.491 . . . . 10.0 110.117 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.557 HG12 HG11 ' A' ' 452' ' ' VAL . 71.2 mt -70.83 -49.68 48.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.565 -0.743 . . . . 10.0 111.068 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -54.08 -42.6 69.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.791 -0.641 . . . . 10.0 112.081 -178.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.99 -34.6 78.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.303 0.573 . . . . 10.0 110.684 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.469 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 66.5 mtt-85 -82.19 -17.48 46.06 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.825 -179.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 1.8 m -69.25 -28.35 66.25 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -84.71 -23.66 29.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.656 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -87.36 -14.06 41.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.938 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 79.14 36.78 26.73 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.762 -0.733 . . . . 10.0 112.619 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 450' ' ' GLN . . . . . 0.469 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 63.7 tt0 -105.44 126.42 30.91 Favored Pre-proline 0 C--N 1.324 -0.531 0 O-C-N 122.712 -0.287 . . . . 10.0 110.542 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.87 136.17 44.12 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.535 2.157 . . . . 10.0 111.421 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.557 HG11 HG12 ' A' ' 442' ' ' ILE . 91.8 t -119.16 124.76 73.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.356 -0.384 . . . . 10.0 111.392 -178.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 52.5 tp -112.21 108.25 17.42 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.965 -0.562 . . . . 10.0 109.544 178.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 12.2 t -90.92 115.27 29.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.169 -0.468 . . . . 10.0 110.418 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -96.46 79.59 0.74 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.867 -0.682 . . . . 10.0 112.294 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 6.4 p -82.43 120.43 25.45 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.386 -0.227 . . . . 10.0 110.386 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 41.9 pt -89.93 -10.28 10.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.086 0.47 . . . . 10.0 110.638 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 458' ' ' SER . . . . . 0.499 ' OG ' ' HB2' ' A' ' 461' ' ' LYS . 25.8 p -116.57 127.01 54.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.506 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 24.2 mt -62.68 -32.95 57.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-O 120.897 0.38 . . . . 10.0 111.02 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -62.88 -33.03 74.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.977 0.418 . . . . 10.0 110.568 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.499 ' HB2' ' OG ' ' A' ' 458' ' ' SER . 0.0 OUTLIER -83.37 -30.66 27.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.769 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 17.5 m -59.32 -46.94 87.22 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.875 0.369 . . . . 10.0 110.697 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.74 -33.61 66.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.858 0.361 . . . . 10.0 110.376 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 46.7 tp -63.39 -53.05 58.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.69 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 8.1 p -63.56 -33.69 63.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.695 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 75.6 m -64.43 -42.22 96.15 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 120.744 0.307 . . . . 10.0 110.442 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -67.54 -40.3 85.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.13 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 468' ' ' GLU . . . . . 0.499 ' HG3' HG21 ' A' ' 435' ' ' ILE . 8.4 mm-40 -65.57 -41.66 92.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.851 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 51.8 mt -61.75 -36.69 81.75 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.9 0.381 . . . . 10.0 110.477 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.4 m -71.01 -33.45 70.38 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.294 0.569 . . . . 10.0 109.873 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -66.28 -40.36 90.03 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.483 -0.781 . . . . 10.0 110.576 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.94 -21.27 37.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.584 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 89.79 52.82 2.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.709 -0.758 . . . . 10.0 112.489 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 50.0 mt -124.82 127.28 72.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.722 0.296 . . . . 10.0 110.566 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' A' ' 500' ' ' VAL . 50.6 mttm -62.16 138.76 58.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.136 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 45.4 p-80 -156.88 147.54 21.56 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.882 0.372 . . . . 10.0 111.231 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -130.54 119.59 22.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.304 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.7 t -89.59 133.87 30.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.006 0.431 . . . . 10.0 111.408 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 86.4 mt -84.81 83.83 7.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.263 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -78.28 113.45 16.27 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.812 -0.44 . . . . 10.0 109.812 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -62.68 -10.11 11.42 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.897 0.703 . . . . 10.0 112.897 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -81.36 -10.17 59.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.985 0.422 . . . . 10.0 109.992 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -135.47 85.23 2.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.537 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' HIS . . . . . 0.406 ' HA ' ' OE1' ' A' ' 487' ' ' GLU . 45.3 m-70 -61.57 -32.96 73.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.259 -178.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.51 -36.03 82.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.025 0.441 . . . . 10.0 110.086 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.93 -44.06 73.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.462 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 487' ' ' GLU . . . . . 0.406 ' OE1' ' HA ' ' A' ' 484' ' ' HIS . 37.5 mt-10 -59.73 -47.83 84.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.433 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -60.26 -33.96 73.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.63 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -70.52 -38.56 74.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.808 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 50.8 mt -74.84 -45.68 43.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.799 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.0 t -55.36 -34.62 34.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.138 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -57.4 -31.49 65.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.542 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -124.62 26.59 7.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.734 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -69.02 -21.25 64.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.132 0.492 . . . . 10.0 110.902 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -100.08 14.12 60.04 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.771 -0.728 . . . . 10.0 111.671 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -75.52 140.44 71.94 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.208 -0.293 . . . . 10.0 110.208 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -52.59 125.98 19.54 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.689 2.26 . . . . 10.0 113.356 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 70.78 16.52 6.69 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.449 -0.796 . . . . 10.0 112.8 178.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.23 115.29 26.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.897 0.379 . . . . 10.0 110.105 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' A' ' 475' ' ' LYS . 53.8 t -96.1 108.03 20.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.247 0.546 . . . . 10.0 110.205 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 7.4 m -106.11 130.18 54.05 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.601 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 49.0 mt -109.41 119.28 58.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.2 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -109.19 130.29 55.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.87 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 7.0 m -100.72 93.58 5.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.816 0.341 . . . . 10.0 110.75 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 55.51 78.41 0.19 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.456 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 8.6 ttt -83.87 142.88 30.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.421 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -70.8 173.01 7.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.007 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -61.69 156.82 35.18 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 116.144 -0.48 . . . . 10.0 113.172 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.55 HH21 ' HB2' ' A' ' 210' ' ' GLU . 75.5 mtt180 70.77 -82.05 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.463 0.705 . . . . 10.0 111.302 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 79.73 170.65 40.72 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.53 -0.628 . . . . 10.0 111.53 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.28 148.47 49.72 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.585 0.231 . . . . 10.0 110.584 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.53 90.68 4.51 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.822 -0.436 . . . . 10.0 109.822 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 70.8 mt -70.7 114.74 9.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.692 -0.685 . . . . 10.0 111.235 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 3.9 t -89.71 133.84 30.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.663 -0.698 . . . . 10.0 110.182 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 53.7 mt -64.9 131.57 47.05 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.515 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 98.13 -17.17 59.06 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 121.079 -0.582 . . . . 10.0 111.743 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 115.66 -164.38 12.2 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.0 p -135.05 101.79 4.99 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 117.061 0.431 . . . . 10.0 110.624 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 53.3 p-90 -56.28 -28.15 57.75 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.315 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -61.0 -43.32 99.05 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.055 0.455 . . . . 10.0 110.662 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -73.09 -23.03 60.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.873 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -79.49 -47.06 16.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.042 -0.527 . . . . 10.0 110.574 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 523' ' ' VAL . . . . . 0.449 HG12 HD12 ' A' ' 537' ' ' ILE . 34.0 m -69.4 -23.45 26.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.927 0.394 . . . . 10.0 110.848 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -78.89 -10.85 59.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.009 0.433 . . . . 10.0 110.916 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -94.25 -3.1 51.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.665 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 58.5 mt -97.19 152.28 18.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.317 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -64.64 -61.22 2.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.554 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -131.1 97.28 20.34 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 529' ' ' PRO . . . . . 0.446 ' HA ' ' OE1' ' A' ' 533' ' ' GLN . 60.7 Cg_endo -81.17 93.18 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.613 2.209 . . . . 10.0 112.057 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 17.5 p -71.04 168.84 16.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.448 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.92 -41.42 70.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.936 0.398 . . . . 10.0 111.025 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -61.01 -43.58 98.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.053 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 533' ' ' GLN . . . . . 0.446 ' OE1' ' HA ' ' A' ' 529' ' ' PRO . 75.0 mt-30 -65.3 -46.64 79.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.731 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.421 HG22 ' HE2' ' A' ' 538' ' ' LYS . 75.1 mt -58.85 -49.24 83.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.314 -179.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -61.98 -41.88 98.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.036 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 20.1 tptp -61.08 -49.05 78.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.801 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 537' ' ' ILE . . . . . 0.449 HD12 HG12 ' A' ' 523' ' ' VAL . 74.6 mt -63.79 -39.29 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.706 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 538' ' ' LYS . . . . . 0.421 ' HE2' HG22 ' A' ' 534' ' ' ILE . 25.1 mtmt -62.11 -39.62 93.12 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.865 0.364 . . . . 10.0 110.277 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -62.92 -44.41 96.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.225 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -67.26 -41.95 84.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.115 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 70.9 t90 -60.46 -39.63 88.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.568 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -57.5 -46.03 84.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.469 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.61 -42.06 94.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.883 179.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 544' ' ' ARG . . . . . 0.465 ' O ' HG23 ' A' ' 548' ' ' VAL . 31.6 mtp180 -62.41 -38.54 90.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.824 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -66.77 -47.39 72.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.469 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -33.4 75.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.859 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.7 99.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.926 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 548' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 544' ' ' ARG . 67.7 t -65.82 -35.14 74.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.386 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 84.0 mt -62.26 -43.64 98.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.315 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.18 -18.15 61.29 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.913 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 551' ' ' ALA . . . . . 0.458 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -80.19 -30.49 38.76 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.398 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 125.82 19.14 2.29 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.571 -0.823 . . . . 10.0 112.973 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 72.21 -163.76 54.52 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.938 -0.649 . . . . 10.0 112.505 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 51.8 tp -77.91 119.68 21.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.918 0.389 . . . . 10.0 110.336 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.4 t60 -92.51 115.54 28.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.163 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 14.8 mm -98.83 132.8 43.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.929 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 557' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.8 mt -124.21 122.72 64.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.918 0.39 . . . . 10.0 110.517 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.89 116.71 5.24 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.897 -0.668 . . . . 10.0 111.437 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 19.0 p -74.37 -43.19 57.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.125 0.488 . . . . 10.0 110.656 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 560' ' ' GLU . . . . . 0.43 ' OE2' ' HG2' ' A' ' 461' ' ' LYS . 19.8 mp0 -136.72 145.21 44.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.631 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 561' ' ' ARG . . . . . 0.475 ' HB2' HD22 ' A' ' 594' ' ' LEU . 88.1 mtt-85 -95.36 166.85 11.68 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.854 -0.424 . . . . 10.0 109.854 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 562' ' ' HIS . . . . . 0.42 ' CE1' HD12 ' A' ' 567' ' ' ILE . 46.2 t-80 -107.39 149.85 27.41 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -57.02 -64.98 0.7 Allowed 'General case' 0 N--CA 1.462 0.148 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.75 117.45 10.48 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 108.937 -0.764 . . . . 10.0 108.937 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 565' ' ' ARG . . . . . 0.409 ' HB3' ' OG1' ' A' ' 396' ' ' THR . 14.2 tpt180 -61.66 -14.36 30.53 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.891 -178.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 566' ' ' ARG . . . . . 0.535 ' HG2' ' HB1' ' A' ' 394' ' ' ALA . 5.4 ttm180 -55.06 -45.41 75.32 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 121.002 0.43 . . . . 10.0 110.939 179.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 567' ' ' ILE . . . . . 0.42 HD12 ' CE1' ' A' ' 562' ' ' HIS . 61.3 mt -81.1 -31.75 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.458 . . . . 10.0 110.401 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -61.41 -51.48 68.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.135 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 569' ' ' ASN . . . . . 0.533 ' HB3' ' O ' ' A' ' 393' ' ' THR . 31.3 m-20 -65.27 -28.95 69.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.634 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -62.13 -36.75 82.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.214 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 40.3 tp -76.65 -35.72 57.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.377 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 572' ' ' ARG . . . . . 0.411 ' HD2' ' OD2' ' A' ' 422' ' ' ASP . 14.4 ttp180 -69.32 -30.8 68.94 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.16 0.505 . . . . 10.0 110.497 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -85.37 13.82 53.4 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 121.035 -0.602 . . . . 10.0 113.76 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 574' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 574' ' ' ARG . 3.9 mmt180 -75.46 -32.38 60.6 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 117.231 0.515 . . . . 10.0 110.279 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 4.7 t -91.03 166.63 12.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.471 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 67.16 54.02 23.01 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.724 -0.75 . . . . 10.0 112.571 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 15.2 mmt180 -69.02 117.23 10.41 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 578' ' ' GLN . . . . . 0.649 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 3.5 tt0 61.45 26.79 16.49 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.968 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 86.4 55.97 2.36 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.867 -0.683 . . . . 10.0 112.679 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -108.36 -169.3 1.48 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.94 -0.393 . . . . 10.0 109.94 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -95.25 150.3 20.39 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.962 0.41 . . . . 10.0 111.596 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.59 -179.18 48.37 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.135 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.6 p -155.31 128.57 8.3 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.144 -0.317 . . . . 10.0 110.144 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.11 125.45 52.16 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.785 0.326 . . . . 10.0 111.147 -179.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 585' ' ' ARG . . . . . 0.43 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 2.0 tpm_? -129.69 122.51 29.11 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -113.48 149.8 33.76 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.046 0.451 . . . . 10.0 110.777 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 587' ' ' TYR . . . . . 0.494 ' CD1' HG12 ' A' ' 438' ' ' ILE . 59.9 m-85 -129.0 162.06 28.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.988 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 588' ' ' LEU . . . . . 0.507 ' HB3' HG22 ' A' ' 427' ' ' VAL . 44.6 tp -162.51 149.41 13.32 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.104 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 92.5 p -123.3 169.94 10.8 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.808 -0.442 . . . . 10.0 109.808 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 71.4 mmm -83.61 0.22 47.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.144 0.497 . . . . 10.0 110.075 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -100.91 -17.37 16.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.005 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -70.71 147.48 49.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.13 0.49 . . . . 10.0 111.451 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -65.12 -15.88 62.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.558 -0.746 . . . . 10.0 112.735 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.546 ' O ' HG12 ' A' ' 597' ' ' ILE . 14.5 tp -64.81 -23.15 67.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.703 0.287 . . . . 10.0 111.406 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 7.0 mmt -75.49 -2.42 28.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.725 0.298 . . . . 10.0 111.442 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -95.17 -7.66 38.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.514 -0.312 . . . . 10.0 111.37 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.546 HG12 ' O ' ' A' ' 594' ' ' LEU . 20.2 pt -79.51 -13.09 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-O 120.945 0.402 . . . . 10.0 111.298 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -84.75 50.48 1.92 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.409 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 70.6 -55.83 0.62 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.812 0.845 . . . . 10.0 111.167 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 59.4 m -155.0 137.74 15.27 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -62.88 -17.2 61.28 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 602' ' ' ARG . . . . . 0.416 ' HD2' ' O ' ' A' ' 602' ' ' ARG . 1.8 tmm_? -64.32 -35.46 80.93 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.116 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 48.5 t -71.2 -46.37 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.91 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -20.03 63.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.522 -0.763 . . . . 10.0 111.213 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -62.93 -15.08 55.15 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 116.018 -0.537 . . . . 10.0 113.088 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 46.2 tpp -67.37 -21.56 65.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.095 0.474 . . . . 10.0 110.431 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 66.6 mtt -78.32 -11.24 59.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.569 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 608' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 608' ' ' ARG . 59.8 mtt-85 -69.17 -17.64 63.83 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.089 0.471 . . . . 10.0 110.298 179.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -102.74 28.37 6.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.766 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 22.6 tp -88.17 -14.59 38.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.23 0.538 . . . . 10.0 110.099 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 111.26 -48.07 0.98 Allowed Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.803 -0.635 . . . . 10.0 112.193 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 66.98 -77.54 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.368 0.667 . . . . 10.0 111.836 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 59.86 83.98 0.2 Allowed Pre-proline 0 N--CA 1.464 0.229 0 O-C-N 123.613 0.571 . . . . 10.0 110.992 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 614' ' ' PRO . . . . . 0.453 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 31.8 Cg_exo -58.13 105.03 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.833 2.355 . . . . 10.0 112.278 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 125.0 -14.68 7.46 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 121.023 -0.608 . . . . 10.0 111.71 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -110.57 129.56 55.77 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.061 -0.348 . . . . 10.0 110.061 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -83.3 100.65 10.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.542 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 4.7 tp -66.93 -28.53 43.3 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.758 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 40.01 82.64 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.611 0.967 . . . . 10.0 113.611 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 40.8 m170 -119.71 100.57 48.94 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -57.48 -30.17 87.3 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 123.368 2.712 . . . . 10.0 113.752 -178.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 65.9 p-90 -63.59 -22.08 66.7 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 121.12 -0.232 . . . . 10.0 111.583 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 70.1 t -66.84 -48.7 79.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 109.704 -0.48 . . . . 10.0 109.704 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 43.8 m -60.56 -40.39 91.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.38 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -67.13 -32.34 73.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.661 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -70.8 -43.81 67.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.959 0.409 . . . . 10.0 110.126 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.67 -45.25 92.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.289 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.36 -34.9 74.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.808 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -65.21 -48.8 72.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.817 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 630' ' ' ALA . . . . . 0.47 ' O ' HG23 ' A' ' 634' ' ' VAL . . . -65.99 -36.87 84.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.832 179.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -58.11 -44.93 87.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.066 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 632' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 632' ' ' ARG . 9.5 mtp180 -74.05 -25.46 59.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.294 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -68.62 -37.13 79.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.32 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 634' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 630' ' ' ALA . 88.5 t -57.46 -48.06 83.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 109.786 -0.45 . . . . 10.0 109.786 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -70.18 -28.18 65.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.818 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.8 m -63.48 -35.25 79.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.181 -0.674 . . . . 10.0 109.181 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -70.25 -40.96 74.11 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.359 -0.837 . . . . 10.0 109.084 178.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -66.77 -35.6 80.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.257 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -58.13 -43.88 87.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.093 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.22 -40.63 90.84 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 641' ' ' ILE . . . . . 0.444 ' O ' ' HG ' ' A' ' 645' ' ' LEU . 61.3 mt -67.77 -46.22 82.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.3 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 64.8 mtm-85 -58.16 -42.79 86.73 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.038 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -61.65 -45.52 93.68 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.73 179.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -60.9 -39.74 90.43 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.862 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 641' ' ' ILE . 85.0 mt -71.03 -40.45 71.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.675 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 646' ' ' LEU . . . . . 0.433 ' HA ' ' HB2' ' A' ' 649' ' ' ASP . 82.4 mt -67.46 -24.43 65.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.578 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 647' ' ' GLU . . . . . 0.519 ' O ' HG23 ' A' ' 651' ' ' VAL . 2.6 mm-40 -58.33 -44.68 88.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.043 178.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -77.63 -31.17 52.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.333 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 649' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 646' ' ' LEU . 88.1 m-20 -65.9 -45.43 82.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.428 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 650' ' ' ASP . . . . . 0.459 ' HA ' ' HB3' ' A' ' 653' ' ' ASN . 15.9 t70 -63.46 -28.75 70.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.51 -0.313 . . . . 10.0 111.469 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 651' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 647' ' ' GLU . 53.7 t -61.25 -50.46 80.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.444 -0.576 . . . . 10.0 109.444 178.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -70.48 -27.61 64.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.991 179.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 653' ' ' ASN . . . . . 0.459 ' HB3' ' HA ' ' A' ' 650' ' ' ASP . 20.5 t30 -63.13 -52.14 63.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.395 -0.821 . . . . 10.0 111.11 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -62.03 -44.56 96.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.808 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -60.73 -42.1 96.63 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.871 0.367 . . . . 10.0 110.083 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 6.6 ttp-105 -63.75 -45.99 87.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.02 178.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 657' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 657' ' ' ARG . 13.2 ttp180 -60.09 -43.16 95.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.694 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.71 -53.84 44.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.719 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.8 tp -65.31 -32.17 57.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-O 120.655 0.264 . . . . 10.0 111.419 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -69.78 -32.41 70.89 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 110.39 -0.226 . . . . 10.0 110.39 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 49.1 m -65.62 -46.29 79.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -63.77 -43.78 95.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.371 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 28.3 ttt-85 -63.26 -36.73 84.63 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.521 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -66.1 -40.71 90.98 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.776 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 665' ' ' GLU . . . . . 0.405 ' O ' HG22 ' A' ' 669' ' ' VAL . 1.6 tp10 -60.67 -49.74 76.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.054 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 61.7 mt -67.32 -17.19 64.66 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.066 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 44.2 tp -83.18 -44.13 15.38 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.385 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -71.63 -47.96 51.09 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 665' ' ' GLU . 20.0 m -68.59 149.36 11.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.073 0.463 . . . . 10.0 111.566 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -42.54 9.92 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.917 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -94.99 140.86 29.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.386 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 8.6 p -135.2 11.8 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.918 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 8.1 m -55.18 -38.61 68.57 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.587 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -59.17 -51.74 68.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 10.0 111.219 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 675' ' ' THR . . . . . 0.504 ' O ' HG12 ' A' ' 679' ' ' ILE . 0.2 OUTLIER -63.99 -46.12 86.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.051 -179.76 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 676' ' ' ILE . . . . . 0.408 ' O ' ' HB2' ' A' ' 680' ' ' ARG . 34.0 mm -58.47 -44.2 88.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.874 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -72.52 -40.5 66.76 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.949 -0.3 . . . . 10.0 111.613 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 60.6 m -61.92 -39.43 92.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.659 -0.246 . . . . 10.0 111.464 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 679' ' ' ILE . . . . . 0.504 HG12 ' O ' ' A' ' 675' ' ' THR . 45.9 pt -83.49 -21.07 8.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 120.835 -0.346 . . . . 10.0 111.011 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 680' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 676' ' ' ILE . 30.3 ttm-85 -59.66 -51.13 71.11 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.917 0.389 . . . . 10.0 110.702 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 681' ' ' GLU . . . . . 0.425 ' HG2' ' H ' ' A' ' 681' ' ' GLU . 2.8 pt-20 -63.76 -36.38 83.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.057 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -66.95 -46.5 74.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.836 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 683' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 679' ' ' ILE . 72.1 t -60.09 -45.1 96.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.361 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -62.98 -45.55 91.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.308 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 34.3 tttm -58.81 -49.2 78.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.694 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -60.4 -41.04 93.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.402 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 25.6 m -67.87 -40.08 83.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.39 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 92.1 mt -68.61 -43.4 83.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.213 -0.448 . . . . 10.0 110.377 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -60.92 -19.09 60.1 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.866 0.365 . . . . 10.0 111.721 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -79.59 -21.06 45.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.736 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -117.4 -29.28 5.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.995 0.426 . . . . 10.0 110.995 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 692' ' ' ILE . . . . . 0.56 HG23 ' CD1' ' A' ' 701' ' ' TRP . 55.6 mt -124.79 106.16 29.4 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.386 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -72.72 138.74 29.61 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.701 2.267 . . . . 10.0 111.389 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 694' ' ' PRO . . . . . 0.444 ' HA ' ' OE1' ' A' ' 732' ' ' GLU . 37.4 Cg_endo -67.21 131.37 24.9 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.344 2.029 . . . . 10.0 112.891 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 64.11 41.33 6.37 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.708 -0.678 . . . . 10.0 112.03 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 40.4 p -107.86 -150.98 0.46 Allowed 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 96.8 mt -113.55 158.71 20.42 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.174 -0.306 . . . . 10.0 110.174 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -58.99 -36.73 75.39 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.237 0.458 . . . . 10.0 112.237 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -78.29 1.39 21.89 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.032 0.444 . . . . 10.0 111.294 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 60.9 mtt -104.38 7.05 35.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.145 0.498 . . . . 10.0 110.071 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 701' ' ' TRP . . . . . 0.56 ' CD1' HG23 ' A' ' 692' ' ' ILE . 48.7 m0 -104.5 121.49 43.58 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.437 -178.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -86.05 82.74 7.98 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 703' ' ' ILE . . . . . 0.477 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 39.2 mm -61.74 -48.99 88.22 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.34 -0.846 . . . . 10.0 112.009 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 704' ' ' PRO . . . . . 0.477 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 42.9 Cg_exo -58.15 -43.69 45.47 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.008 1.805 . . . . 10.0 112.425 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -62.82 -42.93 99.59 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.954 -0.641 . . . . 10.0 112.299 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 35.2 tp -69.16 -42.49 75.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.659 0.266 . . . . 10.0 110.472 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -60.97 -44.91 96.64 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.706 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.83 -41.86 99.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.785 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -64.16 -41.98 96.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.888 0.375 . . . . 10.0 110.567 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 89.9 mt -62.64 -38.96 92.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.237 0.541 . . . . 10.0 110.011 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 21.1 mtpp -86.49 13.13 8.87 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.588 -0.733 . . . . 10.0 111.349 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -125.8 -51.95 1.57 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.767 0.318 . . . . 10.0 111.511 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -98.03 -23.64 15.68 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.353 0.871 . . . . 10.0 113.353 -177.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -108.63 -6.46 15.99 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.363 -0.535 . . . . 10.0 112.204 -178.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 39.1 t70 57.01 32.92 22.51 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.596 0.713 . . . . 10.0 110.7 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 12.5 tp -120.69 117.65 28.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.171 0.51 . . . . 10.0 111.06 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -90.96 99.24 12.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.459 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 77.7 mt -121.97 123.06 27.46 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.832 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -85.16 73.69 4.09 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.816 2.344 . . . . 10.0 111.653 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 46.7 mt -57.81 -37.67 61.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.115 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -62.34 -29.69 70.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.799 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -81.67 -37.61 27.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.003 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 42.5 m0 -60.92 -56.72 17.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.645 -0.707 . . . . 10.0 111.233 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 18.2 tp -65.07 -24.44 67.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.041 0.448 . . . . 10.0 111.244 -179.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -66.81 -39.93 87.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.042 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 726' ' ' LYS . . . . . 0.444 ' O ' ' HD3' ' A' ' 728' ' ' PRO . 8.8 mttp -99.84 -29.51 12.56 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.446 0.536 . . . . 10.0 112.446 -178.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -114.97 87.41 15.15 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 120.719 0.295 . . . . 10.0 111.049 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 728' ' ' PRO . . . . . 0.504 ' HD2' ' OE1' ' A' ' 729' ' ' GLU . 10.6 Cg_exo -72.27 -22.23 22.31 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.683 2.255 . . . . 10.0 112.346 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 729' ' ' GLU . . . . . 0.504 ' OE1' ' HD2' ' A' ' 728' ' ' PRO . 4.0 mp0 -74.59 1.95 10.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.75 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 730' ' ' LEU . . . . . 0.421 HD21 ' NH1' ' A' ' 738' ' ' ARG . 16.4 mt -66.12 -27.34 67.97 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 56.42 -101.41 0.13 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.801 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 732' ' ' GLU . . . . . 0.444 ' OE1' ' HA ' ' A' ' 694' ' ' PRO . 8.4 tt0 -148.99 -54.31 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.924 -0.31 . . . . 10.0 111.428 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.78 -50.51 73.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.454 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.59 -35.61 74.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.559 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 4.5 tt -65.0 -43.47 92.44 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.164 -0.471 . . . . 10.0 109.898 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 736' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 736' ' ' ARG . 52.8 mtt180 -62.67 -46.75 86.72 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.115 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -63.13 -38.1 89.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.198 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 738' ' ' ARG . . . . . 0.421 ' NH1' HD21 ' A' ' 730' ' ' LEU . 21.9 mmm-85 -57.47 -49.83 75.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.853 0.359 . . . . 10.0 110.089 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 79.8 mt -57.31 -46.34 85.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.218 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 740' ' ' LEU . . . . . 0.434 ' O ' HG13 ' A' ' 744' ' ' ILE . 53.6 tp -62.0 -47.2 85.86 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.11 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -59.44 -46.71 87.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.382 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -60.9 -35.73 77.42 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.199 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 20.4 m -66.66 -44.84 80.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.435 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 744' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 740' ' ' LEU . 73.1 mt -64.49 -37.65 80.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.458 . . . . 10.0 110.614 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.47 -55.66 25.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.363 -0.381 . . . . 10.0 110.611 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 85.0 t -62.23 -35.47 69.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.758 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -58.67 -49.48 77.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.463 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 748' ' ' GLN . . . . . 0.588 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 57.2 mt-30 -64.52 -35.99 82.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.493 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 64.8 mtp180 -64.68 -36.77 85.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.147 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -71.08 -37.72 72.45 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.45 -45.43 91.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.877 -1.056 . . . . 10.0 112.269 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 752' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 56.2 mt-10 -58.61 -28.7 65.86 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -178.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 17.8 t -78.74 -32.6 15.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.992 0.425 . . . . 10.0 111.147 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.9 t -86.59 -46.04 16.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.082 0.468 . . . . 10.0 110.946 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 130.78 137.78 4.17 Favored Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 111.137 -0.785 . . . . 10.0 111.137 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 756' ' ' ALA . . . . . 0.441 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -57.64 -59.26 5.47 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 757' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 757' ' ' GLU . 27.1 mp0 -63.09 -36.03 82.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.762 0.315 . . . . 10.0 111.032 -179.236 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 17.5 tpt -65.85 -43.86 87.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.82 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 40.3 mmm -63.03 -42.51 99.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.516 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.441 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.7 mmp_? -60.12 -39.25 85.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.249 0.547 . . . . 10.0 109.834 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -69.45 -38.11 77.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.711 178.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -64.07 -49.96 70.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.158 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -59.08 -46.12 89.1 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.213 -0.448 . . . . 10.0 110.31 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -57.44 -46.2 83.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.24 178.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -66.68 -46.04 79.19 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.832 -0.622 . . . . 10.0 112.351 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 61.6 t -59.66 -42.01 87.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.408 0.147 . . . . 10.0 110.822 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 22.7 mtp -59.94 -48.82 80.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.726 0.298 . . . . 10.0 110.427 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.99 -43.3 96.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.644 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -62.5 -48.3 80.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.312 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 8.4 m -63.0 -40.17 96.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.85 0.357 . . . . 10.0 110.292 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.6 tt -61.61 -46.92 87.78 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.433 -0.581 . . . . 10.0 109.433 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 772' ' ' ASP . . . . . 0.593 ' O ' ' HG2' ' A' ' 776' ' ' LYS . 0.3 OUTLIER -63.99 -43.6 95.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.796 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 42.1 m -55.86 -45.98 78.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.896 0.379 . . . . 10.0 110.844 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.24 -24.96 59.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.723 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -67.62 -38.84 84.48 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.996 -0.372 . . . . 10.0 109.996 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.593 ' HG2' ' O ' ' A' ' 772' ' ' ASP . 3.8 mmtt -62.38 -40.84 97.79 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 108.816 -0.809 . . . . 10.0 108.816 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 777' ' ' GLU . . . . . 0.448 ' HG2' ' HG3' ' A' ' 305' ' ' MET . 15.5 tm-20 -63.4 -53.29 54.65 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.912 -1.04 . . . . 10.0 109.374 178.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 778' ' ' HIS . . . . . 0.537 ' O ' ' HG2' ' A' ' 782' ' ' MET . 16.0 t60 -54.77 -37.27 65.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.31 -0.859 . . . . 10.0 111.86 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.16 -44.31 97.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.999 0.428 . . . . 10.0 110.361 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -75.43 -38.14 59.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.433 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.97 -42.06 93.33 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.9 -0.591 . . . . 10.0 111.281 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 782' ' ' MET . . . . . 0.537 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 97.5 mmm -60.0 -37.67 80.38 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.171 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 783' ' ' ASP . . . . . 0.424 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 9.1 t70 -71.79 -45.82 60.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.421 179.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -54.48 -42.52 70.82 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.531 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 21.9 tp -78.93 -30.97 44.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.858 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -58.5 -45.15 89.36 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.956 0.407 . . . . 10.0 110.984 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 787' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 6.9 pt20 -88.58 -31.8 18.44 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.749 -0.38 . . . . 10.0 110.627 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -70.61 -25.68 75.31 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.018 -0.611 . . . . 10.0 113.226 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 789' ' ' ILE . . . . . 0.403 ' HA ' ' HG3' ' A' ' 792' ' ' ARG . 6.3 tp -61.97 -17.7 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.805 0.336 . . . . 10.0 111.667 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -64.33 -27.14 68.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.829 0.347 . . . . 10.0 110.483 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 87.0 mt -98.38 2.22 47.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.402 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 792' ' ' ARG . . . . . 0.403 ' HG3' ' HA ' ' A' ' 789' ' ' ILE . 7.6 mtp180 -109.68 -21.06 12.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.605 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -77.6 87.44 1.03 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 121.03 -0.605 . . . . 10.0 112.199 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 8.2 p90 -79.79 -177.23 5.82 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.917 0.389 . . . . 10.0 110.874 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -75.23 156.33 35.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.583 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 67.56 34.95 4.35 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.432 0.457 . . . . 10.0 111.291 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -167.73 137.28 2.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.417 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -79.77 129.17 71.92 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.545 -0.298 . . . . 10.0 110.461 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.3 -24.09 58.39 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 123.099 2.533 . . . . 10.0 113.807 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 25.7 mtmm -82.45 -45.48 14.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.001 0.429 . . . . 10.0 109.95 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -62.95 -44.19 96.74 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.695 -0.684 . . . . 10.0 111.418 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -65.66 -36.55 83.99 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -61.36 -47.52 85.48 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.003 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -58.3 -40.46 82.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.114 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -60.39 -53.5 56.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.33 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -60.77 -37.49 82.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.692 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 28.4 m -65.97 -36.77 84.23 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.904 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -67.37 -41.46 85.03 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 6.6 m -65.47 -38.25 89.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.204 0.526 . . . . 10.0 109.827 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 32.7 ttm -63.52 -41.85 98.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.327 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -65.83 -42.49 90.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.57 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.42 -46.53 89.73 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.008 0.432 . . . . 10.0 110.32 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.75 85.03 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.463 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 22.4 ttp -63.61 -40.72 97.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.098 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.5 -40.59 95.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.523 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -65.05 -40.88 95.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.149 0.5 . . . . 10.0 110.173 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 14.4 m -68.93 -30.84 69.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.256 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 61.5 tp -63.55 -57.43 10.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.608 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt -61.13 -34.52 75.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.691 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -60.45 -61.44 2.6 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.582 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.79 -31.57 72.29 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.554 0.576 . . . . 10.0 112.554 -178.168 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 822' ' ' VAL . . . . . 0.442 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 14.6 t -60.22 -54.58 32.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.851 -0.34 . . . . 10.0 110.282 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 34.3 mm -66.6 -40.63 86.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.934 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 50.7 m -60.65 -50.9 71.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.005 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 93.3 m -59.6 -38.72 82.0 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.749 0.309 . . . . 10.0 111.593 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 826' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 94.6 mt -66.65 -18.27 65.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.823 0.344 . . . . 10.0 111.347 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 5.4 m -102.51 -34.1 9.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.913 0.387 . . . . 10.0 110.309 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -63.35 -23.89 67.61 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.624 -0.717 . . . . 10.0 111.722 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.82 122.33 4.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 121.586 0.708 . . . . 10.0 111.323 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -86.38 93.13 9.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.549 -0.751 . . . . 10.0 110.161 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 62.1 t -90.75 137.44 21.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.606 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 38.0 mtt180 -72.34 93.08 1.47 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.981 0.419 . . . . 10.0 110.216 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 91.4 mtp -97.26 121.81 57.7 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.966 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.76 170.06 19.71 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.678 2.252 . . . . 10.0 111.501 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -66.19 108.03 2.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.012 0.434 . . . . 10.0 111.066 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.485 -0.769 . . . . 10.0 109.84 179.474 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 110.308 -0.256 . . . . 10.0 110.308 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.68 108.58 14.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.062 0.458 . . . . 10.0 110.27 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 2.5 pt -96.83 91.66 2.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.904 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.1 95.63 4.27 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.103 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 79.9 mt -91.03 133.24 35.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.066 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.45 146.99 29.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.551 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -85.89 65.39 9.1 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.056 0.455 . . . . 10.0 110.328 179.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.74 -19.82 61.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.296 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -83.42 67.43 9.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.307 0.575 . . . . 10.0 109.853 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' LYS . . . . . 0.552 ' O ' ' HD3' ' B' ' 12' ' ' PRO . 28.4 mttt -73.33 147.68 44.19 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.223 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.29 101.1 11.82 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 120.951 0.405 . . . . 10.0 111.701 -178.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' PRO . . . . . 0.552 ' HD3' ' O ' ' B' ' 10' ' ' LYS . 8.1 Cg_endo -87.89 18.93 1.43 Allowed 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.052 2.502 . . . . 10.0 111.59 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -60.88 -31.79 71.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.795 -0.638 . . . . 10.0 111.555 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -33.95 76.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.969 0.414 . . . . 10.0 110.994 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 39.5 t -81.49 -33.83 12.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.519 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.11 -16.99 56.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.972 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 82.0 t -66.82 -35.25 74.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.928 0.394 . . . . 10.0 110.904 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.18 -40.32 78.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.123 0.487 . . . . 10.0 111.064 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.31 -6.89 59.21 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.685 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' GLY . . . . . 0.467 ' HA2' ' OG ' ' B' ' 23' ' ' SER . . . -62.07 -32.17 81.36 Favored Glycine 0 N--CA 1.453 -0.226 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.974 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 12.6 t -59.85 -34.7 56.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.912 0.387 . . . . 10.0 111.214 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 22.6 ttt -132.91 56.08 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.231 0.538 . . . . 10.0 110.378 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' SER . . . . . 0.467 ' OG ' ' HA2' ' B' ' 20' ' ' GLY . 73.8 m -83.51 90.83 7.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.502 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.95 157.3 18.97 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.006 -0.739 . . . . 10.0 109.006 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -140.69 145.88 37.1 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.152 0.501 . . . . 10.0 111.244 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -105.34 -122.27 0.22 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.689 -0.687 . . . . 10.0 109.392 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 60.3 ttp -85.72 -31.24 22.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.881 0.372 . . . . 10.0 110.421 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.038 -0.982 . . . . 10.0 110.112 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.79 0.329 . . . . 10.0 110.245 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -81.79 124.94 30.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.84 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 136.62 150.0 5.76 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.908 -0.663 . . . . 10.0 112.444 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' HB3' ' A' ' 16' ' ' ARG . 6.0 m -63.31 148.16 49.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.906 0.384 . . . . 10.0 110.421 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.665 ' HD2' ' OD1' ' A' ' 408' ' ' ASP . 2.3 mmp_? -66.94 143.9 56.55 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.53 0.567 . . . . 10.0 112.53 -178.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.9 t30 68.33 -82.96 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 114.76 -1.109 . . . . 10.0 112.801 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -51.63 -59.64 4.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.509 0.929 . . . . 10.0 113.509 -177.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 16' ' ' ARG . 8.1 tpt180 -72.13 -41.73 66.84 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.76 0.652 . . . . 10.0 112.76 -177.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.6 p -59.44 -50.55 73.51 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.9 mt -64.06 -37.88 89.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.762 0.315 . . . . 10.0 111.041 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 23.6 ttp-105 -65.62 -45.12 84.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.469 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -63.58 -41.74 98.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.124 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.419 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 52.1 mtt -65.81 -34.81 79.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.618 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -61.96 -33.4 74.23 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.012 0.434 . . . . 10.0 110.135 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 19' ' ' ARG . 25.0 mtpp -66.88 -35.61 80.42 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.33 -0.618 . . . . 10.0 109.33 179.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 56.9 t -71.87 -38.83 66.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.504 -0.771 . . . . 10.0 109.476 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.574 HG13 HD12 ' A' ' 88' ' ' LEU . 59.5 t -58.49 -36.18 57.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.683 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -60.66 -38.66 85.62 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.069 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.7 mt -65.72 -43.97 93.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 65.9 mt -62.65 -36.44 75.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.503 -0.772 . . . . 10.0 110.233 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -63.35 -36.27 83.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.478 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.2 -25.28 36.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.71 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 46.8 mtt -80.35 -19.05 47.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.064 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.487 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 5.8 tt0 -59.65 -55.87 41.46 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-O 119.356 -0.355 . . . . 10.0 110.973 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.487 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 27.5 Cg_exo -63.7 -19.34 67.1 Favored 'Trans proline' 0 C--N 1.359 1.09 0 C-N-CA 121.97 1.78 . . . . 10.0 111.712 179.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -74.3 -45.09 49.72 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.4 mmt -68.96 -24.02 64.21 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.357 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 96.5 mt-10 -65.06 -22.77 67.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.76 179.228 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.9 mttt -86.35 -6.61 58.9 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.386 0.613 . . . . 10.0 109.915 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.2 mp -98.38 141.21 31.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.383 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.8 p -74.48 170.15 16.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.241 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -60.23 -38.05 82.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.959 0.409 . . . . 10.0 110.846 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -68.12 -32.89 73.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.721 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.71 -34.34 73.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.764 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.88 -43.65 98.42 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -67.04 -32.48 73.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.093 -0.958 . . . . 10.0 109.761 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.5 -34.91 90.86 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.351 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -66.74 -36.88 83.49 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.3 m -60.78 -44.83 96.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.136 178.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.15 -33.85 76.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.284 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -65.16 -40.51 94.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.65 179.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.413 ' CD1' HD22 ' A' ' 63' ' ' LEU . 23.2 m-30 -61.01 -42.66 98.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.777 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -59.02 -43.12 91.53 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.016 0.436 . . . . 10.0 110.372 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.37 -41.37 76.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.891 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -61.44 -38.11 86.0 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.153 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 55.3 mt -63.22 -40.16 96.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.801 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -70.14 -31.96 69.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.539 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -69.65 -61.79 1.64 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.785 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 168.95 27.27 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.204 -0.998 . . . . 10.0 113.27 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -94.02 140.92 29.13 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.1 t -87.09 139.43 17.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.572 HD11 ' O ' ' A' ' 118' ' ' LEU . 20.6 tp -56.26 -40.75 74.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.967 0.413 . . . . 10.0 111.107 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -63.43 -21.55 66.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.626 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -82.31 -20.73 36.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.076 0.465 . . . . 10.0 110.358 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.413 HD22 ' CD1' ' A' ' 50' ' ' PHE . 90.6 mt -82.15 -9.32 59.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.625 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.538 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 76.8 mt -49.43 -53.4 40.72 Favored Pre-proline 0 CA--C 1.542 0.645 0 N-CA-C 113.013 0.746 . . . . 10.0 113.013 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.538 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 33.5 Cg_exo -58.95 -49.83 10.4 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.963 1.776 . . . . 10.0 113.204 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.442 ' O ' HG23 ' A' ' 70' ' ' VAL . 48.6 mt-10 -69.61 -43.8 72.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.335 -0.393 . . . . 10.0 111.955 -178.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.42 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -64.9 -47.56 77.36 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.002 0.371 . . . . 10.0 112.002 -178.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -61.5 -34.03 74.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.7 -0.227 . . . . 10.0 110.663 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.58 -43.98 88.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.372 179.025 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 66' ' ' GLU . 95.5 t -61.59 -47.44 93.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.024 -0.534 . . . . 10.0 110.265 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 67' ' ' ALA . 48.2 t -61.58 -42.52 94.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.442 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -59.82 -46.22 89.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.488 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -64.17 -44.25 92.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.383 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.46 -33.39 72.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.374 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.5 m -63.76 -37.11 86.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.38 179.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.6 mtmm -72.33 -12.51 61.17 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.83 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -110.89 -39.32 4.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -178.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 62.0 t -82.07 -45.09 20.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.957 0.408 . . . . 10.0 111.702 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -101.21 -27.88 12.96 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.854 0.359 . . . . 10.0 111.212 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.11 4.63 81.35 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.017 -0.611 . . . . 10.0 111.784 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 18.0 mtt -117.27 139.94 50.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.587 -0.523 . . . . 10.0 109.587 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.434 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 8.5 ttp180 -85.66 138.05 32.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.815 0.34 . . . . 10.0 110.711 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.41 114.31 5.33 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -55.56 152.52 8.98 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 123.596 0.56 . . . . 10.0 112.022 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.75 -40.17 96.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.975 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.9 m -68.29 -27.33 36.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 10.0 111.084 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.463 HE22 HD23 ' A' ' 110' ' ' LEU . 96.7 mt-30 -70.96 -30.29 66.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.221 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.574 HD12 HG13 ' A' ' 25' ' ' VAL . 86.9 mt -65.22 -36.21 83.45 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.466 ' O ' HG23 ' A' ' 93' ' ' VAL . 82.2 mt -65.19 -50.57 65.41 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.835 -0.621 . . . . 10.0 109.719 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.09 99.5 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.666 -0.697 . . . . 10.0 112.089 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -66.44 -32.2 81.1 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.886 -0.673 . . . . 10.0 112.079 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.419 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 13.9 ttm -71.27 -36.09 71.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.846 0.355 . . . . 10.0 110.424 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 89' ' ' LEU . 76.5 t -65.82 -33.78 65.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.223 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.76 -2.27 22.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.702 -0.681 . . . . 10.0 112.13 -179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -80.5 -28.03 37.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.207 0.527 . . . . 10.0 109.988 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -103.73 175.43 5.48 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.167 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 43.1 ttt85 -78.49 77.83 4.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.888 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 408' ' ' ASP . 0.4 OUTLIER -152.0 159.85 43.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.099 0.476 . . . . 10.0 111.582 -179.676 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.577 HD12 HG11 ' A' ' 211' ' ' VAL . 49.9 mm -100.12 134.64 39.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.713 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.84 111.95 23.69 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.851 0.358 . . . . 10.0 111.287 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -86.99 117.11 25.49 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.7 mtt -111.59 177.67 4.58 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.281 0.562 . . . . 10.0 111.495 -178.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.466 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 9.2 mmm180 -108.73 142.71 38.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.312 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.63 110.0 2.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.771 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.445 ' O ' ' HG2' ' A' ' 578' ' ' GLN . . . 127.17 -23.36 5.51 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.856 -0.687 . . . . 10.0 112.535 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -75.85 -41.06 53.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.939 0.4 . . . . 10.0 110.834 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 155.27 150.38 5.56 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.971 -0.633 . . . . 10.0 111.63 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.416 ' HE2' ' HA ' ' A' ' 108' ' ' LYS . 0.3 OUTLIER -121.55 -80.43 0.62 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.777 0.289 . . . . 10.0 110.687 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.74 -24.64 38.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.061 0.457 . . . . 10.0 110.675 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.463 HD23 HE22 ' A' ' 87' ' ' GLN . 45.9 tp -63.14 -25.29 68.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.323 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.96 -20.99 26.5 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.23 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -83.06 -8.84 59.49 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.435 0.531 . . . . 10.0 112.435 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 11.5 p -67.1 -33.36 75.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.768 0.318 . . . . 10.0 111.793 -179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.403 ' HB2' ' CD ' ' A' ' 115' ' ' PRO . 26.3 mt -65.71 -57.6 13.74 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.929 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.403 ' CD ' ' HB2' ' A' ' 114' ' ' LEU . 33.2 Cg_endo -63.13 -32.28 74.83 Favored 'Trans proline' 0 C--N 1.357 0.977 0 C-N-CA 121.935 1.757 . . . . 10.0 111.959 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.98 -52.88 45.57 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.689 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.413 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 63.6 t80 -59.92 -44.55 94.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.865 0.364 . . . . 10.0 110.633 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.572 ' O ' HD11 ' A' ' 60' ' ' LEU . 36.6 tp -59.44 -54.74 43.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.462 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -69.94 -23.29 63.18 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.876 0.324 . . . . 10.0 111.876 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.48 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -67.28 -26.19 66.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.019 0.438 . . . . 10.0 110.882 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 63.5 mt -60.81 -25.55 66.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.382 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.7 p -70.17 -19.32 63.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.864 0.364 . . . . 10.0 111.089 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 72.45 12.09 76.84 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 121.048 -0.596 . . . . 10.0 112.711 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.1 mmpp? -85.28 -21.99 28.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.688 0.28 . . . . 10.0 111.034 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.39 115.23 3.78 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.554 -0.831 . . . . 10.0 112.962 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.408 HG13 ' CD2' ' A' ' 205' ' ' TYR . 96.4 t -83.78 112.18 20.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 19.0 m170 -86.87 96.43 10.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.799 0.333 . . . . 10.0 110.387 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.5 t -86.1 120.34 35.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.127 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 26.0 t -98.88 113.58 34.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.326 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.36 151.8 21.84 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.99 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.412 ' H ' HG22 ' A' ' 131' ' ' VAL . 0.6 OUTLIER -69.06 -49.15 65.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.353 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -126.96 157.6 39.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.421 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.08 -17.77 63.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.703 -178.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -68.51 -55.44 11.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.837 0.351 . . . . 10.0 110.559 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.68 -31.94 73.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.69 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.05 -44.62 74.9 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.866 -0.607 . . . . 10.0 111.118 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -80.7 -40.45 25.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.792 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -52.55 -61.37 2.32 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.922 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -70.11 -27.3 64.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.259 -0.428 . . . . 10.0 112.073 -178.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.61 -50.49 64.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.949 0.404 . . . . 10.0 110.494 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -71.17 -33.21 69.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.052 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -70.88 -36.69 72.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.569 -0.287 . . . . 10.0 111.658 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -92.69 -3.12 55.4 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.027 -0.269 . . . . 10.0 111.559 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.486 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 63.2 ttm-85 -59.77 -49.16 93.05 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-O 119.293 -0.384 . . . . 10.0 111.877 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' PRO . . . . . 0.559 ' O ' ' HB2' ' A' ' 149' ' ' PHE . 29.2 Cg_exo -63.15 -9.12 16.03 Favored 'Trans proline' 0 C--N 1.361 1.204 0 C-N-CA 122.228 1.952 . . . . 10.0 112.692 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.5 tp -93.09 -52.39 4.59 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.018 0.437 . . . . 10.0 110.245 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -72.24 -45.5 59.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.888 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -67.0 -23.29 65.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.764 0.316 . . . . 10.0 110.971 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.559 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 29.7 t80 -68.29 -26.11 65.48 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.751 -0.463 . . . . 10.0 109.751 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 54.2 mt -94.5 -1.0 54.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.637 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 97.62 1.8 58.83 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.819 -0.705 . . . . 10.0 113.447 178.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 28.8 mt -80.9 140.79 35.12 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.057 0.429 . . . . 10.0 110.794 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.86 123.95 34.26 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.754 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 56.7 t -104.95 119.78 54.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.574 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -115.51 146.87 18.89 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.652 -0.785 . . . . 10.0 112.201 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.5 tp -119.99 127.4 75.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.038 0.447 . . . . 10.0 110.45 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -108.46 105.83 15.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.137 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 161' ' ' MET . 86.1 mt -96.65 146.68 31.73 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.897 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' PRO . . . . . 0.494 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 27.5 Cg_endo -62.37 116.96 3.84 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.856 2.371 . . . . 10.0 112.355 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 96.21 6.19 59.01 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.749 -0.739 . . . . 10.0 112.825 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' MET . . . . . 0.449 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.5 OUTLIER -67.97 150.09 97.92 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.539 0.17 . . . . 10.0 110.612 179.679 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -63.52 152.53 79.75 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.628 2.219 . . . . 10.0 112.14 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' ALA . . . . . 0.527 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.46 -50.92 80.29 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 113.12 0.785 . . . . 10.0 113.12 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.527 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 52.7 Cg_exo -57.03 -44.59 42.92 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 122.029 1.819 . . . . 10.0 112.416 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.12 -41.89 97.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.848 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.44 ' HZ2' ' CG ' ' A' ' 185' ' ' ASP . 54.4 mttm -63.91 -41.38 97.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.955 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 167' ' ' ARG . . . . . 0.43 ' HG2' ' HA ' ' A' ' 199' ' ' VAL . 64.3 mtt180 -58.35 -36.8 74.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.285 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -70.5 -38.79 74.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.962 0.41 . . . . 10.0 110.26 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.02 -44.19 85.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.524 -0.762 . . . . 10.0 111.11 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 41.7 m-85 -73.76 -28.2 61.55 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.307 -0.406 . . . . 10.0 111.036 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -76.27 -10.3 59.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.753 0.311 . . . . 10.0 111.274 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -75.12 174.67 9.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.615 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' ASP . . . . . 0.48 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 9.4 m-20 -75.44 -38.55 59.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.12 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 66.4 mt -130.84 125.95 59.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.006 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.9 m -115.5 117.21 29.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.917 0.389 . . . . 10.0 111.626 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -96.06 131.21 42.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.998 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -166.43 173.66 41.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.284 -0.96 . . . . 10.0 112.768 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.17 153.54 20.87 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 122.214 0.205 . . . . 10.0 111.074 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -61.48 -36.59 80.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.684 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -63.23 -56.44 16.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.44 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.494 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.5 tp10 -62.81 -37.85 88.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.238 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.67 -34.69 71.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.767 0.318 . . . . 10.0 110.993 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -81.21 -40.3 11.58 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.92 -0.657 . . . . 10.0 111.835 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -64.38 -36.09 83.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.826 0.346 . . . . 10.0 110.75 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 185' ' ' ASP . . . . . 0.44 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 29.8 m-20 -61.42 -40.74 95.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.333 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -61.53 -38.12 86.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.418 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 54.8 mt -67.24 -41.68 85.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.554 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 72.9 mtm-85 -67.61 -41.71 83.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.951 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.39 -23.79 67.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.19 0.519 . . . . 10.0 111.264 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -90.95 1.66 56.86 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.966 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 66.6 mtp -108.88 -7.11 15.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.736 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -62.42 160.52 13.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.621 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -110.8 -14.9 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.281 0.563 . . . . 10.0 109.932 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -129.24 138.15 32.54 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.481 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -58.3 -29.97 89.57 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.639 2.226 . . . . 10.0 112.743 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -70.77 -16.09 62.73 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.662 0.245 . . . . 10.0 111.662 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -76.36 -15.96 59.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.668 -0.242 . . . . 10.0 111.549 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 75.1 mtt180 -57.88 134.82 56.65 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.959 0.409 . . . . 10.0 111.521 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 199' ' ' VAL . . . . . 0.43 ' HA ' ' HG2' ' A' ' 167' ' ' ARG . 20.5 m -108.07 -20.49 6.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.496 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -89.47 -178.61 5.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.209 0.528 . . . . 10.0 111.729 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -137.73 -179.02 5.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.588 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -52.91 133.56 37.8 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.432 0.635 . . . . 10.0 112.351 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 17.3 mt -87.55 61.99 6.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.473 -0.785 . . . . 10.0 110.034 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -80.06 -50.08 10.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.337 0.495 . . . . 10.0 112.337 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 205' ' ' TYR . . . . . 0.408 ' CD2' HG13 ' A' ' 126' ' ' VAL . 33.3 t80 -131.22 138.02 49.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.993 0.425 . . . . 10.0 111.701 -178.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.608 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -134.53 125.28 27.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.697 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 30.5 tp -122.68 108.57 13.23 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.877 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.4 p -96.04 129.87 45.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.207 0.527 . . . . 10.0 110.836 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -58.81 -55.9 29.16 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.377 -0.829 . . . . 10.0 111.981 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 210' ' ' GLU . . . . . 0.468 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 23.0 tt0 -126.27 114.72 18.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.867 0.365 . . . . 10.0 110.924 -179.08 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.577 HG11 HD12 ' A' ' 99' ' ' ILE . 25.5 m -85.22 -9.56 11.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.792 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 212' ' ' ASP . . . . . 0.424 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 10.0 t70 -52.97 -68.07 0.2 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.363 -0.835 . . . . 10.0 110.99 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 7.8 p -82.4 -50.8 8.49 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.996 -0.547 . . . . 10.0 112.119 -179.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 69.2 mt -55.52 -41.71 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 114.37 1.248 . . . . 10.0 114.37 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 10.8 mt -97.76 -51.95 3.91 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.614 0.968 . . . . 10.0 113.614 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 216' ' ' ILE . . . . . 0.424 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 47.0 mm -70.76 -56.24 11.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 113.387 0.884 . . . . 10.0 113.387 -177.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -74.49 -41.24 61.07 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.87 0.693 . . . . 10.0 112.87 -177.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -91.11 28.21 1.67 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 111.88 0.326 . . . . 10.0 111.88 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -66.78 -52.61 42.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.015 0.436 . . . . 10.0 111.907 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 220' ' ' ARG . . . . . 0.431 ' O ' ' HD3' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -94.74 16.73 15.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.325 -178.419 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 90.1 m -79.82 116.92 64.51 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 120.819 0.342 . . . . 10.0 110.298 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -92.33 141.49 2.29 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.022 2.481 . . . . 10.0 113.065 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 223' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.71 112.95 25.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.528 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 53.3 mt -115.16 124.43 71.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.405 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 6.5 pt -82.75 173.06 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.974 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 1.4 p -82.63 156.7 23.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.14 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -152.52 157.19 27.14 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 121.291 -0.48 . . . . 10.0 112.042 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -80.14 -23.73 6.21 Favored 'Trans proline' 0 CA--C 1.531 0.365 0 C-N-CA 122.616 2.211 . . . . 10.0 113.885 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -161.77 -168.19 1.89 Allowed 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.872 0.368 . . . . 10.0 111.568 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 230' ' ' GLU . . . . . 0.405 ' CD ' ' HB3' ' A' ' 369' ' ' ASN . 30.7 tt0 -147.23 145.54 29.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.149 -0.686 . . . . 10.0 109.149 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 8.5 t70 58.75 -110.87 0.52 Allowed 'General case' 0 N--CA 1.465 0.308 0 O-C-N 123.625 0.578 . . . . 10.0 110.274 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 5.2 p -173.04 115.58 0.27 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.91 0.386 . . . . 10.0 110.708 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.0 -32.47 66.16 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.119 -0.492 . . . . 10.0 111.347 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -63.18 -33.79 76.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.305 0.574 . . . . 10.0 110.461 179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.39 -41.23 80.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.487 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 236' ' ' TYR . . . . . 0.438 ' HA ' HG12 ' A' ' 239' ' ' VAL . 60.4 m-85 -67.79 -48.48 66.18 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.406 0.521 . . . . 10.0 112.406 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 237' ' ' LYS . . . . . 0.478 ' O ' ' HD3' ' A' ' 241' ' ' LYS . 8.3 ptmm? -63.63 -27.24 69.1 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.914 -0.315 . . . . 10.0 111.573 -178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 35.7 ttp85 -88.11 -40.33 13.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.643 0.258 . . . . 10.0 111.205 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 239' ' ' VAL . . . . . 0.528 HG11 ' HB3' ' A' ' 309' ' ' HIS . 2.6 p -67.27 -27.82 40.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 111.722 0.267 . . . . 10.0 111.722 -178.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -77.95 -14.6 59.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.43 0.633 . . . . 10.0 110.126 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 241' ' ' LYS . . . . . 0.478 ' HD3' ' O ' ' A' ' 237' ' ' LYS . 11.7 mptt -97.67 19.17 14.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.43 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 242' ' ' ILE . . . . . 0.483 ' C ' ' HD3' ' A' ' 244' ' ' PRO . 11.3 tt -88.51 -5.69 10.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.596 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 243' ' ' ILE . . . . . 0.437 HG23 HD12 ' A' ' 246' ' ' LEU . 54.3 mt -117.67 74.25 8.98 Favored Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.177 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 244' ' ' PRO . . . . . 0.483 ' HD3' ' C ' ' A' ' 242' ' ' ILE . 93.4 Cg_endo -104.46 7.15 0.3 Allowed 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 123.132 2.554 . . . . 10.0 114.212 -179.313 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.24 15.12 0.9 Allowed 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.872 0.693 . . . . 10.0 112.872 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 246' ' ' LEU . . . . . 0.437 HD12 HG23 ' A' ' 243' ' ' ILE . 62.5 mt -99.21 153.7 18.72 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.501 -0.48 . . . . 10.0 110.691 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 10.7 pt -121.42 165.93 16.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.36 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 3.5 ptt180 -78.66 8.94 4.55 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -88.94 -29.39 19.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.891 0.377 . . . . 10.0 110.446 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 250' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 251' ' ' LYS . 13.8 tt0 -167.4 159.55 12.55 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 250' ' ' GLU . 0.4 OUTLIER 79.2 179.08 0.11 Allowed 'General case' 0 C--O 1.234 0.278 0 O-C-N 124.276 0.985 . . . . 10.0 110.075 -179.119 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 252' ' ' GLU . . . . . 0.417 ' HG2' ' HG ' ' A' ' 285' ' ' LEU . 16.4 mp0 -64.75 97.88 0.24 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.124 0.787 . . . . 10.0 113.124 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -163.4 -45.33 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.62 -1.173 . . . . 10.0 108.28 178.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.08 -179.61 4.45 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.82 179.34 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 255' ' ' GLU . . . . . 0.514 ' HG2' HG22 ' A' ' 256' ' ' THR . 0.0 OUTLIER -86.06 -35.03 20.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.068 0.461 . . . . 10.0 110.613 -179.464 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 256' ' ' THR . . . . . 0.514 HG22 ' HG2' ' A' ' 255' ' ' GLU . 14.6 t -162.56 -42.41 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 10.0 109.844 179.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 1.5 t80 59.98 -73.14 0.03 OUTLIER 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.795 0.838 . . . . 10.0 112.225 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 62.31 -170.29 0.17 Allowed 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.051 0.54 . . . . 10.0 110.441 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -85.64 -21.44 53.7 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.56 -0.828 . . . . 10.0 111.421 179.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.85 -53.31 13.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.525 -0.337 . . . . 10.0 110.939 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 77.56 -168.6 54.46 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.755 -0.736 . . . . 10.0 111.483 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -130.61 -92.47 0.42 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.889 0.345 . . . . 10.0 110.112 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -153.79 168.46 26.23 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.643 -0.503 . . . . 10.0 109.643 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 3.0 m -83.65 -9.68 58.71 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.021 0.438 . . . . 10.0 110.082 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.59 -62.64 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.183 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.923 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -140.01 88.27 2.22 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.787 -0.82 . . . . 10.0 108.787 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.94 -47.57 77.2 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.802 -0.635 . . . . 10.0 110.752 -178.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 268' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.62 104.67 0.45 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.578 -0.737 . . . . 10.0 110.637 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 269' ' ' SER . . . . . 0.533 ' HB2' HE22 ' A' ' 271' ' ' GLN . 4.8 m -93.78 127.22 39.39 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.856 -179.223 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 27.0 ttp180 -96.31 78.61 3.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.294 0.569 . . . . 10.0 110.933 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 271' ' ' GLN . . . . . 0.533 HE22 ' HB2' ' A' ' 269' ' ' SER . 0.4 OUTLIER -121.87 133.8 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.745 178.535 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 41.4 t -79.25 89.48 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.036 0.446 . . . . 10.0 110.512 -179.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -168.34 -35.42 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.35 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 1.1 tp 69.87 -156.76 0.15 Allowed 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.477 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 6.5 t -132.7 -176.7 4.19 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.628 0.252 . . . . 10.0 110.723 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -164.7 -35.91 0.03 OUTLIER 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.446 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 -79.74 66.34 5.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.085 -0.507 . . . . 10.0 112.006 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . -95.79 -38.28 4.71 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.804 -0.712 . . . . 10.0 111.855 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 279' ' ' LEU . 2.7 mm? 55.91 -95.05 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.355 0.662 . . . . 10.0 112.36 179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 11.5 p -70.73 -24.09 24.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 111.778 0.288 . . . . 10.0 111.778 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 83.9 mt -64.95 -63.0 1.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.913 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 24.2 pt -59.39 -19.98 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.048 -0.524 . . . . 10.0 111.99 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -70.71 -25.03 62.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.922 0.391 . . . . 10.0 110.305 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -89.68 -26.48 20.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.417 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 285' ' ' LEU . . . . . 0.417 ' HG ' ' HG2' ' A' ' 252' ' ' GLU . 1.6 tm? -70.33 -34.82 73.12 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 286' ' ' LEU . . . . . 0.426 ' HG ' ' N ' ' A' ' 287' ' ' VAL . 34.3 tp -64.31 165.49 9.49 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.521 179.289 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 287' ' ' VAL . . . . . 0.426 ' N ' ' HG ' ' A' ' 286' ' ' LEU . 33.0 t 71.37 161.02 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 109.974 -0.38 . . . . 10.0 109.974 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 288' ' ' LYS . . . . . 0.416 ' N ' HG12 ' A' ' 287' ' ' VAL . 0.0 OUTLIER 81.25 158.94 0.15 Allowed 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.798 0.839 . . . . 10.0 110.901 179.806 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 73.92 166.2 0.29 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.339 -0.846 . . . . 10.0 111.607 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 290' ' ' GLY . . . . . 0.471 ' O ' ' HB ' ' A' ' 291' ' ' ILE . . . -82.49 159.36 38.57 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.999 -0.619 . . . . 10.0 112.886 -178.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 291' ' ' ILE . . . . . 0.471 ' HB ' ' O ' ' A' ' 290' ' ' GLY . 78.8 mt 79.35 -47.26 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 123.611 0.764 . . . . 10.0 110.425 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 41.4 ttp -93.95 17.82 11.6 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.199 -1.037 . . . . 10.0 108.199 177.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -77.87 -8.7 58.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.542 -1.208 . . . . 10.0 111.517 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -89.21 176.5 6.93 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.867 0.365 . . . . 10.0 110.739 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -84.62 69.49 3.32 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.203 -0.523 . . . . 10.0 112.815 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -125.13 173.42 8.75 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.153 -0.314 . . . . 10.0 110.153 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 21.0 m -112.39 159.23 18.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.47 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 15.9 tp -85.36 -21.52 28.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.351 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -92.5 5.85 49.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.726 0.298 . . . . 10.0 111.614 -179.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 10.0 m -69.18 141.38 91.53 Favored Pre-proline 0 C--N 1.326 -0.446 0 N-CA-C 110.042 -0.355 . . . . 10.0 110.042 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.44 -27.93 85.78 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.649 2.233 . . . . 10.0 111.885 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 302' ' ' ALA . . . . . 0.4 ' HA ' ' HG3' ' A' ' 810' ' ' MET . . . -84.75 -4.19 58.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.982 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -122.32 17.86 10.63 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.404 0.621 . . . . 10.0 110.194 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 9.6 tp -63.71 -25.22 37.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.313 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.0 tmm? -63.77 -47.27 81.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.895 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 306' ' ' LEU . . . . . 0.434 ' O ' ' HB2' ' A' ' 309' ' ' HIS . 14.7 tp -70.59 -38.03 73.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.218 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 13.4 tpt -61.42 -42.46 98.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.185 0.517 . . . . 10.0 109.889 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -67.47 -24.09 65.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.294 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 309' ' ' HIS . . . . . 0.528 ' HB3' HG11 ' A' ' 239' ' ' VAL . 35.5 m170 -71.05 -49.56 43.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.368 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 33.6 m -69.15 -25.78 30.48 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-O 120.798 0.333 . . . . 10.0 110.735 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 88.9 m -62.88 -40.27 97.01 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 312' ' ' ALA . . . . . . . . . . . . . . . -70.72 -39.58 73.3 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.343 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 313' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 317' ' ' HIS . . . -63.0 -38.25 90.45 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.744 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 19.4 tp -73.4 -34.68 65.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.369 0.604 . . . . 10.0 109.652 178.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 315' ' ' ARG . . . . . 0.702 ' O ' ' HB2' ' A' ' 319' ' ' LEU . 21.1 ttp180 -64.66 -42.34 95.47 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.173 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -88.3 20.57 3.21 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.103 0.478 . . . . 10.0 110.431 179.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 317' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 313' ' ' ALA . 1.7 t60 -108.06 -59.21 1.88 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.322 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -110.8 -21.32 12.12 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.287 0.477 . . . . 10.0 112.287 -179.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 319' ' ' LEU . . . . . 0.702 ' HB2' ' O ' ' A' ' 315' ' ' ARG . 3.9 mm? -78.75 -55.66 5.0 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.944 0.402 . . . . 10.0 110.285 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -99.56 113.55 26.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.277 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.73 142.31 30.45 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.537 0.684 . . . . 10.0 111.726 -179.023 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 322' ' ' ARG . . . . . 0.479 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 4.0 tpt180 -65.49 139.05 58.46 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.35 -0.841 . . . . 10.0 111.616 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 323' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 97.2 m-20 83.77 -29.21 0.09 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.311 1.044 . . . . 10.0 113.189 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 2.3 p -103.3 -44.71 9.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 120.705 -0.398 . . . . 10.0 111.574 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -87.57 -40.65 14.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.444 0.64 . . . . 10.0 110.367 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 54.7 p90 -143.36 147.69 35.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.699 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 5.8 tp -123.08 113.96 40.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.336 0.588 . . . . 10.0 110.253 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 328' ' ' VAL . . . . . 0.413 HG21 ' HG3' ' A' ' 361' ' ' GLU . 21.2 t -90.73 99.27 9.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.795 -0.638 . . . . 10.0 109.489 179.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 329' ' ' LYS . . . . . 0.445 ' O ' ' HD3' ' A' ' 329' ' ' LYS . 0.0 OUTLIER -117.15 131.14 56.95 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.818 -178.884 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 2.6 p30 42.61 42.24 2.74 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.092 0.957 . . . . 10.0 113.352 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 88.98 -10.64 72.04 Favored Glycine 0 C--N 1.33 0.211 0 C-N-CA 120.836 -0.697 . . . . 10.0 114.531 177.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -103.82 130.6 51.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 117.618 0.709 . . . . 10.0 111.072 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 47.2 t -96.03 102.65 13.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.076 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 43.9 mt -98.56 130.8 46.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.419 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 27.6 mt -83.52 135.31 25.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.4 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 16.3 t -108.57 129.12 63.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.857 0.36 . . . . 10.0 110.304 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -77.33 125.94 30.13 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.387 -0.369 . . . . 10.0 110.537 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -69.2 -30.49 68.69 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.947 0.403 . . . . 10.0 111.12 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -73.7 -65.5 0.82 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -177.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.25 -27.48 26.0 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.716 0.636 . . . . 10.0 112.716 -177.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 77.45 44.82 12.13 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.319 -0.943 . . . . 10.0 112.157 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.9 mmt85 -118.91 144.55 46.35 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.099 -0.334 . . . . 10.0 110.099 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.92 115.8 20.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.873 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 72.6 mtm -113.46 95.84 5.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.982 0.42 . . . . 10.0 110.911 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -81.47 -27.87 34.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.0 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -84.65 49.15 4.19 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.984 -0.627 . . . . 10.0 112.358 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -139.64 126.39 20.66 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 348' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 348' ' ' ARG . 0.6 OUTLIER -126.73 111.72 14.58 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.768 0.318 . . . . 10.0 110.914 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 75.3 m95 -88.42 139.06 30.87 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.764 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.99 -162.41 0.6 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.408 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 4.2 t70 61.65 16.59 7.88 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.276 0.631 . . . . 10.0 111.439 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 67.8 26.27 73.9 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 116.013 -0.539 . . . . 10.0 113.119 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 50.8 tp -59.35 -52.48 65.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.846 0.323 . . . . 10.0 111.271 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 354' ' ' HIS . . . . . 0.407 ' CE1' HE22 ' A' ' 355' ' ' GLN . 11.7 p80 -78.87 -12.85 60.04 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.827 -0.349 . . . . 10.0 111.267 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 355' ' ' GLN . . . . . 0.447 ' CD ' ' HA ' ' A' ' 368' ' ' GLU . 2.6 mp0 -66.27 -42.92 87.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.035 0.445 . . . . 10.0 110.22 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -69.5 -33.53 72.97 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.131 179.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 94.6 t -62.19 -47.96 90.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.075 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -65.63 -31.93 73.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.924 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -80.51 -20.74 42.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.603 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -89.57 -47.18 8.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.914 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 361' ' ' GLU . . . . . 0.413 ' HG3' HG21 ' A' ' 328' ' ' VAL . 49.6 mm-40 -77.21 168.93 19.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.322 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -81.33 70.4 3.1 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.26 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.0 -176.41 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 122.398 0.279 . . . . 10.0 110.363 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -103.16 148.02 26.29 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.754 -0.461 . . . . 10.0 109.754 179.206 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 365' ' ' ILE . . . . . . . . . . . . . 72.1 mt -74.11 142.37 14.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.244 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -75.13 -163.26 0.22 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.384 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -74.61 8.05 2.6 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.201 -0.454 . . . . 10.0 112.049 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 368' ' ' GLU . . . . . 0.447 ' HA ' ' CD ' ' A' ' 355' ' ' GLN . 37.9 mt-10 59.94 -96.48 0.06 Allowed 'General case' 0 C--O 1.236 0.384 0 C-N-CA 123.141 0.576 . . . . 10.0 112.494 179.11 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.405 ' HB3' ' CD ' ' A' ' 230' ' ' GLU . 55.9 t30 -146.44 -123.44 0.07 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 121.15 -0.22 . . . . 10.0 111.118 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -173.06 104.95 0.14 Allowed 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 117.788 0.267 . . . . 10.0 111.469 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 46.5 m -159.6 119.52 2.99 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.833 0.349 . . . . 10.0 111.199 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -138.82 -67.35 0.46 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.836 178.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -138.1 147.99 44.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.074 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 374' ' ' SER . . . . . . . . . . . . . 18.9 m -153.82 153.21 31.71 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.42 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.5 tt -146.45 146.22 19.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.754 0.311 . . . . 10.0 110.534 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.71 142.03 28.17 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -56.39 -52.3 65.13 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -56.05 -41.84 75.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.462 . . . . 10.0 110.62 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -69.68 -21.19 63.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.693 -0.685 . . . . 10.0 111.577 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -82.04 -42.71 18.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.857 0.36 . . . . 10.0 110.268 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -70.24 -17.77 63.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.312 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -78.26 -7.48 57.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.835 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 25.5 mt -89.25 -2.86 58.64 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.548 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.608 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 43.9 m-85 -96.48 137.79 35.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.793 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -70.64 -74.04 0.15 Allowed 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.169 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -88.86 98.51 11.77 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.432 HD23 HD21 ' A' ' 407' ' ' LEU . 56.2 tp -109.08 111.48 23.14 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.019 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -124.57 154.78 40.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.987 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -156.02 158.49 28.64 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.21 -0.995 . . . . 10.0 112.573 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 24.5 mtm -115.71 160.88 19.5 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.684 0.278 . . . . 10.0 110.419 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 391' ' ' THR . . . . . 0.576 ' HB ' HG22 ' A' ' 211' ' ' VAL . 6.6 t -164.31 169.79 17.01 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.111 178.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -93.71 166.21 27.58 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.832 -0.907 . . . . 10.0 110.832 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 393' ' ' THR . . . . . 0.466 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 0.2 OUTLIER -60.77 102.55 0.2 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.558 0.218 . . . . 10.0 110.594 179.719 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -141.79 -29.26 0.62 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.546 0.572 . . . . 10.0 112.546 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 38.8 t70 55.76 -119.63 1.41 Allowed 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 110.12 -0.326 . . . . 10.0 110.12 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 396' ' ' THR . . . . . 0.48 ' HB ' ' OE1' ' A' ' 397' ' ' GLU . 2.3 m 51.99 -100.9 0.1 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.97 0.73 . . . . 10.0 112.97 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 397' ' ' GLU . . . . . 0.48 ' OE1' ' HB ' ' A' ' 396' ' ' THR . 3.7 mp0 -76.91 9.8 2.68 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -58.8 -30.5 67.65 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.247 0.462 . . . . 10.0 112.247 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -72.2 -17.0 61.96 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.103 0.409 . . . . 10.0 112.103 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -81.59 -13.43 58.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.657 0.265 . . . . 10.0 111.277 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -61.16 -44.98 96.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.619 -0.264 . . . . 10.0 111.487 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 11.9 m -74.64 -4.44 37.22 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 48.9 m -111.15 -54.89 2.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.037 0.384 . . . . 10.0 112.037 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 49.3 mt -71.31 -47.95 56.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -106.3 -5.77 18.86 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm 60.5 47.5 8.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.37 0.605 . . . . 10.0 110.288 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 407' ' ' LEU . . . . . 0.525 HD13 HD11 ' A' ' 99' ' ' ILE . 42.0 mt -117.04 135.81 53.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.626 -0.715 . . . . 10.0 109.866 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 408' ' ' ASP . . . . . 0.665 ' OD1' ' HD2' ' A' ' 13' ' ' ARG . 1.1 t0 -75.69 175.87 8.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 10.2 m -138.78 125.61 21.0 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.947 -0.47 . . . . 10.0 111.881 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 47.2 t -130.97 137.39 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.851 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.9 t -92.74 134.67 29.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 110.195 -0.298 . . . . 10.0 110.195 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 412' ' ' VAL . . . . . 0.414 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 38.8 t -95.16 127.71 41.53 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.125 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 413' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 412' ' ' VAL . 24.6 Cg_exo -64.19 154.26 71.81 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.843 2.362 . . . . 10.0 112.055 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.3 p -84.11 154.42 23.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.196 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -66.85 -36.66 82.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.284 0.564 . . . . 10.0 109.588 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 41.2 mtm180 -129.45 154.19 80.72 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.001 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.48 115.3 2.94 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.429 2.086 . . . . 10.0 111.973 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 51.1 ttp -75.71 105.37 6.71 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.959 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -97.58 62.06 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.212 0.53 . . . . 10.0 110.936 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 36.2 ttp180 -98.42 115.57 28.78 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 47.0 mtpt -82.95 100.84 10.67 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.495 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 422' ' ' ASP . . . . . 0.47 ' HA ' ' OG ' ' A' ' 584' ' ' SER . 8.2 m-20 -89.0 102.35 14.99 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 68.1 mt -82.82 153.31 67.27 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.295 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.49 168.26 6.87 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.12 2.547 . . . . 10.0 113.444 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -88.17 124.31 33.69 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.312 -0.858 . . . . 10.0 110.706 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 58.3 mt -98.49 86.89 3.7 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.5 -0.556 . . . . 10.0 109.5 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 22.6 t -81.18 129.45 37.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.394 -179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 428' ' ' TYR . . . . . 0.505 ' CE2' ' HA ' ' A' ' 614' ' ' PRO . 6.9 m-85 -112.42 -178.17 3.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.358 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 62.9 mtm -80.99 -74.22 0.33 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.909 -0.317 . . . . 10.0 111.166 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 67.8 p -89.5 162.56 15.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.912 0.387 . . . . 10.0 111.415 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 431' ' ' GLU . . . . . 0.41 ' O ' HG12 ' A' ' 435' ' ' ILE . 3.9 tt0 -63.09 -29.8 71.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.175 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -59.43 -46.01 89.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.768 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -61.2 -44.46 97.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.23 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 434' ' ' LYS . . . . . 0.423 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 37.4 ttpt -58.69 -50.3 74.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.544 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 435' ' ' ILE . . . . . 0.46 ' O ' HG12 ' A' ' 439' ' ' ILE . 45.7 mm -61.25 -46.0 97.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.904 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 55.9 tp60 -58.13 -43.5 87.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.876 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.52 86.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.811 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 438' ' ' ILE . . . . . 0.431 HD13 HG22 ' A' ' 559' ' ' THR . 92.0 mt -62.42 -49.64 83.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.051 178.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 439' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 435' ' ' ILE . 45.6 mm -60.24 -38.76 78.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.253 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -61.83 -44.52 96.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.675 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 441' ' ' ASP . . . . . 0.604 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 14.8 t70 -63.98 -45.15 90.36 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.161 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 86.6 mt -58.65 -39.62 76.71 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.692 -0.686 . . . . 10.0 110.964 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -58.29 -40.62 82.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.676 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.419 ' O ' ' HE2' ' A' ' 448' ' ' LYS . 63.2 mm-40 -69.18 -40.14 78.28 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.765 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.604 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 17.7 mmt180 -65.66 -45.52 82.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.548 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 7.6 m -63.04 -38.48 91.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.593 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.7 -31.61 72.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.252 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 448' ' ' LYS . . . . . 0.419 ' HE2' ' O ' ' A' ' 444' ' ' GLU . 0.2 OUTLIER -86.86 -23.15 25.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.233 -179.491 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 95.93 29.25 8.71 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.838 -0.696 . . . . 10.0 111.825 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 450' ' ' GLN . . . . . 0.561 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 64.2 tt0 -101.43 130.99 23.61 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 120.451 0.167 . . . . 10.0 111.046 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.96 140.58 50.63 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.676 2.251 . . . . 10.0 111.282 178.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 23.9 t -121.61 133.69 67.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.692 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 60.4 tp -120.68 106.27 11.57 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 22.5 t -95.09 127.77 46.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.752 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -115.5 115.17 3.34 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.958 -0.639 . . . . 10.0 111.911 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 21.8 p -103.72 148.58 25.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.633 0.254 . . . . 10.0 110.839 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 457' ' ' ILE . . . . . 0.426 HG12 ' OE1' ' A' ' 560' ' ' GLU . 21.1 pt -92.36 -4.54 10.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.853 0.358 . . . . 10.0 111.107 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 7.5 m -148.82 146.98 28.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.082 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 47.6 mt -63.09 -36.68 76.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.396 -0.366 . . . . 10.0 111.127 -179.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.86 -37.23 71.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.036 0.446 . . . . 10.0 110.326 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -67.48 -40.03 85.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.04 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.87 -43.75 91.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.481 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -61.99 -43.05 99.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.637 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 40.6 tp -65.13 -50.17 67.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.901 -0.591 . . . . 10.0 111.546 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 9.3 p -64.88 -33.93 66.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 121.048 -0.261 . . . . 10.0 111.393 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 71.1 m -65.44 -38.91 91.27 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 120.84 0.352 . . . . 10.0 110.363 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -63.32 -48.27 78.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.261 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.94 -39.7 95.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.76 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 18.8 mt -63.49 -37.24 86.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.891 0.377 . . . . 10.0 110.432 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 20.7 m -68.92 -39.93 79.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.43 0.633 . . . . 10.0 109.807 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt -64.7 -32.11 73.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.215 -0.902 . . . . 10.0 110.493 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -87.41 -4.61 59.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.293 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 68.31 31.55 74.53 Favored Glycine 0 C--N 1.329 0.169 0 CA-C-N 116.116 -0.493 . . . . 10.0 112.963 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 57.5 mt -101.06 136.68 31.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.731 0.301 . . . . 10.0 110.62 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.483 ' O ' ' HB ' ' A' ' 500' ' ' VAL . 52.8 mttm -61.0 134.63 57.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.135 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 476' ' ' HIS . . . . . 0.405 ' HA ' ' O ' ' A' ' 500' ' ' VAL . 45.5 p-80 -152.84 125.4 8.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.066 0.46 . . . . 10.0 111.289 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -110.13 124.25 51.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.868 -0.606 . . . . 10.0 109.467 178.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 19.1 t -94.16 122.24 45.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.805 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.469 HD12 ' HB2' ' A' ' 503' ' ' ALA . 21.0 mt -79.5 72.83 6.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.429 0.633 . . . . 10.0 110.412 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -68.8 126.03 28.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.473 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -66.95 -18.57 65.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.618 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -72.51 -29.88 63.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.003 0.43 . . . . 10.0 110.567 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -107.71 74.33 0.95 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.955 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -65.71 -32.55 74.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.921 0.391 . . . . 10.0 110.68 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.36 -38.74 90.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.572 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -80.44 -29.88 37.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.098 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' GLU . . . . . 0.43 ' HG3' HD22 ' A' ' 479' ' ' LEU . 26.4 tt0 -54.49 -47.41 73.07 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.516 -0.766 . . . . 10.0 110.864 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -56.82 -41.45 77.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.288 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -68.64 -41.33 79.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.956 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.2 mt -64.35 -47.82 87.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.911 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 97.4 t -63.58 -36.96 78.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.918 0.389 . . . . 10.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -62.9 -33.95 76.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.672 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -113.0 23.16 13.67 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.972 0.415 . . . . 10.0 111.106 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -73.18 -18.81 61.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.107 0.48 . . . . 10.0 110.928 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -94.38 15.0 64.21 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.867 -0.682 . . . . 10.0 111.744 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 496' ' ' TYR . . . . . 0.402 ' HA ' ' HD3' ' A' ' 497' ' ' PRO . 5.5 t80 -71.27 140.63 85.3 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 110.365 -0.235 . . . . 10.0 110.365 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 497' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 496' ' ' TYR . 52.4 Cg_exo -56.54 128.11 28.69 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.398 2.065 . . . . 10.0 112.371 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 64.6 32.94 11.14 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.031 179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -111.52 121.6 45.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.566 -0.288 . . . . 10.0 110.274 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 500' ' ' VAL . . . . . 0.483 ' HB ' ' O ' ' A' ' 475' ' ' LYS . 44.5 t -101.92 117.75 47.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.035 0.445 . . . . 10.0 110.927 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.6 m -109.47 135.88 49.77 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.282 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 25.9 mt -115.99 123.47 71.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.706 0.289 . . . . 10.0 110.548 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 503' ' ' ALA . . . . . 0.469 ' HB2' HD12 ' A' ' 479' ' ' LEU . . . -122.51 136.89 54.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.777 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 10.3 m -107.48 122.23 46.22 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.702 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 16.7 m120 53.37 68.04 0.9 Allowed 'General case' 0 N--CA 1.465 0.294 0 O-C-N 123.682 0.614 . . . . 10.0 110.743 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.03 135.04 57.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.176 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.9 172.59 12.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.712 -0.677 . . . . 10.0 110.848 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -68.9 167.1 46.17 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 121.009 -0.615 . . . . 10.0 112.422 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.468 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 74.8 mtt180 64.96 -86.71 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.023 0.529 . . . . 10.0 111.179 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.2 133.23 5.68 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.835 -0.697 . . . . 10.0 112.376 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.35 153.88 39.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.714 0.292 . . . . 10.0 111.046 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -76.96 112.98 14.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.806 0.336 . . . . 10.0 110.462 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 82.5 mt -84.56 125.0 40.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.186 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 2.0 t -85.84 125.47 40.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.788 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.4 HD21 ' HB2' ' A' ' 554' ' ' LEU . 72.4 mt -74.99 132.07 41.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.585 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 91.94 -4.31 78.24 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.505 -0.638 . . . . 10.0 111.505 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 113.0 -175.32 16.55 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.608 -0.997 . . . . 10.0 110.608 -179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 1.6 p -123.26 93.83 4.07 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.304 0.552 . . . . 10.0 111.018 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 34.8 p-90 -59.22 -32.99 70.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.009 0.433 . . . . 10.0 110.405 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -66.54 -23.58 66.25 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.32 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -92.96 -33.22 14.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.095 0.474 . . . . 10.0 109.864 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -68.2 -39.83 82.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.748 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 523' ' ' VAL . . . . . 0.544 HG12 HD12 ' A' ' 537' ' ' ILE . 26.8 m -73.53 -23.1 19.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.973 0.416 . . . . 10.0 110.318 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -81.94 -27.67 33.18 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.716 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -66.26 -27.77 68.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.442 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 25.2 mt -75.98 136.5 40.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.979 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -69.33 -32.21 71.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.987 0.422 . . . . 10.0 110.027 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -134.36 88.11 31.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.312 179.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -84.34 103.01 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.462 2.108 . . . . 10.0 112.06 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 20.8 p -75.83 162.7 27.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.52 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -60.37 -34.42 73.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.937 0.398 . . . . 10.0 110.364 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.38 -47.39 76.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.107 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -64.26 -43.08 95.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.826 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 72.4 mt -59.46 -42.78 88.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.609 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.64 -36.84 68.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.541 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 9.5 tptt -64.18 -50.27 68.78 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.327 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 537' ' ' ILE . . . . . 0.544 HD12 HG12 ' A' ' 523' ' ' VAL . 81.4 mt -63.6 -36.05 74.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 110.114 -0.328 . . . . 10.0 110.114 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -62.3 -45.79 91.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.064 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -68.32 -40.5 81.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.449 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.56 -45.16 94.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.574 -0.739 . . . . 10.0 109.454 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 50.0 t90 -61.68 -37.63 84.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.842 -1.072 . . . . 10.0 110.877 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 40.2 tp60 -57.39 -44.9 84.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.778 0.323 . . . . 10.0 110.879 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 42.2 t -64.03 -42.74 96.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.083 0.468 . . . . 10.0 110.314 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -68.83 -38.14 79.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.588 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -62.27 -45.21 94.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.963 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.08 -34.22 77.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.271 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -60.22 -39.39 86.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.732 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 99.6 t -69.69 -39.05 77.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.526 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.88 -45.94 90.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.598 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -69.51 -15.52 63.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.503 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 551' ' ' ALA . . . . . 0.561 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -86.02 -25.86 25.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.974 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 123.89 22.75 2.14 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.567 -0.825 . . . . 10.0 112.896 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 71.12 -162.51 54.14 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.007 -0.616 . . . . 10.0 112.636 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.4 ' HB2' HD21 ' A' ' 515' ' ' LEU . 50.7 tp -74.36 126.71 31.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.089 -0.337 . . . . 10.0 110.089 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 555' ' ' HIS . . . . . 0.421 ' HA ' ' O ' ' A' ' 583' ' ' SER . 65.9 t60 -97.86 110.97 23.44 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.328 -179.005 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 16.7 mm -92.8 132.88 35.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.427 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 26.4 mt -127.5 124.51 63.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.909 0.385 . . . . 10.0 110.239 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -110.13 129.92 9.62 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 111.32 -0.712 . . . . 10.0 111.32 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 559' ' ' THR . . . . . 0.431 HG22 HD13 ' A' ' 438' ' ' ILE . 16.1 p -79.58 -34.31 40.96 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.155 0.502 . . . . 10.0 110.62 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 560' ' ' GLU . . . . . 0.426 ' OE1' HG12 ' A' ' 457' ' ' ILE . 25.8 mp0 -142.04 160.19 40.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.074 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 561' ' ' ARG . . . . . 0.508 ' HB2' HD22 ' A' ' 594' ' ' LEU . 24.7 mmt180 -98.11 150.35 21.53 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.257 -0.645 . . . . 10.0 109.257 178.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -93.91 145.35 24.69 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -62.33 -57.54 10.96 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.2 107.96 6.7 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.064 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 41.8 ttt85 -60.53 -16.96 42.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.952 -0.567 . . . . 10.0 112.275 -178.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -55.85 -41.96 75.1 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 121.236 0.541 . . . . 10.0 110.299 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 58.9 mt -84.59 -28.99 6.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.367 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -61.52 -48.08 82.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.415 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -64.13 -36.27 83.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.667 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -70.89 -28.79 64.8 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.196 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.429 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 25.5 tp -66.44 -39.84 89.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.994 0.426 . . . . 10.0 110.467 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 32.5 mtm105 -82.4 -16.03 50.51 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.19 0.519 . . . . 10.0 110.009 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.26 4.2 34.7 Favored Glycine 0 CA--C 1.52 0.355 0 CA-C-N 115.731 -0.668 . . . . 10.0 113.225 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 574' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 2.4 mmt180 -77.08 -24.29 51.85 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 3.8 t -106.97 162.39 13.88 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.915 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 66.67 40.91 94.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.224 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -87.43 143.81 27.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.178 -0.305 . . . . 10.0 110.178 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 578' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 105' ' ' GLY . 60.4 mt-30 64.75 23.56 12.74 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.637 0.586 . . . . 10.0 110.371 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 69.85 45.14 59.22 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.524 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -107.52 -167.27 1.24 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.296 -0.261 . . . . 10.0 110.296 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -88.82 167.82 12.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.22 0.533 . . . . 10.0 111.877 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 168.86 166.06 27.29 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.512 -0.635 . . . . 10.0 111.512 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.421 ' O ' ' HA ' ' A' ' 555' ' ' HIS . 4.8 p -152.51 142.38 22.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.919 0.359 . . . . 10.0 110.52 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 584' ' ' SER . . . . . 0.47 ' OG ' ' HA ' ' A' ' 422' ' ' ASP . 84.6 p -126.61 139.67 53.01 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.07 0.462 . . . . 10.0 110.554 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 4.3 tpm_? -135.83 109.42 7.98 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.909 -0.775 . . . . 10.0 108.909 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -102.34 145.31 29.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.269 0.557 . . . . 10.0 111.671 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 587' ' ' TYR . . . . . 0.423 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 68.6 m-85 -127.5 164.45 21.91 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.193 -0.912 . . . . 10.0 109.39 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 588' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 587' ' ' TYR . 5.5 mt -163.57 166.89 22.01 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.194 -0.299 . . . . 10.0 110.194 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 589' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 428' ' ' TYR . 0.3 OUTLIER -139.01 150.43 45.81 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 178.262 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 590' ' ' MET . . . . . 0.437 ' HA ' ' HG3' ' A' ' 595' ' ' MET . 75.3 mmm -68.47 -8.51 41.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.563 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -93.66 2.12 56.41 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.875 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -80.58 154.46 27.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.849 0.357 . . . . 10.0 110.864 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -68.15 -17.86 64.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.746 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.546 ' O ' HG12 ' A' ' 597' ' ' ILE . 9.1 tp -65.61 -24.01 66.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.992 0.425 . . . . 10.0 110.998 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.437 ' HG3' ' HA ' ' A' ' 590' ' ' MET . 13.6 mmt -73.89 1.63 10.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.652 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -96.84 -3.11 42.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.24 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.546 HG12 ' O ' ' A' ' 594' ' ' LEU . 24.0 pt -84.9 -3.22 7.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.07 0.462 . . . . 10.0 110.971 -179.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -89.78 1.55 55.99 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.696 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.84 -66.03 0.23 Allowed 'General case' 0 N--CA 1.466 0.35 0 O-C-N 124.001 0.813 . . . . 10.0 111.827 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.7 m -86.74 120.53 28.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.011 0.434 . . . . 10.0 110.918 -179.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.16 -19.39 64.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.656 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -61.26 -34.57 75.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.69 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 49.4 t -65.13 -49.36 79.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.067 0.46 . . . . 10.0 109.885 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.0 -35.63 81.08 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.378 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -64.94 -38.02 94.99 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 116.076 -0.511 . . . . 10.0 112.237 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 37.8 tpp -68.16 -28.36 67.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.905 0.383 . . . . 10.0 110.543 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 58.0 mtt -68.28 -24.61 64.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.809 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 80.1 mtt-85 -69.59 -17.99 63.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.866 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -82.39 9.21 9.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.072 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 4.2 tp -78.79 -11.01 59.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.056 0.455 . . . . 10.0 110.461 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 611' ' ' GLY . . . . . 0.443 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 87.79 -45.64 3.36 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.575 -0.821 . . . . 10.0 111.776 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 612' ' ' MET . . . . . 0.443 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.6 OUTLIER 73.36 -56.8 0.65 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.625 0.77 . . . . 10.0 111.912 179.154 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 18.2 mtpp 61.21 80.79 0.25 Allowed Pre-proline 0 N--CA 1.463 0.204 0 O-C-N 123.523 0.515 . . . . 10.0 111.153 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 614' ' ' PRO . . . . . 0.505 ' HA ' ' CE2' ' A' ' 428' ' ' TYR . 32.5 Cg_exo -58.93 106.86 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.018 2.479 . . . . 10.0 112.451 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 120.0 -22.29 8.61 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.921 -0.657 . . . . 10.0 112.009 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -106.1 116.65 32.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.814 0.34 . . . . 10.0 110.1 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -69.14 102.01 1.57 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.873 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 10.5 tp -71.99 -33.09 46.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.174 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 48.14 86.29 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.428 0.691 . . . . 10.0 112.853 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -120.51 96.75 48.95 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.245 179.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.59 -29.49 85.35 Favored 'Trans proline' 0 N--CA 1.476 0.446 0 C-N-CA 123.49 2.793 . . . . 10.0 114.456 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 56.0 p-90 -63.21 -24.44 67.88 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.638 -0.425 . . . . 10.0 111.374 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 95.9 t -65.71 -48.24 83.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 91.3 m -61.1 -38.86 87.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.463 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -35.22 79.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.27 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -68.7 -45.04 72.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.196 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 77.9 mt -66.28 -41.48 89.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.706 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.03 -41.49 92.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.976 0.417 . . . . 10.0 110.75 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -70.07 -38.77 75.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.125 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 630' ' ' ALA . . . . . 0.403 ' O ' HG23 ' A' ' 634' ' ' VAL . . . -61.36 -42.09 98.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.943 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -58.93 -42.21 89.22 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.299 0.571 . . . . 10.0 110.022 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -70.48 -34.81 72.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.563 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -59.47 -38.05 79.77 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.786 0.327 . . . . 10.0 110.327 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 634' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 630' ' ' ALA . 95.1 t -57.09 -52.64 53.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.423 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -73.07 -25.7 61.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.353 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 56.9 m -64.19 -38.27 90.44 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -77.44 -34.93 54.45 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.21 -0.663 . . . . 10.0 109.21 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 28.6 t30 -64.67 -40.51 95.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.088 -0.96 . . . . 10.0 110.606 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.09 -37.7 83.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.75 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 640' ' ' ASP . . . . . 0.502 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 3.4 t70 -62.09 -27.6 69.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.084 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 58.0 mt -81.6 -37.24 15.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.408 -0.589 . . . . 10.0 109.408 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 53.9 mtm-85 -62.02 -38.49 88.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.33 179.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 643' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 14.6 pttm -65.56 -27.16 68.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.958 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -65.44 -41.7 93.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.159 0.504 . . . . 10.0 109.734 179.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.98 -41.61 77.67 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.043 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 646' ' ' LEU . . . . . 0.409 ' O ' ' HB2' ' A' ' 650' ' ' ASP . 96.1 mt -61.07 -40.7 94.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.696 -0.683 . . . . 10.0 110.939 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -56.46 -36.37 68.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.101 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -83.8 -41.47 17.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.673 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -70.95 -32.09 68.88 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 650' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 653' ' ' ASN . 0.3 OUTLIER -63.59 -32.58 74.09 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.892 0.377 . . . . 10.0 110.731 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 651' ' ' VAL . . . . . 0.474 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 44.8 t -63.53 -44.08 98.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.382 0.61 . . . . 10.0 109.435 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -73.6 -24.42 60.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.412 -0.813 . . . . 10.0 110.34 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 653' ' ' ASN . . . . . 0.411 ' HB3' ' O ' ' A' ' 650' ' ' ASP . 18.1 t30 -61.83 -51.57 67.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.584 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.84 -43.93 97.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.798 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 655' ' ' GLN . . . . . 0.474 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 29.7 mt-30 -61.89 -44.57 96.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.368 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 16.6 ttp-105 -61.79 -42.89 99.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.124 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 45.3 ttp180 -66.39 -43.19 86.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.656 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.7 -47.11 79.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.125 -0.489 . . . . 10.0 112.014 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.8 tp -67.79 -39.84 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 120.935 -0.306 . . . . 10.0 111.389 -179.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -70.55 -31.19 68.14 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.672 -0.411 . . . . 10.0 110.088 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 27.6 t -61.34 -51.0 70.65 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -59.29 -46.52 88.34 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.34 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -60.11 -43.28 95.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.085 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -74.6 -35.19 62.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.756 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -64.57 -43.01 95.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.874 0.369 . . . . 10.0 110.038 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 79.7 mt -76.42 -17.08 59.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.343 0.592 . . . . 10.0 109.98 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 24.4 tp -76.54 -37.44 56.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.247 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -54.38 28.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.584 -0.735 . . . . 10.0 111.288 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 26.8 m -76.39 149.05 6.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.079 -0.509 . . . . 10.0 111.603 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.61 -24.0 16.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.334 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -83.37 108.63 16.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.273 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 672' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 676' ' ' ILE . 7.9 p -113.59 -3.94 11.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.221 0.534 . . . . 10.0 109.863 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -42.16 72.63 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.338 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.85 -46.74 88.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.916 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 675' ' ' THR . . . . . 0.414 ' O ' HG12 ' A' ' 679' ' ' ILE . 3.8 m -64.26 -48.03 77.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.297 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 676' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 672' ' ' VAL . 48.2 mm -57.29 -43.86 82.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.45 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.81 -40.34 75.99 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.045 -0.262 . . . . 10.0 111.372 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 69.6 m -61.43 -44.07 97.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.573 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 679' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 675' ' ' THR . 45.0 pt -77.26 -23.62 14.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 120.839 -0.344 . . . . 10.0 111.285 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 36.2 ttm-85 -60.4 -46.07 91.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.951 0.405 . . . . 10.0 110.61 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -63.84 -37.84 88.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.744 -0.662 . . . . 10.0 111.014 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -70.29 -47.56 60.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.205 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 683' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 679' ' ' ILE . 75.8 t -59.79 -46.81 93.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.969 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -63.44 -42.72 98.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.482 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.4 tttm -60.54 -50.87 71.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.457 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.81 89.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.908 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 95.5 m -62.84 -46.27 88.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.727 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 95.8 mt -66.29 -41.29 88.79 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 116.58 -0.282 . . . . 10.0 110.381 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -56.61 -29.73 62.46 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.677 0.391 . . . . 10.0 111.921 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -72.97 -23.25 60.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 10.0 112.033 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -111.71 -30.41 7.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.894 0.378 . . . . 10.0 111.184 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 692' ' ' ILE . . . . . 0.617 HG23 ' CD1' ' A' ' 701' ' ' TRP . 86.1 mt -127.84 108.03 20.34 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.454 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.14 132.1 20.52 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.352 2.035 . . . . 10.0 111.001 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -52.04 116.21 2.64 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.633 2.222 . . . . 10.0 112.69 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 63.57 74.06 0.43 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.801 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 17.1 p -135.25 -162.2 1.23 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.557 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 88.9 mt -98.41 159.29 15.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.598 -0.273 . . . . 10.0 110.585 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.41 -38.63 71.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.883 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -67.24 -16.19 64.14 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.96 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 43.0 mtt -92.49 -6.1 50.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.983 0.42 . . . . 10.0 110.482 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 701' ' ' TRP . . . . . 0.617 ' CD1' HG23 ' A' ' 692' ' ' ILE . 46.5 m0 -90.75 103.67 16.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.431 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -80.81 77.96 7.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.364 0.602 . . . . 10.0 110.006 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 703' ' ' ILE . . . . . 0.492 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.5 mm -61.65 -48.09 90.86 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.304 -0.862 . . . . 10.0 111.197 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 704' ' ' PRO . . . . . 0.492 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.2 Cg_exo -55.85 -47.27 25.94 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 121.889 1.726 . . . . 10.0 112.134 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -65.03 -43.01 96.41 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.033 -0.603 . . . . 10.0 112.293 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 61.9 tp -61.63 -46.58 89.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.767 0.318 . . . . 10.0 110.466 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -63.64 -40.46 96.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.788 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -56.52 -41.62 77.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.994 0.426 . . . . 10.0 110.862 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 709' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 709' ' ' ARG . 1.2 tpt180 -75.77 -47.62 25.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.176 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 66.6 mt -60.67 -45.68 93.23 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 44.8 mttt -75.38 -5.88 47.16 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -178.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -116.6 -57.37 2.19 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.09 0.774 . . . . 10.0 113.09 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -89.29 -16.76 30.39 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.929 0.715 . . . . 10.0 112.929 -177.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -108.48 -7.22 15.83 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.14 -0.624 . . . . 10.0 111.603 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.16 27.28 17.07 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.068 0.461 . . . . 10.0 110.786 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 1.9 mp -108.53 100.76 9.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.486 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -86.26 77.25 9.57 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.013 -0.539 . . . . 10.0 109.712 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.64 131.52 21.72 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.346 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 719' ' ' PRO . . . . . 0.501 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 85.4 Cg_endo -83.75 65.81 7.33 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.152 2.568 . . . . 10.0 112.23 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 720' ' ' ILE . . . . . 0.401 ' HA ' ' CE3' ' A' ' 723' ' ' TRP . 52.6 mt -59.53 -43.77 91.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.689 -179.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -66.45 -27.27 67.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.022 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 722' ' ' GLU . . . . . 0.501 ' HB2' ' HB2' ' A' ' 719' ' ' PRO . 1.0 OUTLIER -98.58 27.58 4.74 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.776 -179.581 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 723' ' ' TRP . . . . . 0.401 ' CE3' ' HA ' ' A' ' 720' ' ' ILE . 4.7 m0 -115.41 -47.44 2.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.636 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 94.8 mt -63.84 -21.1 66.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.089 -0.505 . . . . 10.0 112.081 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -78.4 -17.32 56.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.039 0.447 . . . . 10.0 110.613 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -107.39 -29.9 9.0 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.784 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 727' ' ' GLU . . . . . 0.545 ' O ' ' HB2' ' A' ' 730' ' ' LEU . 33.7 mt-10 -123.65 87.35 52.44 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.53 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -63.75 -30.73 69.23 Favored 'Trans proline' 0 CA--C 1.528 0.195 0 C-N-CA 122.577 2.185 . . . . 10.0 112.218 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -91.11 20.11 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.411 -0.358 . . . . 10.0 111.258 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 730' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 727' ' ' GLU . 0.5 OUTLIER -66.75 -30.09 70.22 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.829 -0.434 . . . . 10.0 109.829 178.938 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 32.4 m170 62.44 -167.71 0.2 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.54 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.84 -45.0 6.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.164 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -61.22 -55.12 35.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.636 -0.257 . . . . 10.0 111.154 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 734' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 730' ' ' LEU . 1.3 m -58.27 -32.89 68.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.839 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 37.5 tp -63.56 -42.94 98.31 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 51.7 mtt180 -62.84 -44.85 95.04 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.949 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -62.09 -36.18 80.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.91 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 20.8 mmm-85 -61.08 -50.64 72.45 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.943 -0.391 . . . . 10.0 109.943 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 59.7 mt -60.08 -43.36 92.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.381 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 34.1 tp -63.29 -48.12 79.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.767 -0.651 . . . . 10.0 111.029 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.18 -40.21 95.62 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.869 0.366 . . . . 10.0 111.014 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -39.36 93.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.919 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 743' ' ' SER . . . . . 0.41 ' O ' ' HB2' ' A' ' 747' ' ' TYR . 48.3 p -61.27 -38.3 86.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.76 0.314 . . . . 10.0 110.444 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 58.2 mt -70.2 -41.89 78.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.192 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -60.87 -46.59 90.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.553 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 87.6 t -69.49 -37.27 74.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.433 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 747' ' ' TYR . . . . . 0.41 ' HB2' ' O ' ' A' ' 743' ' ' SER . 20.8 t80 -61.04 -51.95 67.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.341 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 748' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 93.1 mt-30 -63.84 -28.05 69.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.438 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -46.03 79.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.847 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -67.13 -33.6 75.79 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.154 -0.476 . . . . 10.0 109.824 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.44 -25.24 67.87 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.367 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 752' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 85.5 mt-10 -62.15 -24.8 67.39 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.895 0.332 . . . . 10.0 111.895 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 1.7 t -102.59 4.93 10.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.266 0.555 . . . . 10.0 110.611 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 47.8 t -113.64 -49.68 5.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.17 145.82 6.96 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.047 -0.821 . . . . 10.0 111.047 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 756' ' ' ALA . . . . . 0.471 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -59.98 -66.25 0.55 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.056 0.428 . . . . 10.0 111.785 -178.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.48 -27.48 66.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.068 0.461 . . . . 10.0 110.742 -179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.5 tpt -66.56 -46.91 74.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.876 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 759' ' ' MET . . . . . 0.404 ' O ' ' HG3' ' A' ' 763' ' ' GLU . 12.4 tpt -62.39 -38.66 90.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.556 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.9 mmp_? -59.13 -35.11 72.9 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.267 0.556 . . . . 10.0 110.41 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -69.96 -38.41 76.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.581 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -65.51 -44.93 85.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.085 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.446 ' HA ' HD21 ' A' ' 826' ' ' LEU . 84.9 mt-10 -58.95 -49.29 78.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.857 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -59.74 -42.97 94.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.306 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.89 -46.82 92.79 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.946 -0.645 . . . . 10.0 112.011 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.15 -42.09 91.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-O 120.686 0.279 . . . . 10.0 110.637 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 23.7 mtp -59.09 -48.47 81.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.606 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.7 -44.94 92.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.53 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 -59.35 -46.26 89.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.115 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 9.2 m -65.74 -39.94 91.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.974 0.416 . . . . 10.0 110.416 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.2 tt -61.46 -49.88 75.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.942 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -64.29 -30.98 72.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.934 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 7.8 t -64.69 -52.67 55.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.214 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 71.4 mt -72.79 -26.96 61.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.245 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 9.3 t-105 -60.5 -47.01 88.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.621 -0.263 . . . . 10.0 110.835 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -69.96 -31.34 69.02 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.768 -0.373 . . . . 10.0 110.337 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.24 -47.16 74.66 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 38.1 t60 -60.06 -40.46 89.54 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.69 -1.141 . . . . 10.0 110.64 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 19.7 mt -63.46 -46.77 84.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.537 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -65.69 -43.29 89.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.382 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.57 -46.43 89.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.03 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 50.8 mmm -63.1 -41.58 99.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.762 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.21 -46.95 86.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.828 0.347 . . . . 10.0 110.52 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -65.24 -38.81 91.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.03 0.443 . . . . 10.0 110.458 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 785' ' ' LEU . . . . . 0.502 ' O ' ' HB ' ' A' ' 789' ' ' ILE . 15.8 tp -67.4 -38.89 85.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.468 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -57.06 -42.51 80.73 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.63 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -84.31 -31.86 24.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.388 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -78.74 -26.01 59.46 Favored Glycine 0 CA--C 1.52 0.362 0 C-N-CA 120.695 -0.764 . . . . 10.0 113.054 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 789' ' ' ILE . . . . . 0.502 ' HB ' ' O ' ' A' ' 785' ' ' LEU . 0.4 OUTLIER -57.99 -22.66 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 122.871 0.468 . . . . 10.0 111.506 -179.566 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 33.8 m170 -60.49 -34.23 73.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.631 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 53.9 mt -77.18 -33.43 56.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.535 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -75.49 -13.36 60.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.091 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -79.35 77.18 1.87 Allowed Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 111.153 -0.779 . . . . 10.0 111.153 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -80.0 -176.37 5.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.876 0.369 . . . . 10.0 111.254 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -63.79 142.74 58.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.537 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 67.12 10.92 8.08 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.954 -179.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -122.61 126.95 48.73 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.317 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -84.52 120.28 74.02 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.251 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.0 -16.43 49.5 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 122.9 2.4 . . . . 10.0 113.314 -178.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 22.1 mtmm -90.88 -49.6 6.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.947 0.403 . . . . 10.0 110.022 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -65.07 -39.46 93.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.104 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -65.9 -41.97 90.8 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -59.83 -37.03 78.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.479 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -67.01 -25.7 66.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.466 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 44.9 ttp85 -80.16 -47.95 13.92 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -58.1 -43.46 87.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.644 -0.707 . . . . 10.0 111.048 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 3.9 p -66.86 -37.73 85.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.265 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -66.11 -48.44 70.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.555 -0.293 . . . . 10.0 110.416 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 15.0 m -63.11 -34.78 78.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.092 0.472 . . . . 10.0 110.169 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 810' ' ' MET . . . . . 0.4 ' HG3' ' HA ' ' A' ' 302' ' ' ALA . 35.0 ttm -66.78 -36.48 82.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.86 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -70.55 -44.08 68.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.334 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -59.67 -47.07 87.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.385 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.64 81.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.799 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 23.6 ttp -62.78 -36.25 82.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.447 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 95.7 mt -71.88 -30.02 64.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.479 . . . . 10.0 109.876 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 816' ' ' GLU . . . . . 0.475 ' HA ' ' CE ' ' A' ' 819' ' ' LYS . 74.4 mm-40 -69.8 -45.14 68.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.474 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 1.3 p -70.11 -28.73 65.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.615 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 818' ' ' LEU . . . . . 0.41 ' O ' HG23 ' A' ' 822' ' ' VAL . 58.8 tp -56.7 -63.15 1.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.705 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 819' ' ' LYS . . . . . 0.475 ' CE ' ' HA ' ' A' ' 816' ' ' GLU . 31.0 pttt -62.31 -32.8 73.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.797 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -60.91 -59.22 5.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.271 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -66.42 -32.58 74.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.309 -0.405 . . . . 10.0 111.584 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 822' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 818' ' ' LEU . 20.3 t -60.87 -53.25 51.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-O 120.792 0.33 . . . . 10.0 110.211 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 33.7 mm -65.36 -37.46 80.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.42 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 45.5 t -58.44 -57.88 10.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.229 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 22.1 m -59.19 -42.61 91.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.377 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 826' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 763' ' ' GLU . 68.2 mt -65.39 -43.26 91.26 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -178.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 4.9 m -75.03 -26.06 59.2 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.974 0.416 . . . . 10.0 111.059 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -87.06 11.95 12.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.451 0.538 . . . . 10.0 112.451 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.8 p -64.17 128.98 27.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -101.69 115.26 30.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.035 0.445 . . . . 10.0 111.15 -179.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 4.4 m -135.19 155.26 37.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.607 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 25.3 ptt-85 -74.1 93.25 2.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.168 0.508 . . . . 10.0 110.455 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 72.3 mtp -80.08 139.34 52.99 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.543 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -68.15 147.36 72.81 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.667 2.245 . . . . 10.0 111.701 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.53 105.06 11.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.962 0.411 . . . . 10.0 110.208 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 . . . . . 0 C--O 1.245 0.839 0 CA-C-O 118.562 -0.732 . . . . 10.0 110.332 -179.922 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.767 0.317 . . . . 10.0 110.721 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.0 168.76 20.11 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 41.0 mt -64.12 97.82 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.586 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.6 m -84.31 -31.64 24.76 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.158 0.504 . . . . 10.0 110.528 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 43.5 tp -88.18 110.73 20.92 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.264 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.1 171.99 17.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.133 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -54.52 115.92 2.39 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 123.757 0.661 . . . . 10.0 110.032 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -100.78 14.53 31.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.034 0.445 . . . . 10.0 111.42 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -83.41 87.97 6.98 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.141 0.496 . . . . 10.0 110.541 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -79.42 138.96 37.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.468 -0.787 . . . . 10.0 110.338 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 72.0 mt -111.1 99.89 44.87 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.164 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -68.12 -15.32 42.81 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.068 2.512 . . . . 10.0 112.621 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.429 ' O ' HG23 ' B' ' 17' ' ' VAL . 70.8 mt -58.2 -34.99 70.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.528 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.48 -48.92 78.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.235 -0.439 . . . . 10.0 112.009 -179.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 32.4 m -79.25 -13.83 13.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.919 0.39 . . . . 10.0 111.569 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.24 -30.77 62.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.062 0.458 . . . . 10.0 110.361 179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.526 ' O ' HG23 ' B' ' 21' ' ' VAL . 72.8 t -64.26 -41.19 91.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.516 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.23 -25.84 67.33 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.3 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.66 -48.66 30.62 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.87 -26.44 60.58 Favored Glycine 0 N--CA 1.452 -0.292 0 CA-C-N 115.546 -0.752 . . . . 10.0 112.908 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 17' ' ' VAL . 85.6 t -63.25 -20.99 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 120.952 0.406 . . . . 10.0 111.196 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 2.4 tpt -85.09 -4.49 59.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.865 0.364 . . . . 10.0 111.268 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.4 m -134.67 -174.52 3.61 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.141 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -88.11 62.89 7.01 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -80.09 115.53 19.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.496 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -105.19 -5.44 20.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.892 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 30.3 ttm -83.49 66.97 9.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.798 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.956 0 CA-C-O 118.886 -0.578 . . . . 10.0 110.365 179.916 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 47.4 t . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -126.57 120.58 29.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.703 0.287 . . . . 10.0 110.773 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 109.76 -168.43 13.18 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.117 -0.563 . . . . 10.0 111.94 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.428 ' H ' ' HD2' ' A' ' 16' ' ' ARG . 0.3 OUTLIER -57.0 140.38 49.16 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.942 0.401 . . . . 10.0 110.452 179.472 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.456 ' HD2' ' OD1' ' A' ' 408' ' ' ASP . 16.9 mmt85 -88.98 164.15 15.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.696 -178.143 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.9 t30 64.84 -88.4 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.167 -0.924 . . . . 10.0 112.652 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -55.52 -60.07 3.94 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.825 0.676 . . . . 10.0 112.825 -177.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.428 ' HD2' ' H ' ' A' ' 12' ' ' SER . 11.7 ttt85 -63.56 -38.13 89.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.668 -0.242 . . . . 10.0 111.437 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -57.85 -51.54 69.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.739 0.304 . . . . 10.0 110.982 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.4 mt -64.72 -35.38 80.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.203 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.7 ttp-105 -66.87 -44.42 80.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.807 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -39.47 90.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.149 0.499 . . . . 10.0 110.133 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.465 ' O ' HG23 ' A' ' 25' ' ' VAL . 55.4 mtt -71.84 -28.28 63.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.644 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -29.96 69.09 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.366 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -71.07 -39.92 71.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.714 -0.675 . . . . 10.0 109.584 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.1 t -65.84 -38.44 82.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.62 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.647 HG13 HD12 ' A' ' 88' ' ' LEU . 98.7 t -58.79 -37.42 66.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.233 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -63.4 -41.34 98.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.431 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.1 mt -62.32 -44.65 99.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.079 0.466 . . . . 10.0 109.885 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' A' ' 65' ' ' PRO . 48.8 mt -62.66 -44.57 99.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.341 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -63.35 -38.77 92.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.787 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.483 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -75.01 -26.06 59.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.477 -0.328 . . . . 10.0 111.531 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 15.9 ttt -84.25 -12.55 54.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.066 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.504 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 7.1 tt0 -57.2 -51.96 77.74 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 116.371 -0.377 . . . . 10.0 111.34 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.504 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 61.1 Cg_exo -54.11 -30.64 61.34 Favored 'Trans proline' 0 C--N 1.363 1.296 0 C-N-CA 122.207 1.938 . . . . 10.0 112.429 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -70.13 -44.24 69.33 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 23.3 mmt -66.92 -31.07 71.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.749 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -63.06 -20.36 65.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.902 0.382 . . . . 10.0 111.0 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.6 mtmt -96.42 1.55 51.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.566 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 mp -100.14 148.85 24.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.095 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.4 p -81.66 166.81 19.82 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -58.58 -38.74 78.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.965 0.412 . . . . 10.0 110.999 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -68.89 -33.14 73.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.977 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -68.55 -35.65 77.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.836 0.35 . . . . 10.0 110.144 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.3 mt -66.58 -46.97 74.24 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -60.64 -33.75 73.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.338 -0.846 . . . . 10.0 110.305 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.64 -33.25 86.72 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 115.538 -0.755 . . . . 10.0 111.873 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -69.09 -36.87 78.06 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.5 m -60.07 -46.25 90.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.946 0.403 . . . . 10.0 110.221 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.37 -34.93 79.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.932 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -62.26 -45.04 95.09 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.995 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -60.36 -42.57 96.03 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.102 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -58.35 -38.23 76.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.872 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.89 -40.38 32.52 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.967 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -60.51 -40.49 91.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.571 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 32.2 mt -63.94 -20.9 66.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.707 0.289 . . . . 10.0 111.62 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -106.34 9.85 31.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.07 0.462 . . . . 10.0 110.857 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -117.52 -50.29 2.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.365 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 168.57 64.51 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.602 -0.809 . . . . 10.0 112.309 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -144.35 149.42 36.12 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.42 ' HB ' ' HB2' ' A' ' 62' ' ' ASN . 4.7 t -97.3 142.53 14.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.52 -179.372 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 39.1 tp -61.3 -47.14 87.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.945 0.403 . . . . 10.0 111.238 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -73.82 1.35 10.74 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.265 -0.425 . . . . 10.0 111.45 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.42 ' HB2' ' HB ' ' A' ' 59' ' ' VAL . 65.6 t30 -105.54 -11.05 16.54 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.311 0.577 . . . . 10.0 109.839 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.6 mt -93.56 -4.64 50.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.798 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.454 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 73.9 mt -49.58 -56.64 15.53 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 115.806 -0.634 . . . . 10.0 112.62 -179.285 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 64' ' ' ILE . 11.3 Cg_endo -54.32 -47.28 27.78 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.34 2.027 . . . . 10.0 113.474 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -71.44 -42.96 67.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.84 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.422 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -65.64 -48.25 72.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.898 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -63.72 -31.55 72.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.512 -0.313 . . . . 10.0 111.11 -179.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.45 -44.73 93.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.832 0.348 . . . . 10.0 110.288 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 81.9 t -62.82 -43.93 99.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.442 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 67' ' ' ALA . 40.4 t -64.06 -44.34 97.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.835 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.497 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 1.1 ttm180 -59.01 -39.73 82.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.843 0.354 . . . . 10.0 110.212 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.8 tp10 -68.45 -49.81 57.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.664 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.28 -30.75 69.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.654 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.6 m -57.79 -40.6 80.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.505 -0.316 . . . . 10.0 111.392 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.0 mtmt -77.65 -17.86 57.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.699 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -95.65 -29.92 14.05 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.938 0.348 . . . . 10.0 111.938 -178.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 64.9 t -94.31 -55.51 6.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.618 0.246 . . . . 10.0 111.458 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -90.95 -40.84 11.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.88 0.371 . . . . 10.0 111.039 -179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.45 9.94 34.71 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.681 -0.771 . . . . 10.0 111.94 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.1 mtt -122.83 151.72 41.41 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.459 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 11.7 ttp180 -98.79 138.48 35.88 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.979 0.418 . . . . 10.0 111.192 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.02 110.89 4.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.584 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -56.9 156.88 6.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.299 0.571 . . . . 10.0 112.003 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.38 -38.17 79.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.229 -0.896 . . . . 10.0 111.182 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.77 -31.64 51.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.839 0.352 . . . . 10.0 111.082 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -67.08 -34.04 76.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.647 HD12 HG13 ' A' ' 25' ' ' VAL . 80.9 mt -65.82 -36.16 82.69 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.415 ' O ' HG23 ' A' ' 93' ' ' VAL . 62.6 mt -66.46 -49.62 66.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.705 178.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.449 ' O ' ' HG ' ' A' ' 94' ' ' LEU . . . -60.12 -43.85 97.91 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.842 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.26 -32.75 85.22 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.03 -0.605 . . . . 10.0 112.096 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 8.7 ttm -69.2 -42.11 76.21 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.901 -0.407 . . . . 10.0 109.901 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 89' ' ' LEU . 85.2 t -65.9 -36.42 77.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.656 -0.702 . . . . 10.0 110.071 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 90' ' ' GLY . 79.9 mt -68.14 -8.83 41.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.734 -0.666 . . . . 10.0 111.993 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -81.36 -20.68 40.09 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.499 0.666 . . . . 10.0 109.236 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -102.18 174.56 5.87 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.315 -0.857 . . . . 10.0 110.236 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -83.63 67.88 9.62 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.308 0.575 . . . . 10.0 109.564 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 16.4 m -141.01 161.77 37.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.4 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.651 HD11 HD13 ' A' ' 407' ' ' LEU . 44.0 mm -103.17 131.0 52.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.734 179.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -110.06 122.97 48.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.891 0.377 . . . . 10.0 111.793 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.62 ' CD ' ' HA ' ' A' ' 393' ' ' THR . 42.5 tt0 -94.72 130.08 41.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.134 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 41.6 mtm -145.34 176.94 9.19 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.707 0.289 . . . . 10.0 110.78 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.496 ' HB2' ' HG2' ' A' ' 106' ' ' GLU . 16.9 mmm180 -105.76 175.77 5.39 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.808 -0.442 . . . . 10.0 109.808 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 18.9 p -77.2 -36.65 54.69 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.757 0.313 . . . . 10.0 111.821 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -72.55 -9.4 73.81 Favored Glycine 0 N--CA 1.453 -0.23 0 CA-C-N 116.08 -0.509 . . . . 10.0 113.888 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.496 ' HG2' ' HB2' ' A' ' 103' ' ' ARG . 3.2 mm-40 -90.86 -1.29 57.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.226 0.513 . . . . 10.0 110.6 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.94 62.16 4.44 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.381 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -52.94 -45.54 67.74 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 111.884 0.327 . . . . 10.0 111.884 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -33.97 76.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.707 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 25.5 tp -70.46 -28.98 65.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.936 0.398 . . . . 10.0 110.494 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 64.8 m -70.81 -30.24 66.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.327 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.17 -15.94 63.56 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.3 0.852 . . . . 10.0 113.3 -178.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 41.1 p -72.41 -25.4 61.47 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.403 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 31.1 mt -68.18 -57.26 9.37 Favored Pre-proline 0 CA--C 1.537 0.478 0 N-CA-C 112.411 0.523 . . . . 10.0 112.411 -178.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.403 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 30.1 Cg_endo -62.38 -31.42 81.27 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 121.994 1.796 . . . . 10.0 111.85 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.67 -49.48 68.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.431 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.471 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 59.1 t80 -62.5 -45.74 91.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.961 0.41 . . . . 10.0 110.66 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 62.8 tp -59.77 -49.36 78.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.668 -0.697 . . . . 10.0 111.616 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -72.41 -26.43 61.86 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.433 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -66.13 -26.08 67.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.7 0.286 . . . . 10.0 111.137 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 60.7 mt -60.71 -21.25 62.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.75 -179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.7 p -79.92 -17.31 53.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.704 0.288 . . . . 10.0 111.027 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.53 6.83 59.59 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.099 -0.572 . . . . 10.0 112.802 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.92 -24.08 44.31 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.857 -0.202 . . . . 10.0 111.326 -179.102 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 109.21 123.85 4.81 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.342 -0.932 . . . . 10.0 113.546 179.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 68.9 t -102.15 119.05 49.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -99.73 107.13 19.13 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.894 0.378 . . . . 10.0 110.806 -179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 64.0 t -96.27 122.03 47.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.242 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 26.5 t -102.02 110.0 27.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.527 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.52 162.31 13.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.528 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.429 ' HA ' HD11 ' A' ' 214' ' ' ILE . 4.4 m -67.23 -40.42 84.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 111.876 0.324 . . . . 10.0 111.876 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -145.41 161.07 40.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.359 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -64.68 -24.61 67.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.892 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -59.18 -55.85 29.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.474 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 89.8 mt -73.68 -31.49 63.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.512 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.85 -52.0 67.28 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.696 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -33.8 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.417 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -59.17 -57.15 14.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.488 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.32 -29.65 67.53 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.518 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.533 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -60.24 -41.64 93.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.811 0.339 . . . . 10.0 110.69 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -89.16 -25.33 21.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.337 -0.392 . . . . 10.0 111.329 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -75.56 -43.28 49.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.79 0.329 . . . . 10.0 111.466 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.7 m-20 -90.35 -1.92 57.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.936 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.533 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 59.2 ttm-85 -60.44 -48.83 92.68 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 116.102 -0.499 . . . . 10.0 112.084 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' PRO . . . . . 0.59 ' O ' ' HB2' ' A' ' 149' ' ' PHE . 34.1 Cg_exo -61.86 -12.69 26.82 Favored 'Trans proline' 0 C--N 1.359 1.092 0 C-N-CA 122.083 1.855 . . . . 10.0 112.946 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.3 tp -88.52 -53.96 4.41 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.982 0.42 . . . . 10.0 110.322 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -70.89 -42.79 69.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.868 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.43 -10.13 59.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.803 0.335 . . . . 10.0 111.54 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.59 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 19.1 t80 -83.97 -26.01 29.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.365 0.603 . . . . 10.0 109.714 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 37.4 mt -95.47 -8.19 36.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.434 -0.803 . . . . 10.0 110.805 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 106.28 15.31 18.02 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.619 -0.8 . . . . 10.0 113.634 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 90.0 mt -101.84 136.76 41.12 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.15 0.475 . . . . 10.0 109.903 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.8 p -90.6 130.18 36.66 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.062 0.458 . . . . 10.0 111.298 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.447 HG21 ' HA ' ' A' ' 144' ' ' ARG . 61.4 t -102.46 120.06 51.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.379 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -111.54 139.63 15.68 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.746 -0.74 . . . . 10.0 111.701 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.2 tp -117.28 130.21 72.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.833 0.349 . . . . 10.0 110.125 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -115.26 129.75 56.72 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.11 -0.495 . . . . 10.0 109.913 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 66.0 mt -121.61 147.8 48.83 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.362 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' PRO . . . . . 0.526 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 17.9 Cg_endo -59.92 102.11 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.212 2.608 . . . . 10.0 112.658 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 110.72 4.03 28.33 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.695 -0.764 . . . . 10.0 112.611 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' MET . . . . . 0.481 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 48.1 ttm -64.33 138.97 97.6 Favored Pre-proline 0 C--N 1.327 -0.394 0 C-N-CA 122.254 0.222 . . . . 10.0 110.696 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -52.06 144.32 37.75 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.801 2.334 . . . . 10.0 112.601 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' ALA . . . . . 0.454 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.77 -48.34 93.79 Favored Pre-proline 0 CA--C 1.54 0.586 0 N-CA-C 113.054 0.761 . . . . 10.0 113.054 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.8 Cg_exo -55.51 -41.57 76.58 Favored 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 121.935 1.757 . . . . 10.0 112.39 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -69.16 -39.89 78.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.642 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.481 ' HE2' ' O ' ' A' ' 161' ' ' MET . 58.7 mttm -58.78 -45.12 90.56 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.33 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -59.94 -29.26 68.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.625 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -78.8 -43.63 24.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.919 0.39 . . . . 10.0 110.288 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.7 -38.47 91.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.377 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -78.11 -26.63 48.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.307 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.22 -11.29 59.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.178 0.513 . . . . 10.0 110.424 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -70.84 177.94 3.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.591 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' ASP . . . . . 0.433 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 19.1 m-20 -76.18 -46.31 29.08 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.597 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 49.2 mt -127.49 125.95 66.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.207 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.9 m -111.46 126.87 55.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.408 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -103.33 137.17 41.82 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -179.19 177.19 48.31 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.368 -0.92 . . . . 10.0 112.727 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -93.7 158.86 15.47 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.713 0.292 . . . . 10.0 110.835 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -68.37 -32.65 72.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.816 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -59.68 -53.93 52.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.123 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.526 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.9 tp10 -68.13 -35.6 78.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.768 0.318 . . . . 10.0 110.661 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -54.85 -42.93 72.59 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.286 -0.416 . . . . 10.0 111.005 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -72.84 -41.0 50.95 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.844 -0.694 . . . . 10.0 112.147 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -64.94 -37.39 87.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 10.0 110.464 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 185' ' ' ASP . . . . . 0.457 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 15.1 m-20 -62.3 -41.76 98.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.021 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -62.13 -41.84 98.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.666 -0.697 . . . . 10.0 110.051 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 187' ' ' LEU . . . . . 0.469 ' O ' ' HB2' ' A' ' 191' ' ' MET . 67.8 mt -62.35 -45.19 94.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.828 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 58.3 mtm-85 -67.91 -38.94 83.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.888 0.375 . . . . 10.0 110.885 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -62.82 -50.95 68.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.76 -0.655 . . . . 10.0 111.618 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.22 1.66 20.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.569 0.581 . . . . 10.0 112.569 -178.262 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 191' ' ' MET . . . . . 0.469 ' HB2' ' O ' ' A' ' 187' ' ' LEU . 23.1 ttp -106.52 2.84 26.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.048 0.451 . . . . 10.0 110.568 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 197' ' ' GLU . . . -73.3 167.67 20.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.199 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -105.56 -29.77 9.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.126 0.488 . . . . 10.0 110.004 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.12 144.88 35.7 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.813 179.091 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.77 -24.87 74.66 Favored 'Trans proline' 0 CA--C 1.527 0.163 0 C-N-CA 122.364 2.042 . . . . 10.0 112.629 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 45.1 mp0 -75.29 -10.44 59.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.361 -0.381 . . . . 10.0 111.384 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.465 ' HB2' ' HB1' ' A' ' 192' ' ' ALA . 46.1 mt-10 -89.03 -3.27 58.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.778 0.323 . . . . 10.0 110.544 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 198' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 198' ' ' ARG . 30.5 mtt85 -61.42 158.67 14.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.569 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 4.8 m -136.32 -18.41 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.756 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -88.81 177.87 6.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.15 0.5 . . . . 10.0 111.085 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -137.44 176.6 8.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.462 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.7 tmtm? -60.01 126.95 29.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.277 0.56 . . . . 10.0 111.143 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 203' ' ' LEU . . . . . 0.411 HD22 ' CZ ' ' A' ' 384' ' ' TYR . 14.2 mt -80.47 91.08 5.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.528 -0.76 . . . . 10.0 109.691 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 78.7 t60 -99.91 -63.28 1.14 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.295 -0.412 . . . . 10.0 111.082 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -128.54 138.06 52.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.139 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.497 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -133.37 129.55 37.58 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.476 -0.783 . . . . 10.0 109.659 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 45.7 tp -119.53 110.53 17.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.167 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 2.4 p -92.43 126.22 44.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.521 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -58.26 -65.58 0.62 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.617 -0.72 . . . . 10.0 111.269 -179.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 210' ' ' GLU . . . . . 0.474 ' CD ' HH21 ' A' ' 509' ' ' ARG . 0.5 OUTLIER -112.64 113.91 26.28 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.923 0.392 . . . . 10.0 110.745 -179.83 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.649 HG11 HD12 ' A' ' 99' ' ' ILE . 27.6 m -76.56 -14.13 14.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.041 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 212' ' ' ASP . . . . . 0.535 ' OD2' ' HD3' ' A' ' 566' ' ' ARG . 1.1 m-20 -45.91 -78.17 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 124.061 0.851 . . . . 10.0 112.247 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.34 -47.09 9.68 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.455 -0.793 . . . . 10.0 112.17 -178.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 214' ' ' ILE . . . . . 0.433 ' HA ' ' HG3' ' A' ' 218' ' ' GLU . 53.2 mt -53.25 -31.89 18.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 N-CA-C 113.876 1.065 . . . . 10.0 113.876 -177.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 215' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 215' ' ' LEU . 10.6 mt -106.26 -58.46 1.92 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 39.1 mm -68.22 -54.46 21.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 113.207 0.817 . . . . 10.0 113.207 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -73.27 -45.04 58.11 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.798 0.666 . . . . 10.0 112.798 -177.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 218' ' ' GLU . . . . . 0.433 ' HG3' ' HA ' ' A' ' 214' ' ' ILE . 5.2 mm-40 -73.45 1.7 9.25 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.36 0.504 . . . . 10.0 112.36 -178.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.47 -25.37 68.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.689 0.281 . . . . 10.0 111.73 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 220' ' ' ARG . . . . . 0.478 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -114.31 19.38 16.33 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.069 -0.253 . . . . 10.0 111.306 -179.241 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 5.6 m -97.45 106.28 31.48 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 120.951 -0.3 . . . . 10.0 110.605 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 222' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 81.7 Cg_endo -92.84 131.46 0.93 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.925 2.417 . . . . 10.0 113.202 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 223' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 374' ' ' SER . 47.6 mt -85.56 124.02 31.64 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.536 HG23 HG23 ' A' ' 371' ' ' THR . 83.3 mt -117.68 130.67 72.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.787 0.327 . . . . 10.0 111.663 -178.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 20.8 pt -105.11 138.01 31.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 178.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 3.9 m -80.04 157.95 26.62 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.323 0.49 . . . . 10.0 112.323 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -170.98 110.03 0.34 Allowed Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 110.888 -0.885 . . . . 10.0 110.888 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 228' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' A' ' 229' ' ' ALA . 65.6 Cg_endo -94.22 106.29 0.14 Allowed 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.066 2.511 . . . . 10.0 114.803 -178.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 229' ' ' ALA . . . . . 0.577 ' HB3' ' HG2' ' B' ' 22' ' ' MET . . . 162.06 69.08 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.886 1.274 . . . . 10.0 108.459 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.76 174.53 7.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.266 -0.879 . . . . 10.0 112.989 -176.268 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 231' ' ' ASP . . . . . 0.48 ' HA ' ' HB1' ' B' ' 18' ' ' ALA . 0.6 OUTLIER -76.6 -26.77 55.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.913 -1.039 . . . . 10.0 111.175 -179.274 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.456 ' HB2' ' HG2' ' A' ' 355' ' ' GLN . 0.6 OUTLIER -55.15 -37.22 66.69 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.745 -178.789 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 49.7 m -57.55 -25.71 60.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.783 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -108.38 -49.17 3.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.055 0.455 . . . . 10.0 111.344 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 48.7 tpp -57.22 -44.6 83.87 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.114 0.783 . . . . 10.0 113.114 -177.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 236' ' ' TYR . . . . . 0.481 ' HB3' ' CB ' ' A' ' 359' ' ' ALA . 26.7 m-85 -69.37 -17.3 63.67 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -67.81 -26.95 66.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.836 0.35 . . . . 10.0 110.617 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -106.39 -35.91 6.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.664 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 55.6 t -64.86 -45.51 94.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 111.902 0.334 . . . . 10.0 111.902 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -71.84 -5.56 35.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.85 0.357 . . . . 10.0 111.826 -178.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -97.83 -5.67 34.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.741 0.305 . . . . 10.0 110.894 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 49.5 mm -98.42 -31.89 3.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.287 0.565 . . . . 10.0 110.368 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 243' ' ' ILE . . . . . 0.49 ' N ' ' HD2' ' A' ' 244' ' ' PRO . 55.6 mt -54.28 -47.95 95.96 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-N 115.486 -0.779 . . . . 10.0 112.872 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 244' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 243' ' ' ILE . 39.0 Cg_endo -67.22 13.07 0.16 Allowed 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.159 1.906 . . . . 10.0 113.571 179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 245' ' ' HIS . . . . . 0.404 ' H ' ' C ' ' A' ' 243' ' ' ILE . 10.6 t-80 -114.44 8.42 16.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.226 0.536 . . . . 10.0 110.11 179.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 40.6 mt -89.57 170.47 10.46 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.766 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 72.7 mt -91.93 126.66 44.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.448 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -73.24 71.21 1.19 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.574 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 179.17 -40.41 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.79 -0.641 . . . . 10.0 109.86 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -154.95 159.98 40.8 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.143 -178.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt 76.24 87.89 0.08 Allowed 'General case' 0 N--CA 1.465 0.28 0 O-C-N 124.106 0.879 . . . . 10.0 112.068 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 252' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 55.39 12.23 0.7 Allowed 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 115.018 1.488 . . . . 10.0 115.018 177.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -80.58 -43.48 20.53 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.735 -0.603 . . . . 10.0 109.613 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -99.78 163.36 12.5 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.267 -0.879 . . . . 10.0 109.629 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 255' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 255' ' ' GLU . 0.0 OUTLIER -85.66 -24.75 26.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.004 0.431 . . . . 10.0 110.67 -179.66 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 17.9 m -149.86 -74.26 0.17 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.418 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 12.7 t80 66.23 -71.04 0.09 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.313 0.645 . . . . 10.0 111.687 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 258' ' ' GLN . . . . . 0.439 ' OE1' ' HG3' ' A' ' 277' ' ' ARG . 12.2 tp60 62.61 -178.62 0.14 Allowed 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.136 0.574 . . . . 10.0 110.886 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -84.65 49.29 4.21 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.682 -0.771 . . . . 10.0 111.727 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -141.29 -64.49 0.44 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.745 0.307 . . . . 10.0 110.791 -179.186 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 79.3 -156.79 41.86 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.671 -0.776 . . . . 10.0 111.951 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.65 -162.18 0.85 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -52.14 143.36 14.45 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.389 0.431 . . . . 10.0 111.57 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.07 50.18 0.87 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 10.0 112.076 -178.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 17.1 t -123.45 -41.12 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.312 0.577 . . . . 10.0 109.769 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 266' ' ' ASP . . . . . 0.561 ' OD1' ' HG2' ' A' ' 268' ' ' LYS . 27.3 t0 -134.34 144.24 48.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.25 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -111.67 0.13 16.23 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.594 0.22 . . . . 10.0 111.594 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 268' ' ' LYS . . . . . 0.638 ' HD3' ' O ' ' A' ' 318' ' ' ALA . 5.1 ptpp? -108.07 144.8 34.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.357 0.599 . . . . 10.0 111.459 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 6.2 m -91.63 77.17 5.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.542 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 270' ' ' ARG . . . . . 0.519 ' HA ' HD13 ' A' ' 319' ' ' LEU . 11.6 ttt85 -71.31 9.33 0.8 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.707 -178.053 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -92.62 -5.58 51.22 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 122.061 -0.4 . . . . 10.0 110.427 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 59.9 t 74.36 129.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.133 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -166.15 -73.1 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.203 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 9.1 mp 61.68 81.23 0.2 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.688 0.617 . . . . 10.0 111.844 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 29.0 m -138.52 119.48 14.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.618 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -74.47 135.45 42.28 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.719 -0.475 . . . . 10.0 109.719 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 277' ' ' ARG . . . . . 0.439 ' HG3' ' OE1' ' A' ' 258' ' ' GLN . 3.7 ptp180 -160.91 27.64 0.14 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.172 0.511 . . . . 10.0 110.508 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.404 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . -114.05 -44.39 0.74 Allowed Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.978 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 278' ' ' GLY . 4.2 mm? 71.54 -52.71 0.69 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.577 0.751 . . . . 10.0 111.589 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 15.0 p -62.23 -22.23 28.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.943 0.402 . . . . 10.0 111.157 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 22.2 mt -72.91 -65.2 0.83 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.868 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 34.4 pt -58.1 -19.59 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.59 -179.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.72 -21.11 64.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.798 0.332 . . . . 10.0 110.791 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.79 -3.12 19.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.169 0.509 . . . . 10.0 110.341 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.7 -34.25 62.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.441 -0.948 . . . . 10.0 108.441 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 6.8 mt -92.16 -156.2 0.45 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.933 -1.031 . . . . 10.0 109.967 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 287' ' ' VAL . . . . . . . . . . . . . 3.4 t 57.99 42.63 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.581 0.705 . . . . 10.0 110.922 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.95 178.16 4.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.495 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 69.18 -162.05 0.18 Allowed 'General case' 0 C--O 1.235 0.308 0 O-C-N 123.579 0.55 . . . . 10.0 110.632 -179.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -129.21 34.32 2.84 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.56 -0.829 . . . . 10.0 112.588 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 291' ' ' ILE . . . . . 0.486 HD12 ' HB3' ' B' ' 14' ' ' ALA . 4.1 tt -166.56 127.72 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.785 -0.45 . . . . 10.0 109.785 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 8.9 tpt 64.37 29.76 13.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.598 0.713 . . . . 10.0 109.92 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -94.35 1.3 55.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.305 -0.861 . . . . 10.0 111.603 -179.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -75.41 -176.8 3.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.31 -0.405 . . . . 10.0 111.055 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -75.85 70.78 1.98 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 121.022 -0.609 . . . . 10.0 112.462 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -124.21 177.65 5.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.825 0.345 . . . . 10.0 110.699 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 6.4 m -129.02 171.46 12.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.976 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 6.8 tp -87.6 5.59 38.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.197 0.523 . . . . 10.0 110.064 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -104.78 -5.63 21.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.278 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 13.4 m -62.35 124.05 81.01 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.043 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -76.86 4.26 5.85 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.927 2.418 . . . . 10.0 112.432 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -65.13 -36.59 84.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.866 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -153.36 108.51 3.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.674 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 5.1 mp -93.15 -11.2 9.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.4 0.619 . . . . 10.0 110.156 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 305' ' ' MET . . . . . 0.499 ' HG3' ' HG2' ' A' ' 777' ' ' GLU . 71.5 mmm -60.22 -52.86 63.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.192 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 6.1 mp -60.11 -38.96 84.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.524 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 22.3 ttt -60.83 -47.83 84.58 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.618 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -74.84 -25.22 58.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.845 0.355 . . . . 10.0 110.766 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -71.5 -44.42 64.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.516 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 27.5 m -69.74 -37.8 74.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 121.035 -0.266 . . . . 10.0 111.571 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -67.84 -36.94 81.24 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.126 0.489 . . . . 10.0 110.437 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 312' ' ' ALA . . . . . . . . . . . . . . . -66.71 -30.86 71.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.195 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -76.93 -32.78 57.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.208 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.12 -42.53 72.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.542 . . . . 10.0 110.733 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 315' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -67.51 -17.12 64.55 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 120.984 0.421 . . . . 10.0 110.631 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -88.61 10.53 20.2 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.287 0.565 . . . . 10.0 110.235 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 23.9 m80 -118.62 -42.13 2.77 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.832 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.638 ' O ' ' HD3' ' A' ' 268' ' ' LYS . . . -107.74 -50.72 3.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.198 -0.456 . . . . 10.0 112.055 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 319' ' ' LEU . . . . . 0.519 HD13 ' HA ' ' A' ' 270' ' ' ARG . 2.0 mm? -60.17 -55.93 27.78 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.698 0.259 . . . . 10.0 111.698 -179.003 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -102.97 132.49 49.18 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.086 0.469 . . . . 10.0 110.243 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -114.89 136.28 53.28 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.827 -178.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 322' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 322' ' ' ARG . 8.5 ptm180 -66.96 159.51 28.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.989 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 323' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 77.55 -25.24 0.2 Allowed 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.846 0.858 . . . . 10.0 112.387 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 14.2 p -113.96 -40.14 3.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.618 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -93.9 -22.3 18.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.154 0.502 . . . . 10.0 110.927 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -163.1 159.13 22.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.109 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 10.5 tp -140.09 139.1 37.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.011 0.434 . . . . 10.0 109.94 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 43.0 t -102.5 104.29 16.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.312 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -96.96 87.58 4.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.57 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 2.8 t70 53.15 56.48 7.43 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.476 -0.783 . . . . 10.0 111.615 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 93.56 -29.91 7.92 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.709 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -79.59 101.37 8.27 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.83 0.348 . . . . 10.0 111.37 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 23.2 t -79.29 111.73 16.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.201 -0.454 . . . . 10.0 109.848 178.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 84.0 mt -113.42 136.53 49.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.891 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 335' ' ' ILE . . . . . 0.464 ' HB ' ' HB2' ' A' ' 344' ' ' MET . 74.1 mt -82.07 135.05 25.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.254 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 58.6 t -106.93 113.56 43.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.033 0.444 . . . . 10.0 110.115 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.48 128.56 36.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.633 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -84.73 -4.89 59.25 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.039 -0.528 . . . . 10.0 112.179 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -84.94 -55.79 3.89 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.099 -0.376 . . . . 10.0 111.528 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -120.35 -25.15 5.7 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.081 0.401 . . . . 10.0 112.081 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 106.98 29.04 4.75 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.035 -0.826 . . . . 10.0 111.035 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.2 tpp180 -74.83 125.86 29.7 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.865 0.364 . . . . 10.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.56 102.07 13.8 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.942 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 344' ' ' MET . . . . . 0.464 ' HB2' ' HB ' ' A' ' 335' ' ' ILE . 64.1 mtt -86.73 93.46 9.25 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -86.73 -25.06 24.91 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.684 -178.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -95.96 17.81 58.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.458 -0.877 . . . . 10.0 113.137 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 19.8 mmt85 -141.77 145.56 34.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.85 0.325 . . . . 10.0 110.533 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -144.13 144.37 31.55 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.259 -0.428 . . . . 10.0 109.998 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 349' ' ' TRP . . . . . 0.444 ' HB3' HD23 ' A' ' 353' ' ' LEU . 61.9 m95 -50.61 126.22 14.95 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.724 1.009 . . . . 10.0 113.724 -177.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.88 -163.18 0.99 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.287 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 14.5 t70 63.81 17.51 10.55 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.377 0.608 . . . . 10.0 111.442 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 352' ' ' GLY . . . . . 0.402 ' HA2' ' OE1' ' A' ' 355' ' ' GLN . . . 82.43 23.11 57.37 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.772 -0.728 . . . . 10.0 112.67 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.444 HD23 ' HB3' ' A' ' 349' ' ' TRP . 34.0 tp -91.0 -40.95 11.37 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.067 0.395 . . . . 10.0 112.067 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 354' ' ' HIS . . . . . 0.426 ' HB3' ' O ' ' A' ' 349' ' ' TRP . 14.5 p80 -62.82 -28.9 70.33 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 122.0 -0.437 . . . . 10.0 110.682 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 355' ' ' GLN . . . . . 0.456 ' HG2' ' HB2' ' A' ' 232' ' ' SER . 18.7 mp0 -68.46 -30.91 69.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.238 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -72.3 -27.98 62.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.203 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 77.0 t -80.77 -46.95 20.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.084 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -67.52 -11.4 57.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.347 -0.842 . . . . 10.0 111.941 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 359' ' ' ALA . . . . . 0.481 ' CB ' ' HB3' ' A' ' 236' ' ' TYR . . . -109.53 -4.01 16.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.775 0.322 . . . . 10.0 111.272 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp -95.38 -54.58 3.35 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.954 0.407 . . . . 10.0 110.169 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -73.33 177.58 5.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.622 -0.717 . . . . 10.0 109.911 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -78.4 57.1 4.11 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 120.724 -0.75 . . . . 10.0 112.941 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 11.0 m -138.54 -172.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 110.181 -0.303 . . . . 10.0 110.181 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 364' ' ' GLN . . . . . 0.463 ' HG2' ' N ' ' A' ' 365' ' ' ILE . 4.7 tt0 -125.05 150.08 47.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.473 -0.33 . . . . 10.0 110.469 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 365' ' ' ILE . . . . . 0.5 ' H ' HD12 ' A' ' 365' ' ' ILE . 4.2 mp -63.89 144.21 14.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.28 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 37.0 mm-40 -71.24 -171.0 0.54 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.621 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 367' ' ' ASN . . . . . 0.419 ' ND2' ' HB2' ' A' ' 228' ' ' PRO . 0.2 OUTLIER -72.41 -24.6 61.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 10.0 112.036 -179.021 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 65.31 -161.44 0.27 Allowed 'General case' 0 C--O 1.239 0.521 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 43.2 t30 174.78 119.9 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.607 0.763 . . . . 10.0 109.866 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -129.0 178.74 6.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.239 0.543 . . . . 10.0 111.424 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 371' ' ' THR . . . . . 0.536 HG23 HG23 ' A' ' 224' ' ' ILE . 56.1 m -85.97 102.23 13.59 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.405 -0.816 . . . . 10.0 110.402 179.324 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 53.2 mt -65.79 -46.22 79.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.243 0.544 . . . . 10.0 110.365 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -153.4 154.24 34.09 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.732 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 374' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 4.2 t -153.33 152.92 31.66 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.763 0.316 . . . . 10.0 110.519 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 14.4 tt -156.9 140.51 7.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.47 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.91 147.77 22.56 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.424 178.668 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -59.44 -37.97 79.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.478 0.18 . . . . 10.0 111.301 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 378' ' ' GLN . . . . . 0.486 HE21 HG23 ' A' ' 404' ' ' ILE . 1.5 tm0? -59.84 -39.04 83.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.305 0.574 . . . . 10.0 110.12 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -82.96 -2.49 55.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.344 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -101.12 -46.13 5.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.278 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -70.31 -20.66 62.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.169 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 42.8 mtp180 -76.54 -9.05 58.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.805 0.336 . . . . 10.0 111.031 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 80.3 mt -83.25 -19.56 36.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.016 0.436 . . . . 10.0 110.001 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.497 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 49.1 m-85 -77.39 141.45 39.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.304 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -71.17 -67.61 0.5 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.154 0.502 . . . . 10.0 110.235 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -100.75 102.32 13.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.169 0.509 . . . . 10.0 110.039 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 50.1 tp -111.05 115.72 29.93 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.879 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -121.3 158.21 28.68 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.104 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -154.52 158.28 28.13 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.198 -1.001 . . . . 10.0 112.61 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 39.6 mtm -115.47 154.79 28.66 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 391' ' ' THR . . . . . 0.465 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 14.7 t -149.94 159.52 44.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.533 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -88.49 157.83 28.13 Favored Glycine 0 N--CA 1.441 -1.016 0 N-CA-C 109.99 -1.244 . . . . 10.0 109.99 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 393' ' ' THR . . . . . 0.62 ' HA ' ' CD ' ' A' ' 101' ' ' GLU . 9.5 m -56.69 99.99 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.11 0.455 . . . . 10.0 111.218 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 394' ' ' ALA . . . . . 0.519 ' HA ' HD22 ' A' ' 569' ' ' ASN . . . -160.11 -27.96 0.06 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.816 -0.629 . . . . 10.0 112.037 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 6.7 t70 59.26 -95.27 0.05 Allowed 'General case' 0 N--CA 1.474 0.729 0 O-C-N 123.326 0.391 . . . . 10.0 110.499 -179.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 5.7 m 55.97 -105.6 0.28 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.045 0.757 . . . . 10.0 113.045 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -84.24 25.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.118 0.414 . . . . 10.0 112.118 -177.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 398' ' ' ALA . . . . . 0.523 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -67.69 -31.02 70.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.9 0.381 . . . . 10.0 110.858 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -65.99 -18.61 65.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.587 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -83.41 -19.67 35.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.682 -0.235 . . . . 10.0 111.235 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 401' ' ' PHE . . . . . 0.523 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 17.5 m-85 -60.56 -42.02 95.74 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.909 0.337 . . . . 10.0 111.909 -179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 6.8 m -70.39 -19.87 62.98 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.423 0.527 . . . . 10.0 112.423 -178.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 26.7 m -98.82 -43.68 6.67 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.998 0.37 . . . . 10.0 111.998 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 404' ' ' ILE . . . . . 0.486 HG23 HE21 ' A' ' 378' ' ' GLN . 60.4 mt -77.87 -62.01 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 112.843 0.683 . . . . 10.0 112.843 -178.083 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 405' ' ' TYR . . . . . 0.434 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 81.9 m-85 -97.36 -2.7 41.83 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -177.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt 62.73 48.1 4.37 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.161 0.505 . . . . 10.0 110.427 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 407' ' ' LEU . . . . . 0.651 HD13 HD11 ' A' ' 99' ' ' ILE . 16.2 mt -113.2 142.08 46.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.028 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 408' ' ' ASP . . . . . 0.456 ' OD1' ' HD2' ' A' ' 13' ' ' ARG . 9.5 t0 -80.79 166.09 21.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.599 0.238 . . . . 10.0 110.602 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 2.0 m -118.42 109.18 15.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.717 0.294 . . . . 10.0 110.953 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 42.1 t -121.6 115.91 47.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.966 0.412 . . . . 10.0 110.918 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 53.3 t -83.99 108.67 16.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.017 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 58.6 t -79.15 130.47 69.28 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.927 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.21 146.46 81.43 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.49 2.127 . . . . 10.0 111.507 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 74.3 p -89.14 149.34 23.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.809 0.337 . . . . 10.0 111.136 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -83.65 -28.16 28.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 178.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -97.87 128.26 34.57 Favored Pre-proline 0 N--CA 1.448 -0.573 0 CA-C-N 114.765 -1.107 . . . . 10.0 109.13 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.36 124.91 12.19 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.62 2.213 . . . . 10.0 113.451 -178.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 48.9 mtm -90.26 82.1 6.03 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.527 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 419' ' ' ILE . . . . . 0.444 HG13 ' HA ' ' A' ' 581' ' ' ALA . 5.9 pt -92.31 42.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.118 -179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 420' ' ' ARG . . . . . 0.558 ' HA ' ' O ' ' A' ' 581' ' ' ALA . 38.5 ttp180 -73.83 137.46 43.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.413 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 583' ' ' SER . 83.0 mttt -93.38 95.65 9.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.248 0.547 . . . . 10.0 110.398 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -80.26 125.33 29.74 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.51 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 89.9 mt -109.43 152.08 42.5 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.259 -0.428 . . . . 10.0 109.951 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.77 160.14 42.1 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.586 2.19 . . . . 10.0 112.895 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -81.72 119.6 24.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.568 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 426' ' ' LEU . 12.6 mt -99.87 102.75 14.25 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.241 0.543 . . . . 10.0 110.661 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 427' ' ' VAL . . . . . 0.534 HG23 HG11 ' A' ' 623' ' ' VAL . 6.0 t -94.65 125.49 47.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.817 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 428' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' A' ' 590' ' ' MET . 2.7 m-85 -104.29 179.86 4.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.636 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 28.4 mmm -73.54 -76.78 0.12 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.682 0.277 . . . . 10.0 111.383 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 64.4 p -88.26 159.75 17.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.971 0.415 . . . . 10.0 111.389 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.79 -31.5 70.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.624 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -61.63 -38.05 86.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.93 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 433' ' ' GLU . . . . . 0.443 ' HG2' ' HG3' ' A' ' 614' ' ' PRO . 31.8 mt-10 -65.58 -39.42 91.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.039 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -59.53 -48.5 81.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.948 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 435' ' ' ILE . . . . . 0.529 ' O ' HG12 ' A' ' 439' ' ' ILE . 41.1 mm -61.81 -43.38 97.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.458 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -56.67 -44.7 81.66 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.709 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.36 -38.91 91.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.732 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 438' ' ' ILE . . . . . 0.441 ' O ' HG13 ' A' ' 442' ' ' ILE . 92.4 mt -62.47 -49.91 81.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.658 179.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 439' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 435' ' ' ILE . 47.9 mm -58.45 -43.25 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.268 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -63.13 -44.81 94.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.717 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 441' ' ' ASP . . . . . 0.612 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 14.1 t70 -63.56 -44.88 92.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.775 0.321 . . . . 10.0 110.326 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.487 HG12 HG11 ' A' ' 452' ' ' VAL . 54.8 mt -59.9 -42.17 88.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.378 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -57.3 -42.8 82.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.5 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -41.71 98.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.408 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.612 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 15.7 mmt180 -68.25 -39.63 82.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.485 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 13.3 m -62.94 -37.15 85.88 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.773 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.12 71.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.035 -0.529 . . . . 10.0 111.363 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 47.7 mttp -85.48 -19.4 31.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.215 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 89.41 33.55 9.29 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.67 -0.776 . . . . 10.0 111.321 -178.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 450' ' ' GLN . . . . . 0.54 ' OE1' ' HD2' ' A' ' 445' ' ' ARG . 60.2 tt0 -105.37 129.58 24.51 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 120.432 0.158 . . . . 10.0 110.836 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.28 141.71 63.66 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.683 2.255 . . . . 10.0 111.462 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.487 HG11 HG12 ' A' ' 442' ' ' ILE . 51.7 t -121.94 128.11 75.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.396 -178.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 57.1 tp -115.07 109.1 17.55 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 18.9 t -95.93 127.93 47.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.358 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -110.26 109.86 2.74 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.887 -0.673 . . . . 10.0 112.391 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 456' ' ' THR . . . . . 0.402 ' HG1' ' HA ' ' A' ' 504' ' ' THR . 15.9 p -105.06 146.84 28.56 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.397 -0.223 . . . . 10.0 110.397 179.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 24.3 pt -94.13 -17.66 7.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.829 0.347 . . . . 10.0 111.294 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 23.2 m -130.75 137.85 49.68 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.339 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 39.4 mt -60.4 -32.24 50.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.091 0.472 . . . . 10.0 110.886 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.67 -33.74 71.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.712 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 -33.8 47.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.512 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.3 m -61.33 -43.74 98.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.545 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -68.62 -36.79 79.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.16 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.48 -53.71 50.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.81 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 10.2 p -65.04 -32.7 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 120.775 0.321 . . . . 10.0 110.322 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 47.0 t -65.0 -43.49 92.37 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.464 -0.569 . . . . 10.0 109.464 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -60.4 -49.38 77.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.661 -0.699 . . . . 10.0 110.294 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' GLU . . . . . 0.51 ' HG3' HG21 ' A' ' 435' ' ' ILE . 10.7 mm-40 -62.16 -38.89 90.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.706 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 24.0 mt -63.16 -38.15 90.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.078 0.466 . . . . 10.0 110.279 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.1 m -72.09 -34.38 68.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.762 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -63.57 -36.91 85.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.437 -0.801 . . . . 10.0 110.004 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -79.45 -30.78 42.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.743 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 97.91 34.31 5.49 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.955 -0.641 . . . . 10.0 112.281 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 70.6 mt -102.71 127.98 55.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.641 0.258 . . . . 10.0 110.849 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -63.63 129.31 39.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.141 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -155.38 153.74 30.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.832 0.349 . . . . 10.0 111.195 -179.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -130.48 132.87 45.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.033 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 478' ' ' VAL . . . . . 0.456 HG22 HD12 ' A' ' 502' ' ' ILE . 19.2 t -100.03 130.0 49.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.356 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 36.6 mt -75.76 94.17 3.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.856 0.36 . . . . 10.0 110.574 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -78.66 108.13 11.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.636 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -65.2 -7.69 13.98 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.888 0.699 . . . . 10.0 112.888 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -88.05 -11.44 47.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.988 0.423 . . . . 10.0 110.254 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -126.66 90.95 3.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.036 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -60.72 -30.67 70.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.3 -179.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.97 -37.25 87.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.069 0.461 . . . . 10.0 109.939 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.66 -38.71 64.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.431 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -52.32 -60.91 2.65 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.692 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -59.63 -36.67 76.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.243 -0.89 . . . . 10.0 111.953 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.41 86.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.876 0.37 . . . . 10.0 111.529 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 83.1 mt -70.91 -45.99 70.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.241 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 71.6 t -58.88 -35.26 55.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 120.836 0.351 . . . . 10.0 111.305 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -59.29 -33.21 70.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.998 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -121.11 24.37 10.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.642 0.258 . . . . 10.0 111.165 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.77 -19.38 62.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.042 0.449 . . . . 10.0 111.198 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -97.88 14.44 62.81 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.858 -0.687 . . . . 10.0 112.023 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -73.4 143.04 82.23 Favored Pre-proline 0 C--N 1.327 -0.407 0 N-CA-C 110.07 -0.345 . . . . 10.0 110.07 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.98 123.8 14.01 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.591 2.194 . . . . 10.0 113.167 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.8 17.65 7.59 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -91.8 113.71 26.05 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.017 0.437 . . . . 10.0 110.315 179.065 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 33.0 t -92.3 112.05 25.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.598 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 12.0 m -108.35 131.62 54.56 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.526 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 502' ' ' ILE . . . . . 0.456 HD12 HG22 ' A' ' 478' ' ' VAL . 55.5 mt -109.84 117.6 55.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 120.827 0.346 . . . . 10.0 110.311 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -111.95 122.84 48.89 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.811 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 504' ' ' THR . . . . . 0.402 ' HA ' ' HG1' ' A' ' 456' ' ' THR . 8.8 m -103.28 124.15 48.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.19 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 52.88 68.71 0.79 Allowed 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.864 0.728 . . . . 10.0 110.763 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.0 132.87 36.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.838 -179.346 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.57 177.02 7.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.066 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -67.09 163.19 45.45 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.125 -0.56 . . . . 10.0 112.486 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.474 HH21 ' CD ' ' A' ' 210' ' ' GLU . 98.5 mtt180 64.83 -92.98 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 122.849 0.46 . . . . 10.0 111.016 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 86.43 141.16 6.22 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.941 -0.647 . . . . 10.0 112.252 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.84 137.06 58.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.762 0.315 . . . . 10.0 110.835 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.17 116.48 8.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.641 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 59.2 mt -80.32 123.12 36.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.557 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 3.4 t -83.31 133.51 28.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.601 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 52.0 mt -70.8 130.49 41.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.566 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 84.65 10.15 79.91 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.103 -0.799 . . . . 10.0 111.103 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 93.55 -175.15 35.57 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 110.432 -1.067 . . . . 10.0 110.432 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 13.0 p -124.68 111.44 15.58 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 117.517 0.659 . . . . 10.0 110.539 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 519' ' ' TRP . . . . . 0.411 ' O ' HG22 ' A' ' 523' ' ' VAL . 41.7 p-90 -61.51 -20.2 62.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.049 0.452 . . . . 10.0 110.096 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -59.63 -40.95 89.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.421 -0.809 . . . . 10.0 110.277 178.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -74.63 -32.44 62.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.755 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -70.43 -45.19 66.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.91 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 523' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 519' ' ' TRP . 27.7 m -69.3 -28.36 38.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.966 0.412 . . . . 10.0 110.265 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -75.11 -22.96 57.88 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.498 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -78.29 -24.13 46.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.009 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 63.0 mt -75.7 145.56 40.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.741 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -75.7 -46.0 33.62 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.018 0.437 . . . . 10.0 110.295 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -138.15 84.39 20.61 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.263 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 529' ' ' PRO . . . . . 0.443 ' HA ' ' OE1' ' A' ' 533' ' ' GLN . 64.6 Cg_endo -78.88 104.15 1.76 Allowed 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.758 2.305 . . . . 10.0 112.66 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 72.2 p -82.4 175.07 10.53 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.309 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.11 -39.88 72.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.545 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 57.9 mp0 -60.89 -43.01 99.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.142 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 533' ' ' GLN . . . . . 0.443 ' OE1' ' HA ' ' A' ' 529' ' ' PRO . 52.4 mt-30 -69.72 -51.14 37.0 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.169 -0.468 . . . . 10.0 110.727 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.04 -42.8 87.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 10.0 111.024 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -64.13 -40.61 96.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.036 0.446 . . . . 10.0 110.45 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.449 ' HG3' ' N ' ' A' ' 537' ' ' ILE . 0.0 OUTLIER -67.1 -43.22 83.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.478 179.804 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 537' ' ' ILE . . . . . 0.449 ' N ' ' HG3' ' A' ' 536' ' ' LYS . 77.2 mt -64.21 -41.83 93.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-N 116.398 -0.365 . . . . 10.0 110.755 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -59.84 -41.15 90.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.799 0.333 . . . . 10.0 110.547 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -67.36 -45.63 75.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.384 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -42.31 99.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.348 0.594 . . . . 10.0 110.028 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 66.4 t90 -63.81 -38.72 92.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.274 -0.875 . . . . 10.0 110.59 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 31.7 tp60 -56.37 -44.41 80.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.551 -0.295 . . . . 10.0 110.591 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 16.9 t -59.77 -46.7 93.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.033 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -65.49 -44.6 86.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.572 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -57.88 -52.72 64.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.147 -0.933 . . . . 10.0 111.922 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.11 -27.12 63.36 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.657 -178.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.7 91.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.994 0.426 . . . . 10.0 110.065 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 64.7 t -65.5 -43.74 94.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.072 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 24.9 mt -62.29 -41.32 98.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.191 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.85 -36.06 81.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.808 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 551' ' ' ALA . . . . . 0.404 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -68.16 -38.38 82.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.963 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 148.26 6.74 0.24 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.379 -0.915 . . . . 10.0 113.584 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 553' ' ' GLY . . . . . 0.402 ' HA3' ' H ' ' A' ' 582' ' ' GLY . . . 82.75 -164.24 42.85 Favored Glycine 0 CA--C 1.516 0.103 0 C-N-CA 120.762 -0.732 . . . . 10.0 112.062 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 36.0 tp -74.06 118.09 16.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.27 0.557 . . . . 10.0 110.864 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -91.45 119.6 31.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.807 0.337 . . . . 10.0 110.808 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 29.9 mm -104.19 132.07 51.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.554 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 557' ' ' ILE . . . . . 0.455 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.1 mt -128.19 123.04 59.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.972 0.415 . . . . 10.0 110.052 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -106.02 129.72 9.88 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.741 -0.742 . . . . 10.0 111.667 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 23.7 p -86.13 -34.13 20.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.233 0.54 . . . . 10.0 110.584 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -134.14 162.28 32.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.335 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -109.46 138.68 45.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.511 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 562' ' ' HIS . . . . . 0.406 ' HB3' ' HB2' ' A' ' 568' ' ' ASP . 46.0 t-80 -86.58 141.15 29.22 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -52.21 -63.85 1.01 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.607 0.567 . . . . 10.0 111.037 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.64 131.9 41.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.112 178.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 565' ' ' ARG . . . . . 0.489 ' HA ' ' HB3' ' A' ' 568' ' ' ASP . 9.3 tpt180 -64.1 -19.58 65.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.381 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 566' ' ' ARG . . . . . 0.535 ' HD3' ' OD2' ' A' ' 212' ' ' ASP . 9.9 ttm180 -52.08 -64.64 0.75 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.528 -179.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 25.8 mt -75.59 -28.28 19.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.965 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 568' ' ' ASP . . . . . 0.489 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 20.5 t70 -61.73 -49.28 77.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.245 0.545 . . . . 10.0 111.005 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 569' ' ' ASN . . . . . 0.519 HD22 ' HA ' ' A' ' 394' ' ' ALA . 40.2 t30 -73.12 -31.6 64.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.473 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -67.94 -29.45 68.51 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.773 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.495 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 32.1 tp -66.89 -34.08 77.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.443 0.639 . . . . 10.0 109.474 178.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 26.5 ttp180 -83.3 -22.82 32.84 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.15 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -71.88 12.94 2.66 Favored Glycine 0 CA--C 1.522 0.5 0 CA-C-N 115.862 -0.608 . . . . 10.0 113.972 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 574' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 1.5 mmt180 -77.15 -35.48 56.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 117.277 0.538 . . . . 10.0 109.806 179.121 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.593 ' OG ' ' HA3' ' A' ' 582' ' ' GLY . 41.2 t -94.96 165.29 12.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.422 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 576' ' ' GLY . . . . . 0.578 ' HA2' ' O ' ' A' ' 580' ' ' ASP . . . 76.64 39.07 30.53 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.718 -0.753 . . . . 10.0 111.281 -179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -111.07 136.71 49.69 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.56 0.219 . . . . 10.0 110.488 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 59.93 21.65 10.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.905 -0.589 . . . . 10.0 112.423 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 105.31 1.75 41.17 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.404 -0.903 . . . . 10.0 113.338 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 580' ' ' ASP . . . . . 0.578 ' O ' ' HA2' ' A' ' 576' ' ' GLY . 2.8 t70 -66.06 148.01 52.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.726 0.298 . . . . 10.0 110.316 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 581' ' ' ALA . . . . . 0.558 ' O ' ' HA ' ' A' ' 420' ' ' ARG . . . -84.3 -85.54 0.13 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.79 -0.819 . . . . 10.0 108.79 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 582' ' ' GLY . . . . . 0.593 ' HA3' ' OG ' ' A' ' 575' ' ' SER . . . 83.77 174.71 50.54 Favored Glycine 0 N--CA 1.439 -1.133 0 C-N-CA 120.59 -0.814 . . . . 10.0 113.396 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 421' ' ' LYS . 0.1 OUTLIER -153.64 121.44 6.0 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 -179.68 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -97.97 110.34 22.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.872 0.367 . . . . 10.0 110.985 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 585' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 3.3 tpm_? -119.36 112.96 20.08 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.714 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -106.9 137.68 44.49 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.975 0.417 . . . . 10.0 111.012 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -124.75 141.93 51.76 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 588' ' ' LEU . . . . . 0.448 ' HB2' HG22 ' A' ' 427' ' ' VAL . 8.6 mt -142.71 171.32 14.21 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.923 0.392 . . . . 10.0 110.863 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.39 155.56 48.23 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.988 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 590' ' ' MET . . . . . 0.499 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 90.7 mmm -71.18 -5.37 31.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.771 0.32 . . . . 10.0 111.131 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -99.33 -4.39 31.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.408 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -73.13 149.73 42.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.369 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -60.25 -17.25 40.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.525 -0.761 . . . . 10.0 112.224 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.518 ' O ' HG12 ' A' ' 597' ' ' ILE . 20.4 tp -64.2 -28.35 69.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.831 0.348 . . . . 10.0 110.842 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.464 ' SD ' ' HB3' ' A' ' 604' ' ' SER . 14.8 mmt -81.75 5.37 18.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.984 0.421 . . . . 10.0 111.297 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -97.9 -15.92 19.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.439 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.518 HG12 ' O ' ' A' ' 594' ' ' LEU . 42.6 pt -86.41 11.34 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.188 0.518 . . . . 10.0 110.764 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -90.25 22.56 3.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.799 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.1 -58.42 0.57 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.684 0.794 . . . . 10.0 111.842 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.2 m -127.53 136.62 51.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.746 0.307 . . . . 10.0 110.567 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.11 -20.3 63.9 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.249 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 602' ' ' ARG . . . . . 0.423 ' O ' ' HD3' ' A' ' 602' ' ' ARG . 0.9 OUTLIER -64.64 -33.7 76.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.75 -179.793 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 16.2 t -67.57 -50.19 63.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.177 0.513 . . . . 10.0 109.752 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 604' ' ' SER . . . . . 0.464 ' HB3' ' SD ' ' A' ' 595' ' ' MET . 0.0 OUTLIER -65.93 -35.8 81.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.08 179.173 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -61.25 -28.73 69.68 Favored Glycine 0 N--CA 1.45 -0.433 0 CA-C-N 115.788 -0.642 . . . . 10.0 112.637 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 14.9 tpt -66.6 -32.21 73.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.191 0.52 . . . . 10.0 110.253 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 67.5 mtt -74.12 -11.27 60.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.698 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -77.39 -0.61 26.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.08 0.467 . . . . 10.0 110.686 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -108.31 22.7 15.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.527 179.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.68 -12.29 57.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.436 -0.802 . . . . 10.0 111.235 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 93.67 -57.16 2.27 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.949 -0.643 . . . . 10.0 112.339 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 66.85 -79.34 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.27 0.628 . . . . 10.0 112.219 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? 67.62 95.4 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.34 0 O-C-N 123.67 0.606 . . . . 10.0 110.172 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 614' ' ' PRO . . . . . 0.443 ' HG3' ' HG2' ' A' ' 433' ' ' GLU . 53.6 Cg_exo -51.79 110.62 0.45 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.211 2.607 . . . . 10.0 113.412 -178.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 117.98 -22.21 9.92 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.012 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -92.79 98.44 11.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.189 0.518 . . . . 10.0 110.449 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -95.06 88.11 5.12 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.489 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -86.45 -12.2 11.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.777 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 69.62 142.41 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.66 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -144.13 93.25 6.04 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.337 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -62.73 -29.92 77.76 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.15 2.567 . . . . 10.0 113.805 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 64.8 p-90 -68.82 -17.72 64.05 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.055 0.391 . . . . 10.0 112.055 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.534 HG11 HG23 ' A' ' 427' ' ' VAL . 44.2 t -66.07 -51.25 62.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.779 0.323 . . . . 10.0 110.3 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 27.9 m -59.03 -34.65 72.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.233 0.54 . . . . 10.0 110.437 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -68.04 -41.93 81.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.988 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -65.45 -43.65 89.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.523 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 92.1 mt -63.34 -45.11 99.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.686 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -59.49 -42.68 92.71 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.914 0.388 . . . . 10.0 110.721 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -68.5 -39.41 81.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.351 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -62.11 -39.68 93.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.969 0.414 . . . . 10.0 110.154 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -61.46 -46.39 90.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.626 178.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.7 -34.09 69.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.432 -0.803 . . . . 10.0 110.915 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -62.75 -48.15 80.45 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.95 0.405 . . . . 10.0 110.519 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 48.1 t -62.97 -43.29 98.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.477 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -64.54 -43.23 94.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.676 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 49.9 m -62.91 -32.89 74.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.991 0.424 . . . . 10.0 110.161 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -67.89 -42.81 80.62 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -65.59 -40.29 92.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.302 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -59.38 -40.57 86.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.255 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 640' ' ' ASP . . . . . 0.566 ' O ' ' HG2' ' A' ' 644' ' ' GLN . 33.1 t70 -60.11 -43.59 95.48 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 179.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 58.2 mt -66.11 -43.03 92.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.159 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 642' ' ' ARG . . . . . 0.431 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 7.6 mtm-85 -59.77 -40.71 89.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.731 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 19.7 ttpp -60.85 -41.98 96.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.494 -0.776 . . . . 10.0 110.599 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 644' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 9.8 mm100 -64.07 -43.33 95.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.577 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 87.3 mt -63.97 -44.14 93.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.198 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 646' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 97.1 mt -66.09 -30.24 70.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.277 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.07 -27.79 68.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.24 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -100.61 -32.41 10.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.888 0.375 . . . . 10.0 110.731 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -35.69 80.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.234 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -69.73 -22.98 63.34 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.988 0.423 . . . . 10.0 110.897 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 651' ' ' VAL . . . . . 0.432 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 48.5 t -64.71 -47.18 89.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.163 -0.68 . . . . 10.0 109.163 178.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -70.7 -28.49 64.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.517 -0.765 . . . . 10.0 109.503 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -60.79 -52.31 65.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.617 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -60.04 -45.95 91.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.937 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 655' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 35.5 mt-30 -62.2 -41.73 98.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.626 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 11.4 ttp-105 -63.8 -48.53 76.52 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 52.0 ttp180 -57.54 -44.92 85.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.91 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.19 -53.55 51.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.902 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 8.5 tp -66.21 -33.31 62.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 121.028 -0.269 . . . . 10.0 111.356 -178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -69.86 -33.49 72.33 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 110.257 -0.275 . . . . 10.0 110.257 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 57.1 m -65.08 -39.13 92.78 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -68.78 -44.22 74.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.712 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 44.5 ttt-85 -62.97 -37.84 88.71 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.238 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -68.6 -35.71 77.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.325 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.62 -51.51 64.9 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 52.0 mt -65.91 -18.25 65.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.601 -0.727 . . . . 10.0 110.472 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 47.6 tp -80.42 -44.43 19.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.457 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.49 -43.15 60.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.991 -0.549 . . . . 10.0 112.351 -178.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 34.3 m -67.68 149.31 11.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.203 0.525 . . . . 10.0 111.73 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.47 -31.71 11.85 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.672 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -101.61 146.47 27.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.125 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 672' ' ' VAL . . . . . 0.443 ' O ' HG12 ' A' ' 676' ' ' ILE . 9.5 p -143.47 10.75 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.958 0.409 . . . . 10.0 110.69 -179.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.85 -43.61 86.01 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.036 0.446 . . . . 10.0 110.942 -179.008 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -62.33 -50.34 72.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.84 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 675' ' ' THR . . . . . 0.404 ' O ' HG12 ' A' ' 679' ' ' ILE . 1.8 m -56.95 -46.41 82.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.022 -0.536 . . . . 10.0 111.33 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 676' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 672' ' ' VAL . 46.4 mm -61.73 -44.23 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.942 0.401 . . . . 10.0 110.932 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -67.27 -41.41 85.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.459 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 40.2 m -62.35 -44.98 95.21 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 679' ' ' ILE . . . . . 0.459 ' O ' HG23 ' A' ' 683' ' ' VAL . 47.2 pt -74.79 -26.38 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 C-N-CA 120.535 -0.466 . . . . 10.0 110.669 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -59.63 -42.04 91.82 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.209 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -60.88 -47.13 87.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.657 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.75 -47.7 77.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.152 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 683' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 679' ' ' ILE . 81.0 t -58.66 -51.91 66.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.314 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -60.57 -42.84 97.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.126 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.1 tttm -63.39 -49.77 72.49 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 121.16 -0.216 . . . . 10.0 110.554 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.92 -41.85 88.3 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.44 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 23.9 m -65.41 -40.77 93.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.022 0.439 . . . . 10.0 110.597 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 84.1 mt -67.43 -42.2 86.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.487 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -57.23 -24.96 58.14 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 122.755 0.422 . . . . 10.0 111.946 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -75.63 -28.45 58.82 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -108.21 -24.64 11.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.096 0.474 . . . . 10.0 111.161 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 692' ' ' ILE . . . . . 0.5 HG23 ' CD1' ' A' ' 701' ' ' TRP . 84.6 mt -132.91 99.89 14.87 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.41 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -62.14 139.91 80.89 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.427 2.085 . . . . 10.0 111.571 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.82 113.88 1.59 Allowed 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.813 2.342 . . . . 10.0 112.855 -179.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 58.13 67.37 0.96 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.215 -0.902 . . . . 10.0 111.942 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 14.3 p -127.35 177.81 6.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.199 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 18.6 mt -75.88 154.54 35.99 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.18 -26.98 65.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.378 . . . . 10.0 111.598 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -67.06 -14.23 62.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.554 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 700' ' ' MET . . . . . 0.403 ' HA ' ' HB2' ' B' ' 2' ' ' MET . 1.7 mpt? -104.96 7.43 34.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.626 -0.261 . . . . 10.0 111.041 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 701' ' ' TRP . . . . . 0.5 ' CD1' HG23 ' A' ' 692' ' ' ILE . 41.7 m0 -101.23 106.3 17.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.742 0.306 . . . . 10.0 111.099 -179.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 58.7 t0 -82.51 77.58 9.26 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 703' ' ' ILE . . . . . 0.511 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 24.2 mm -57.76 -49.9 91.17 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.652 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 704' ' ' PRO . . . . . 0.511 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 32.2 Cg_exo -60.14 -42.0 46.9 Favored 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 121.894 1.729 . . . . 10.0 111.718 179.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -63.81 -44.8 95.67 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.622 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 55.6 tp -65.06 -40.99 95.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.189 -0.301 . . . . 10.0 110.189 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -62.04 -48.11 81.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.512 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -59.42 -42.23 91.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.02 -0.537 . . . . 10.0 110.235 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -63.46 -43.44 97.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.548 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 49.6 mt -64.07 -42.62 96.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.297 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 14.3 mtpp -76.1 -6.05 49.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.881 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -111.84 -56.54 2.37 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.484 0.55 . . . . 10.0 112.484 -178.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -83.73 -19.22 35.56 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.879 0.696 . . . . 10.0 112.879 -177.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -123.02 -8.92 8.27 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.465 -0.494 . . . . 10.0 112.123 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.98 21.79 12.59 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.019 0.438 . . . . 10.0 110.758 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 12.8 tp -97.65 109.88 22.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.407 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -91.47 92.32 8.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.918 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 40.0 mt -123.4 122.7 26.65 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.399 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -82.36 77.99 3.57 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.8 2.334 . . . . 10.0 112.186 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 44.7 mt -61.43 -37.24 77.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.197 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.45 4.35 4.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.883 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -109.18 -0.88 19.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.865 0.364 . . . . 10.0 110.211 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 15.9 m0 -114.44 -44.92 3.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.676 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 11.1 tp -60.33 -16.51 35.47 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.358 0.873 . . . . 10.0 113.358 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -90.27 -32.67 16.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.994 0.426 . . . . 10.0 111.075 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 726' ' ' LYS . . . . . 0.519 ' O ' ' HD3' ' A' ' 728' ' ' PRO . 40.3 mttp -93.34 -23.19 18.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.925 -178.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -109.36 94.74 16.54 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-O 120.752 0.311 . . . . 10.0 110.725 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 728' ' ' PRO . . . . . 0.519 ' HD3' ' O ' ' A' ' 726' ' ' LYS . 11.7 Cg_exo -71.66 -16.81 30.06 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.939 2.426 . . . . 10.0 112.41 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.28 21.42 17.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.111 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.73 -28.35 66.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.71 -134.58 0.57 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.44 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.35 -56.25 1.24 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.066 0.46 . . . . 10.0 110.564 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 733' ' ' GLU . . . . . 0.489 ' HG2' ' N ' ' A' ' 734' ' ' THR . 20.2 pm0 -60.67 -38.95 86.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.758 -0.655 . . . . 10.0 111.8 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 734' ' ' THR . . . . . 0.489 ' N ' ' HG2' ' A' ' 733' ' ' GLU . 0.1 OUTLIER -65.68 -27.59 68.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.974 0.416 . . . . 10.0 110.794 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 50.2 tp -69.04 -40.41 78.6 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 -64.38 -41.15 96.84 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.858 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -60.21 -40.82 91.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.701 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 21.6 mmm-85 -61.15 -50.64 72.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.795 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 55.4 mt -60.38 -43.6 94.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.652 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 740' ' ' LEU . . . . . 0.428 ' O ' HG13 ' A' ' 744' ' ' ILE . 16.5 tp -63.93 -50.95 66.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.001 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.83 86.54 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.24 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 742' ' ' GLN . . . . . 0.405 ' O ' HG23 ' A' ' 746' ' ' VAL . 16.6 tp60 -64.95 -39.51 93.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.744 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 24.5 p -63.44 -33.54 75.77 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.062 0.458 . . . . 10.0 110.033 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 744' ' ' ILE . . . . . 0.522 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 66.7 mt -70.41 -43.98 77.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -48.93 79.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.34 -0.846 . . . . 10.0 111.114 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 742' ' ' GLN . 57.9 t -64.32 -36.66 77.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.065 0.46 . . . . 10.0 110.261 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.48 -43.22 99.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.332 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 748' ' ' GLN . . . . . 0.522 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 97.2 mt-30 -58.75 -37.93 77.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.748 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 749' ' ' ARG . . . . . 0.447 ' O ' HG23 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -62.58 -46.01 90.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.477 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -65.5 -37.56 87.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.08 0.467 . . . . 10.0 109.888 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -64.1 -41.89 97.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.222 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -64.52 -29.82 70.85 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 753' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 749' ' ' ARG . 54.9 t -78.74 -48.96 21.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.824 0.345 . . . . 10.0 111.37 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 38.9 t -74.07 -52.04 21.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.961 0.41 . . . . 10.0 111.637 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 139.77 141.61 4.09 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.301 -0.719 . . . . 10.0 111.301 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 756' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -60.94 -63.2 1.38 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.783 0.291 . . . . 10.0 111.458 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -60.19 -37.87 81.54 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.729 0.299 . . . . 10.0 110.701 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 14.6 tpt -61.19 -45.21 95.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.27 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 45.0 mmm -65.23 -41.34 94.48 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.49 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.4 mmp_? -59.35 -41.4 89.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.255 0.55 . . . . 10.0 109.997 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -70.48 -33.86 71.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.829 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -65.24 -52.41 54.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.542 -0.754 . . . . 10.0 109.772 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -58.91 -45.31 90.64 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.175 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 764' ' ' LYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 768' ' ' LEU . 50.9 tttp -56.11 -47.7 77.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.163 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -68.64 -38.88 86.53 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 121.003 -0.617 . . . . 10.0 112.079 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 30.2 t -61.89 -45.41 98.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 110.523 -0.177 . . . . 10.0 110.523 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 37.8 mtp -59.2 -46.13 89.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.73 -0.213 . . . . 10.0 110.516 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 768' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 764' ' ' LYS . 85.1 mt -64.46 -47.92 77.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.494 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -58.42 -46.58 86.19 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.94 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 19.3 m -63.7 -38.77 92.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.925 0.393 . . . . 10.0 110.563 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.65 -50.56 72.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.788 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.46 -29.95 71.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.702 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 69.1 m -68.05 -43.86 77.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.911 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.16 -25.44 34.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.731 0.301 . . . . 10.0 111.109 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 27.2 t-105 -63.68 -49.45 73.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.565 -0.289 . . . . 10.0 111.3 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.456 ' HE2' ' HB3' ' B' ' 22' ' ' MET . 8.5 ptpp? -59.58 -39.26 83.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.81 0.338 . . . . 10.0 110.547 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 777' ' ' GLU . . . . . 0.499 ' HG2' ' HG3' ' A' ' 305' ' ' MET . 10.6 tt0 -68.42 -39.93 81.4 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.204 0.526 . . . . 10.0 109.985 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 68.0 t60 -62.24 -38.17 88.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.274 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 80.7 mt -65.41 -47.16 77.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.488 179.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -63.81 -46.16 86.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.759 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -60.56 -41.62 94.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.128 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 51.1 mmm -63.16 -42.33 99.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.734 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -68.31 -36.64 79.62 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.099 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -69.69 -32.99 71.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.43 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.55 -37.29 60.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.962 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -60.96 -50.79 71.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.35 -0.841 . . . . 10.0 111.075 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -70.29 -16.51 63.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.944 0.402 . . . . 10.0 110.986 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -97.93 11.23 64.24 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.015 -0.612 . . . . 10.0 112.224 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 16.3 tt -61.77 -19.71 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 121.056 0.455 . . . . 10.0 111.069 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -64.95 -25.8 68.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.332 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 34.9 tp -98.99 -16.47 18.71 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.314 0.578 . . . . 10.0 110.437 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 792' ' ' ARG . . . . . 0.502 ' HD2' ' OE2' ' A' ' 806' ' ' GLU . 12.8 mmt180 -82.91 -45.0 14.73 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.637 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -74.93 107.22 2.23 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.735 -0.745 . . . . 10.0 112.263 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 26.4 p90 -99.73 176.59 5.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.892 0.377 . . . . 10.0 111.046 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -63.36 149.31 46.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.348 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 65.33 25.65 12.1 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.648 -0.706 . . . . 10.0 111.094 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -147.01 152.73 39.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.601 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -100.26 134.52 20.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.137 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.99 -27.44 84.78 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.676 2.25 . . . . 10.0 112.0 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -81.46 155.39 25.86 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 73.09 -49.43 0.7 Allowed 'General case' 0 N--CA 1.468 0.448 0 O-C-N 123.578 0.549 . . . . 10.0 111.166 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 802' ' ' GLU . . . . . 0.46 ' OE2' ' HD3' ' A' ' 805' ' ' ARG . 3.1 tp10 -65.16 -47.65 76.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.069 0.461 . . . . 10.0 109.83 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -61.8 -34.73 76.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.87 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -63.63 -36.24 83.17 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.922 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 805' ' ' ARG . . . . . 0.46 ' HD3' ' OE2' ' A' ' 802' ' ' GLU . 44.8 mtp180 -58.5 -43.59 89.1 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.153 0.502 . . . . 10.0 109.718 178.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 806' ' ' GLU . . . . . 0.502 ' OE2' ' HD2' ' A' ' 792' ' ' ARG . 2.8 mm-40 -62.6 -44.79 95.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.964 179.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 6.2 m -61.02 -39.82 91.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.713 -0.676 . . . . 10.0 110.966 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -71.99 -38.01 69.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.865 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 40.2 m -62.94 -39.66 95.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.06 0.457 . . . . 10.0 109.946 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 18.9 ttm -66.74 -37.21 84.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.086 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 811' ' ' PHE . . . . . 0.43 ' O ' ' HG ' ' A' ' 815' ' ' LEU . 27.4 t80 -65.7 -41.98 91.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.348 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.29 -45.88 92.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.654 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.72 -37.27 85.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.13 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 22.9 ttt -62.83 -44.31 96.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.597 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 815' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 811' ' ' PHE . 94.1 mt -62.06 -41.53 98.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.846 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -64.21 -45.95 86.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.241 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 11.7 m -65.02 -35.8 82.34 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.992 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 63.6 tp -56.07 -51.01 69.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.639 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -62.49 -42.09 99.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.225 0.536 . . . . 10.0 110.399 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -58.88 -57.45 12.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.196 -0.911 . . . . 10.0 111.629 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -59.97 -42.95 95.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.076 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 30.4 t -58.44 -52.55 57.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.561 0.219 . . . . 10.0 110.614 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 35.4 mm -63.77 -41.24 91.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.695 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 37.1 t -56.83 -49.42 75.47 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.736 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 16.7 m -63.16 -37.96 89.28 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.323 -0.398 . . . . 10.0 111.75 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 93.5 mt -75.56 -17.03 60.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.553 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 16.3 m -95.94 -41.75 8.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.997 0.427 . . . . 10.0 110.627 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -77.34 -1.01 27.78 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.867 -0.606 . . . . 10.0 112.453 -178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.0 p -64.59 118.37 6.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.439 0.638 . . . . 10.0 110.065 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -80.44 106.16 12.25 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.237 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 61.5 t -119.66 137.87 52.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.148 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 27.9 ptt-85 -63.83 133.95 54.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.06 0.457 . . . . 10.0 110.635 179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -93.05 136.97 23.97 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.235 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -78.81 -162.45 0.18 Allowed 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.669 2.246 . . . . 10.0 112.363 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.55 105.95 4.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.66 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.5 -0.762 . . . . 10.0 110.188 179.788 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.614 ' HG3' ' SD ' ' B' ' 2' ' ' MET . 16.1 tpt . . . . . 0 N--CA 1.478 0.945 0 N-CA-C 110.287 -0.264 . . . . 10.0 110.287 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 2' ' ' MET . . . . . 0.614 ' SD ' ' HG3' ' B' ' 1' ' ' MET . 0.4 OUTLIER -112.32 109.59 19.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.705 -0.225 . . . . 10.0 110.918 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 25.1 pt -136.11 158.85 38.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.186 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 23.9 p -93.0 153.9 18.46 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.368 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.446 ' O ' ' HD3' ' B' ' 7' ' ' LYS . 10.5 tp -66.24 131.31 45.85 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.711 -0.477 . . . . 10.0 109.711 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 1.5 tpp180 -94.68 86.58 4.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.193 0.521 . . . . 10.0 110.015 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' LYS . . . . . 0.446 ' HD3' ' O ' ' B' ' 5' ' ' LEU . 0.0 OUTLIER -85.64 154.67 21.53 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.565 -0.743 . . . . 10.0 110.352 -179.738 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 20.6 ttp-105 -80.14 -25.37 39.9 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 178.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -95.61 120.32 35.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.115 -0.948 . . . . 10.0 108.724 178.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 23.6 pttt -142.94 108.82 5.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.73 0.3 . . . . 10.0 110.78 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 18.2 tp -166.92 70.22 1.02 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.974 0.416 . . . . 10.0 110.546 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -71.79 -26.57 19.01 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.484 2.123 . . . . 10.0 111.688 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.59 1.57 22.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.333 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 14' ' ' ALA . . . . . 0.486 ' HB3' HD12 ' A' ' 291' ' ' ILE . . . -53.47 -36.57 61.78 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.398 -0.365 . . . . 10.0 111.904 -179.248 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 14.5 t -64.65 -60.38 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.788 0.328 . . . . 10.0 111.142 -179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.27 88.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.855 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.29 -42.39 95.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.733 0.301 . . . . 10.0 110.706 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ALA . . . . . 0.48 ' HB1' ' HA ' ' A' ' 231' ' ' ASP . . . -66.73 -39.87 88.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.858 0.361 . . . . 10.0 111.144 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.83 -13.4 59.9 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.31 0.576 . . . . 10.0 110.764 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -89.15 -7.03 70.61 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.486 -0.779 . . . . 10.0 112.7 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 64.8 t -59.96 -39.41 80.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-O 120.958 0.409 . . . . 10.0 110.048 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.577 ' HG2' ' HB3' ' A' ' 229' ' ' ALA . 0.0 OUTLIER -78.04 77.89 4.53 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.114 0.483 . . . . 10.0 109.966 178.998 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.2 m -146.34 -164.91 2.08 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.251 -0.886 . . . . 10.0 109.323 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.1 123.75 18.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.943 0.401 . . . . 10.0 110.613 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -90.63 103.81 16.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.61 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.71 85.01 2.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.332 0.586 . . . . 10.0 110.736 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 50.3 mtm -80.31 113.91 18.83 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.652 -0.704 . . . . 10.0 111.073 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.56 -0.733 . . . . 10.0 110.267 179.375 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 38.3 t . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.614 0.245 . . . . 10.0 110.385 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -77.09 150.23 35.68 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.864 -179.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 142.58 165.16 10.46 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.842 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.44 ' H ' ' HD3' ' A' ' 16' ' ' ARG . 0.7 OUTLIER -57.28 133.45 55.11 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 122.413 0.285 . . . . 10.0 110.566 179.661 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.517 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 5.1 mmp_? -58.52 137.72 57.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.739 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 68.17 -83.67 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.328 -0.851 . . . . 10.0 112.543 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -41.08 -68.13 0.2 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.497 1.295 . . . . 10.0 114.497 -177.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.44 ' HD3' ' H ' ' A' ' 12' ' ' SER . 44.0 ttt180 -64.32 -43.01 96.01 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.48 0.548 . . . . 10.0 112.48 -177.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.89 -39.34 88.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.15 0.426 . . . . 10.0 112.15 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.5 mt -61.17 -53.94 50.66 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.08 0.4 . . . . 10.0 112.08 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -66.66 -24.22 66.25 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.57 -0.452 . . . . 10.0 110.953 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.07 -42.44 56.89 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 60.5 mtt -68.5 -32.3 72.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.817 -0.628 . . . . 10.0 109.667 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -57.5 -32.96 67.54 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.453 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -63.36 -43.72 96.85 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.182 0.515 . . . . 10.0 109.843 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.64 -41.94 91.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.391 -0.822 . . . . 10.0 109.943 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.455 ' HA ' HD12 ' A' ' 28' ' ' ILE . 97.5 t -60.72 -37.07 74.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.681 -0.69 . . . . 10.0 110.117 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -63.24 -43.12 98.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.66 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 82.3 mt -61.95 -45.57 98.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.986 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.455 HD12 ' HA ' ' A' ' 25' ' ' VAL . 55.8 mt -59.66 -40.29 81.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.346 179.107 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -63.84 -33.55 75.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.862 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.439 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -82.56 -26.94 31.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.479 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 13.4 ttt -83.3 -16.42 46.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.69 0.281 . . . . 10.0 110.814 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.477 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 27.5 tt0 -59.49 -51.93 77.77 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 116.352 -0.385 . . . . 10.0 111.728 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.477 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 51.8 Cg_exo -56.28 -28.3 70.98 Favored 'Trans proline' 0 C--N 1.361 1.214 0 C-N-CA 121.844 1.696 . . . . 10.0 111.949 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -73.1 -42.09 63.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.835 -0.62 . . . . 10.0 109.908 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 25.4 mmt -66.31 -27.83 68.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.435 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 83.7 mt-10 -62.48 -23.48 66.94 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.839 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 mtpt -86.17 -14.32 44.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.069 0.461 . . . . 10.0 110.589 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 7.8 mp -87.48 140.51 29.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.321 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.6 p -76.28 171.67 14.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.649 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.04 -38.24 82.18 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.894 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -70.55 -32.01 69.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.554 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -66.94 -34.74 78.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.276 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.2 mt -62.93 -44.79 95.12 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.896 -0.779 . . . . 10.0 108.896 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -63.4 -28.05 69.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.926 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.65 -34.3 72.65 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 115.421 -0.808 . . . . 10.0 111.449 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -68.89 -39.34 79.82 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.6 m -60.21 -44.24 95.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.103 0.478 . . . . 10.0 109.915 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -38.32 88.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.653 -0.703 . . . . 10.0 110.055 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -60.5 -40.07 90.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.375 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -62.77 -43.42 98.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.321 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -58.48 -46.83 85.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.357 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.571 ' O ' ' HG3' ' A' ' 56' ' ' LYS . . . -68.83 -44.39 73.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.302 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 33.5 mtp180 -58.23 -40.27 81.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.786 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 72.6 mt -62.76 -38.5 90.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 10.0 110.626 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -72.45 -23.93 61.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.301 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 52' ' ' ALA . 20.5 mtpp -83.22 -66.96 0.83 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.77 0.319 . . . . 10.0 110.422 179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 178.22 67.07 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 121.071 -0.585 . . . . 10.0 111.918 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -133.39 150.6 51.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.809 0.338 . . . . 10.0 110.203 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.1 t -100.15 133.66 42.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.892 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.563 HD11 ' O ' ' A' ' 118' ' ' LEU . 17.1 tp -60.35 -41.41 93.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.096 0.474 . . . . 10.0 110.608 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.7 mp0 -68.04 -8.99 42.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.255 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -100.15 -15.18 18.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.38 0.61 . . . . 10.0 109.963 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 55.4 mt -89.1 -5.49 57.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.516 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.498 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 66.6 mt -49.54 -51.01 62.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 113.256 0.835 . . . . 10.0 113.256 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.498 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 32.1 Cg_exo -57.3 -48.19 18.83 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.829 1.686 . . . . 10.0 112.957 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.451 ' O ' HG23 ' A' ' 70' ' ' VAL . 39.4 mt-10 -71.01 -43.47 67.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.719 -178.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.497 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -61.88 -51.44 68.19 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.061 0.393 . . . . 10.0 112.061 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -61.92 -34.17 75.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.325 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.44 -45.01 92.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.415 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 66' ' ' GLU . 85.6 t -60.86 -46.39 96.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.334 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 67' ' ' ALA . 29.1 t -60.87 -46.08 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.677 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.415 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 2.7 ttt180 -59.82 -43.02 94.76 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.682 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.3 tp10 -64.49 -47.56 78.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.83 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.41 72.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.572 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.5 m -58.45 -40.94 83.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.301 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -71.14 -21.21 62.22 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -96.21 -44.38 7.3 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.731 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 67.1 t -74.1 -53.13 18.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.647 0.261 . . . . 10.0 111.628 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -98.87 -47.47 5.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.131 0.491 . . . . 10.0 111.213 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 119.54 -34.24 4.33 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.217 -0.753 . . . . 10.0 111.217 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.6 mpt? -77.99 139.62 39.15 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.01 -0.367 . . . . 10.0 110.01 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -91.13 139.04 31.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.583 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.89 114.96 3.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.079 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -61.31 152.48 29.16 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.056 0.455 . . . . 10.0 111.822 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -41.83 94.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.511 -0.768 . . . . 10.0 111.77 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -63.65 -31.61 53.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.116 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.532 HE22 HD23 ' A' ' 110' ' ' LEU . 97.9 mt-30 -70.19 -31.34 68.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.253 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.22 -31.75 73.07 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.465 ' O ' HG23 ' A' ' 93' ' ' VAL . 39.1 mt -73.77 -48.82 28.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.806 -0.634 . . . . 10.0 109.438 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.88 -40.84 99.38 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.779 -0.646 . . . . 10.0 112.508 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.32 -28.66 73.34 Favored Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 112.026 -0.43 . . . . 10.0 112.026 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 16.4 ttm -74.34 -37.6 63.5 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 89' ' ' LEU . 58.8 t -66.82 -33.78 65.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.03 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.1 mt -74.29 -2.69 26.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.562 -0.745 . . . . 10.0 112.141 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -83.13 -35.05 25.9 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 178.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -96.35 178.02 5.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.194 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -79.07 71.33 5.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.066 0.46 . . . . 10.0 110.443 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 56.2 m -143.74 154.35 43.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.445 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.553 HD12 HG11 ' A' ' 211' ' ' VAL . 41.1 mm -103.29 136.48 35.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -116.18 126.99 54.42 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 111.929 0.344 . . . . 10.0 111.929 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -87.54 121.04 29.46 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.42 ' SD ' ' HG2' ' A' ' 108' ' ' LYS . 45.5 ttm -112.63 158.58 19.82 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.974 0.416 . . . . 10.0 111.271 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 103' ' ' ARG . 9.9 mmm180 -95.02 157.38 15.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.25 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.43 108.04 7.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.39 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 132.31 -28.36 3.47 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.485 -0.864 . . . . 10.0 112.926 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.601 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 4.4 mm-40 -60.47 -51.02 71.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.018 0.437 . . . . 10.0 110.542 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 114.71 99.52 2.28 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.806 -0.711 . . . . 10.0 112.469 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.42 ' HG2' ' SD ' ' A' ' 102' ' ' MET . 40.2 mtmt -69.8 -45.5 67.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.657 0.265 . . . . 10.0 111.054 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 73.4 m -62.07 -34.16 75.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.269 0.556 . . . . 10.0 110.68 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.532 HD23 HE22 ' A' ' 87' ' ' GLN . 13.3 tp -81.14 -1.99 46.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.998 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 42.2 m -110.81 -42.71 3.95 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.895 0.378 . . . . 10.0 110.464 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.52 -13.56 59.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.975 -0.557 . . . . 10.0 112.155 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -24.98 63.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.462 -0.335 . . . . 10.0 111.799 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.416 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 55.5 mt -73.63 -57.16 2.68 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 31.6 Cg_endo -62.11 -32.34 83.31 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.108 1.872 . . . . 10.0 112.118 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.29 77.16 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.385 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.415 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 57.1 t80 -63.47 -46.97 83.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.488 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.563 ' O ' HD11 ' A' ' 60' ' ' LEU . 52.1 tp -58.85 -51.1 71.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.706 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -72.26 -21.78 61.32 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.693 0.257 . . . . 10.0 111.693 -178.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.472 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -70.22 -26.64 63.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.877 0.37 . . . . 10.0 110.861 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 58.8 mt -58.72 -32.32 69.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.218 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 69.0 p -64.23 -35.56 81.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.244 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.06 19.26 59.51 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.914 -0.66 . . . . 10.0 112.303 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 64.1 mmtt -87.36 -26.77 23.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.938 0.399 . . . . 10.0 110.881 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 109.1 105.77 2.99 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.771 -0.728 . . . . 10.0 112.922 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 78.4 t -79.35 115.66 22.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -93.56 99.05 11.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.741 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 40.5 t -92.21 118.9 38.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.957 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 52.4 t -104.8 119.71 54.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.854 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.11 155.7 19.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.275 -0.42 . . . . 10.0 110.764 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 5.1 m -64.71 -36.94 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.899 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -139.0 162.66 34.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.766 0.317 . . . . 10.0 110.631 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.88 -24.12 63.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.406 -178.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -62.68 -55.24 28.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.82 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 83.2 mt -68.71 -33.08 73.34 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.595 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.75 -50.8 69.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.976 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -72.55 -35.63 68.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.725 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -58.92 -57.33 13.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.724 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.76 -32.63 74.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.001 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.7 -49.15 77.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.997 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.415 ' O ' ' HD3' ' A' ' 145' ' ' PRO . 54.4 mm-40 -78.53 -28.26 46.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.472 -179.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -71.38 -43.0 67.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.015 0.436 . . . . 10.0 111.08 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -88.77 -1.66 58.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.119 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.499 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 60.6 ttm-85 -64.87 -50.16 64.68 Favored Pre-proline 0 CA--C 1.535 0.404 0 N-CA-C 112.484 0.55 . . . . 10.0 112.484 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' PRO . . . . . 0.499 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 32.4 Cg_exo -60.69 -14.39 31.28 Favored 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 122.102 1.868 . . . . 10.0 112.62 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 14.3 tp -89.07 -56.49 3.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.405 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -65.87 -46.74 77.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 10.0 112.186 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -64.95 -25.57 67.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.781 0.324 . . . . 10.0 111.591 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -77.45 -22.93 50.68 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.071 0.462 . . . . 10.0 110.306 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 81.8 mt -93.17 -6.73 47.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.659 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 103.74 8.16 40.45 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.515 -0.85 . . . . 10.0 113.585 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 91.8 mt -96.91 138.7 34.06 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.1 0.45 . . . . 10.0 110.592 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.35 130.65 34.44 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.279 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.426 HG21 ' HA ' ' A' ' 144' ' ' ARG . 47.2 t -111.45 123.03 66.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.941 0.4 . . . . 10.0 110.689 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -120.57 150.46 17.37 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.993 -0.622 . . . . 10.0 112.278 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 4.3 tp -123.81 133.2 69.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -118.98 116.48 26.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.407 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.505 ' O ' ' HB2' ' A' ' 161' ' ' MET . 94.7 mt -109.06 146.07 33.08 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.482 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 159' ' ' PRO . . . . . 0.567 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 15.2 Cg_endo -58.46 115.08 2.28 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 122.655 2.236 . . . . 10.0 112.22 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.85 5.24 56.6 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.785 -0.722 . . . . 10.0 112.746 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' MET . . . . . 0.505 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.3 OUTLIER -65.87 151.96 94.15 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.555 0.177 . . . . 10.0 110.809 179.496 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -61.33 147.0 96.69 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.496 2.131 . . . . 10.0 111.866 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' ALA . . . . . 0.487 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.82 -49.71 87.79 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 112.384 0.513 . . . . 10.0 112.384 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.487 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 52.2 Cg_exo -56.59 -44.87 41.45 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 121.819 1.68 . . . . 10.0 112.205 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.69 98.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.67 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -62.25 -44.47 96.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.456 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' ARG . . . . . 0.438 ' CG ' ' HA ' ' A' ' 199' ' ' VAL . 74.9 mtt180 -59.68 -40.52 88.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.005 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.99 -35.07 74.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.882 0.373 . . . . 10.0 110.437 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -68.62 -39.11 80.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.746 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -80.94 -12.84 59.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.59 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -85.66 -9.6 56.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.32 0.581 . . . . 10.0 109.463 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -80.13 165.03 22.87 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.285 -0.87 . . . . 10.0 109.895 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' ASP . . . . . 0.472 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 17.2 m-20 -70.54 -37.05 74.0 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.805 0.336 . . . . 10.0 110.76 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.3 mp -126.52 122.59 61.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.061 179.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 5.8 m -115.7 121.01 41.24 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.886 0.374 . . . . 10.0 111.18 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -99.74 141.67 32.23 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -177.83 172.62 45.26 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.34 -0.933 . . . . 10.0 112.895 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.87 153.45 21.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.805 0.336 . . . . 10.0 111.15 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -63.31 -35.92 81.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.899 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -59.49 -52.19 66.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.169 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.567 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.8 tp10 -69.79 -37.53 76.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.102 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -56.8 -36.04 69.43 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.974 0.416 . . . . 10.0 110.834 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -77.88 -40.03 22.66 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.804 -0.713 . . . . 10.0 111.694 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -64.3 -40.03 95.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.581 0.229 . . . . 10.0 110.58 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -60.43 -41.43 93.99 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.104 0.478 . . . . 10.0 109.973 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 186' ' ' TYR . . . . . 0.434 ' HA ' HE22 ' A' ' 200' ' ' GLN . 43.7 t80 -62.25 -39.54 93.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.518 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 187' ' ' LEU . . . . . 0.4 HD22 ' HB1' ' A' ' 373' ' ' ALA . 87.1 mt -67.4 -44.02 79.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.989 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 64.1 mtm-85 -65.48 -43.56 89.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.953 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 189' ' ' ASP . . . . . 0.411 ' OD1' ' HA ' ' A' ' 198' ' ' ARG . 16.3 m-20 -62.93 -32.91 74.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.79 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -85.27 -0.61 55.24 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.484 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 24.8 ttp -121.58 10.6 10.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.819 0.343 . . . . 10.0 110.848 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -69.74 172.18 7.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.07 -0.513 . . . . 10.0 111.111 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -107.09 -30.02 9.04 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.167 0.508 . . . . 10.0 110.394 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 194' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 197' ' ' GLU . 0.1 OUTLIER -115.42 140.07 25.4 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.734 -0.667 . . . . 10.0 109.577 179.136 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.15 -28.61 87.33 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.696 2.264 . . . . 10.0 113.031 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.02 0.63 52.87 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 121.151 -0.219 . . . . 10.0 111.417 -179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 194' ' ' SER . 32.9 mt-10 -80.06 -11.32 59.78 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 121.234 -0.186 . . . . 10.0 110.71 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 198' ' ' ARG . . . . . 0.411 ' HA ' ' OD1' ' A' ' 189' ' ' ASP . 66.2 mtt180 -58.17 142.42 47.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.622 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 199' ' ' VAL . . . . . 0.438 ' HA ' ' CG ' ' A' ' 167' ' ' ARG . 28.9 m -94.77 -26.7 4.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.482 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 200' ' ' GLN . . . . . 0.434 HE22 ' HA ' ' A' ' 186' ' ' TYR . 4.1 pt20 -107.63 159.73 16.23 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.889 0.376 . . . . 10.0 110.705 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 55.3 mtm180 -82.4 -66.18 0.92 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.75 172.82 7.61 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.497 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 203' ' ' LEU . . . . . 0.436 HD22 ' CZ ' ' A' ' 384' ' ' TYR . 19.5 mt -102.68 124.97 49.21 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -140.59 -56.5 0.52 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.916 0.388 . . . . 10.0 110.325 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -127.12 136.37 52.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.64 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.493 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -132.05 127.29 35.84 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.084 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 47.5 tp -125.65 109.89 13.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.702 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.16 132.26 46.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.214 0.53 . . . . 10.0 111.109 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -49.54 77.38 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.237 -0.892 . . . . 10.0 112.243 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.52 103.97 6.44 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.927 0.394 . . . . 10.0 110.362 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.553 HG11 HD12 ' A' ' 99' ' ' ILE . 30.9 m -74.05 -18.35 17.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.754 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 212' ' ' ASP . . . . . 0.437 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.3 m-20 -46.11 -74.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.561 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 66.0 m -86.84 -19.86 28.34 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.78 0.659 . . . . 10.0 112.78 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 50.3 mt -77.7 -38.98 26.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.316 0.488 . . . . 10.0 112.316 -178.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 215' ' ' LEU . . . . . 0.409 ' O ' ' HB2' ' A' ' 219' ' ' ALA . 18.4 mt -98.44 -42.35 7.37 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -178.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 216' ' ' ILE . . . . . 0.437 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 49.5 mm -81.83 -59.04 3.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 112.575 0.583 . . . . 10.0 112.575 -178.522 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.6 -34.36 76.85 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.05 0.759 . . . . 10.0 113.05 -177.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 218' ' ' GLU . . . . . 0.436 ' O ' ' HB2' ' A' ' 377' ' ' PHE . 7.5 mm-40 -97.69 15.8 22.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.66 0.267 . . . . 10.0 111.718 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 219' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 215' ' ' LEU . . . -60.14 -49.54 77.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.936 0.398 . . . . 10.0 111.84 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 220' ' ' ARG . . . . . 0.562 ' O ' ' HD3' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -97.59 32.8 2.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.1 0.476 . . . . 10.0 111.511 -178.436 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 10.0 m -105.25 106.69 56.79 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -91.52 125.65 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.918 2.412 . . . . 10.0 113.318 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 223' ' ' LEU . . . . . 0.538 ' O ' ' HA ' ' A' ' 374' ' ' SER . 88.0 mt -79.8 110.43 15.15 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 178.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 55.7 mt -108.48 130.64 60.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.035 0.445 . . . . 10.0 111.715 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 9.4 mt -101.19 144.88 12.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 1.5 m -81.24 119.97 24.3 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.903 0.382 . . . . 10.0 111.581 -179.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 227' ' ' GLY . . . . . 0.439 ' H ' ' C ' ' A' ' 370' ' ' GLN . . . -108.23 -157.0 19.08 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 121.249 -0.5 . . . . 10.0 112.665 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -87.99 -32.07 0.18 Allowed 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 123.125 2.55 . . . . 10.0 114.216 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . 65.58 -159.46 0.27 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.046 0.539 . . . . 10.0 111.487 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -68.75 102.04 1.45 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.222 0.534 . . . . 10.0 110.987 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.11 -47.05 10.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.61 -0.723 . . . . 10.0 111.256 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.67 87.3 2.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.357 -178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 69.8 m -78.16 40.43 0.34 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.297 0.57 . . . . 10.0 111.489 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 234' ' ' GLU . . . . . 0.453 ' HB3' HD21 ' B' ' 13' ' ' LEU . 7.3 mm-40 -65.82 -25.78 67.37 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.806 -0.634 . . . . 10.0 111.262 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 12.7 ttm -70.32 -31.79 69.25 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.815 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 236' ' ' TYR . . . . . 0.448 ' CE2' ' HB3' ' A' ' 355' ' ' GLN . 0.3 OUTLIER -63.31 -48.58 77.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.383 -179.232 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.44 -7.7 27.44 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.019 0.377 . . . . 10.0 112.019 -179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -98.9 -40.29 8.16 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.487 -0.324 . . . . 10.0 110.77 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 239' ' ' VAL . . . . . 0.52 HG21 HG12 ' A' ' 310' ' ' VAL . 11.4 p -82.79 -33.73 10.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-O 120.986 0.422 . . . . 10.0 111.462 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -73.38 -6.64 47.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.936 0.347 . . . . 10.0 111.936 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.9 -11.3 19.89 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.986 0.365 . . . . 10.0 111.986 -179.007 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 242' ' ' ILE . . . . . 0.49 HG22 ' O ' ' A' ' 239' ' ' VAL . 12.7 tt -90.62 -22.05 6.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.092 0.472 . . . . 10.0 110.954 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 243' ' ' ILE . . . . . 0.497 ' C ' ' H ' ' A' ' 245' ' ' HIS . 37.4 mt -68.24 -44.78 38.11 Favored Pre-proline 0 CA--C 1.54 0.569 0 N-CA-C 112.776 0.658 . . . . 10.0 112.776 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 244' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -67.89 22.65 0.12 Allowed 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 122.289 1.993 . . . . 10.0 112.775 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 245' ' ' HIS . . . . . 0.497 ' H ' ' C ' ' A' ' 243' ' ' ILE . 18.2 t-80 -122.5 9.34 9.64 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 41.1 mt -100.59 -178.35 3.76 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.035 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 53.4 mt -117.02 128.75 74.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.046 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -67.56 75.88 0.18 Allowed 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.617 0.573 . . . . 10.0 111.335 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -173.3 -34.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.103 -0.498 . . . . 10.0 111.028 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -157.59 -179.81 8.52 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.261 -0.274 . . . . 10.0 110.261 -179.1 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 281' ' ' LEU . 14.2 mmtt 59.52 65.69 1.12 Allowed 'General case' 0 C--O 1.233 0.219 0 O-C-N 123.742 0.651 . . . . 10.0 111.576 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 252' ' ' GLU . . . . . 0.45 ' OE2' HD13 ' A' ' 281' ' ' LEU . 8.3 mm-40 71.12 -37.28 0.39 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.982 0.913 . . . . 10.0 112.653 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -74.49 5.18 4.96 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.223 0.535 . . . . 10.0 110.724 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.36 -4.12 59.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.092 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 55.79 -142.35 0.79 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.387 -0.824 . . . . 10.0 111.032 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.9 7.54 44.6 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.763 0.316 . . . . 10.0 111.184 -179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -67.86 -40.31 83.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.116 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 53.39 -103.61 0.17 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.474 -0.784 . . . . 10.0 111.693 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -129.52 29.01 3.9 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.708 -0.758 . . . . 10.0 111.868 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -143.45 -64.04 0.39 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.026 0.441 . . . . 10.0 110.458 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 78.33 -117.25 4.6 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.832 -0.699 . . . . 10.0 111.865 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -169.05 -80.52 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -163.68 160.84 23.2 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 4.5 m -69.19 116.25 9.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.925 0.393 . . . . 10.0 110.994 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 14.5 p -160.58 -33.45 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.25 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -155.06 -169.2 3.11 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -120.59 -1.88 10.02 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.337 0.589 . . . . 10.0 109.809 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 268' ' ' LYS . . . . . 0.57 ' HE3' ' OG1' ' A' ' 321' ' ' THR . 0.1 OUTLIER -141.95 145.57 34.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.372 -179.37 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 7.5 m -87.82 144.89 26.36 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.947 0.403 . . . . 10.0 110.413 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -88.84 5.67 42.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.178 0.513 . . . . 10.0 110.399 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -118.05 -65.3 1.19 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.681 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 272' ' ' VAL . . . . . 0.651 HG12 ' H ' ' A' ' 274' ' ' LEU . 58.4 t 70.89 -60.52 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.962 179.181 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 50.2 20.56 0.65 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.238 1.015 . . . . 10.0 112.982 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 274' ' ' LEU . . . . . 0.651 ' H ' HG12 ' A' ' 272' ' ' VAL . 83.4 mt 69.18 166.53 0.27 Allowed 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.598 0.759 . . . . 10.0 112.251 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 275' ' ' THR . . . . . 0.451 HG23 ' H ' ' A' ' 276' ' ' GLU . 0.0 OUTLIER -121.88 -72.26 0.69 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.148 -0.478 . . . . 10.0 112.046 -179.068 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 276' ' ' GLU . . . . . 0.451 ' H ' HG23 ' A' ' 275' ' ' THR . 0.7 OUTLIER 62.42 22.94 13.58 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.042 0.449 . . . . 10.0 111.499 -179.566 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -145.56 158.27 43.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.802 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 134.53 -52.05 0.82 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.199 -0.524 . . . . 10.0 111.887 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 279' ' ' LEU . 3.4 mm? 70.55 -58.58 0.55 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.691 0.796 . . . . 10.0 112.675 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 11.0 p -58.02 -24.11 22.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 N-CA-C 112.445 0.535 . . . . 10.0 112.445 -178.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 281' ' ' LEU . . . . . 0.45 HD13 ' OE2' ' A' ' 252' ' ' GLU . 0.1 OUTLIER -80.31 -44.27 19.83 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.079 0.4 . . . . 10.0 112.079 -179.028 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 282' ' ' ILE . . . . . 0.409 ' H ' HD12 ' A' ' 281' ' ' LEU . 34.9 pt -80.05 -4.38 7.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 112.398 0.518 . . . . 10.0 112.398 -178.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.98 -60.06 3.08 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.483 0.549 . . . . 10.0 112.483 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -100.49 5.44 44.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.017 0.437 . . . . 10.0 111.332 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 285' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 285' ' ' LEU . 0.3 OUTLIER -77.56 -39.87 44.35 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.866 -0.79 . . . . 10.0 108.866 178.967 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 16.5 mt -73.07 160.28 32.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.35 -0.841 . . . . 10.0 110.87 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 287' ' ' VAL . . . . . 0.418 HG12 ' N ' ' A' ' 288' ' ' LYS . 17.0 t 66.03 160.99 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.491 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 288' ' ' LYS . . . . . 0.418 ' N ' HG12 ' A' ' 287' ' ' VAL . 0.0 OUTLIER 76.98 138.56 0.07 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.846 0.858 . . . . 10.0 112.72 178.356 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 68.86 -58.55 0.49 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.713 -1.131 . . . . 10.0 112.842 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -81.38 -148.25 6.15 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.794 -0.717 . . . . 10.0 112.663 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 291' ' ' ILE . . . . . 0.523 ' O ' ' HB3' ' A' ' 292' ' ' MET . 18.3 tt -88.03 161.31 2.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 292' ' ' MET . . . . . 0.605 ' SD ' ' HB2' ' A' ' 296' ' ' GLU . 20.7 ttp 76.04 95.82 0.07 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.578 0.704 . . . . 10.0 110.981 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 11.2 p30 -109.88 3.23 20.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.439 -0.8 . . . . 10.0 109.468 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -85.11 -68.76 0.7 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.959 -1.018 . . . . 10.0 109.901 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 146.48 114.01 0.82 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.91 -0.662 . . . . 10.0 112.248 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 296' ' ' GLU . . . . . 0.605 ' HB2' ' SD ' ' A' ' 292' ' ' MET . 1.3 mm-40 -148.19 176.8 9.93 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 110.098 -0.334 . . . . 10.0 110.098 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.97 153.99 20.7 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.052 0.454 . . . . 10.0 111.453 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.3 tp -70.35 -29.36 66.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.238 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -89.75 19.77 4.51 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.278 0.473 . . . . 10.0 112.278 -178.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 62.7 m -80.63 137.79 51.11 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.6 -26.73 66.2 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.997 2.465 . . . . 10.0 113.104 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -71.63 -12.29 61.27 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.138 0.494 . . . . 10.0 110.961 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -106.65 94.08 4.93 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.57 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 304' ' ' ILE . . . . . 0.46 HG12 ' HB1' ' A' ' 781' ' ' ALA . 6.7 tp -127.47 -52.35 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.973 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -50.0 69.49 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 178.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.4 -42.12 99.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.8 178.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 307' ' ' MET . . . . . 0.511 ' O ' HG22 ' A' ' 310' ' ' VAL . 15.5 tpt -59.05 -50.53 73.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.498 -0.774 . . . . 10.0 111.096 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 308' ' ' HIS . . . . . 0.46 ' HE2' ' CG ' ' A' ' 351' ' ' ASP . 9.5 t60 -62.05 -21.15 64.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.482 -0.327 . . . . 10.0 111.176 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.67 -40.99 32.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.5 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 310' ' ' VAL . . . . . 0.52 HG12 HG21 ' A' ' 239' ' ' VAL . 7.1 m -72.01 -34.21 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 C-N-CA 121.074 -0.25 . . . . 10.0 110.737 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 2.2 m -64.17 -34.98 79.32 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.384 0.611 . . . . 10.0 109.961 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 312' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' A' ' 315' ' ' ARG . . . -68.77 -42.93 76.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.347 -0.842 . . . . 10.0 110.854 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 313' ' ' ALA . . . . . 0.436 ' HA ' ' HB1' ' A' ' 356' ' ' ALA . . . -65.67 -25.39 67.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.5 -179.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 34.7 tp -81.47 -44.22 17.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.074 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 315' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 312' ' ' ALA . 33.8 ptt180 -64.77 -24.45 67.56 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.793 0.33 . . . . 10.0 110.76 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -90.11 13.84 13.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.948 0.404 . . . . 10.0 110.676 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -123.67 -0.85 8.54 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.055 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -142.79 -62.9 0.42 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.679 0.276 . . . . 10.0 111.268 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.41 -57.94 9.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.745 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -85.27 112.81 21.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.943 0.402 . . . . 10.0 110.417 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 321' ' ' THR . . . . . 0.576 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 1.0 OUTLIER -104.17 138.78 40.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.277 -179.409 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 322' ' ' ARG . . . . . 0.562 ' HD3' ' OE1' ' A' ' 361' ' ' GLU . 7.0 tpt180 -62.0 141.29 58.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.846 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 323' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 0.7 OUTLIER 78.69 -45.35 0.39 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.991 0.916 . . . . 10.0 113.165 177.541 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 324' ' ' VAL . . . . . 0.576 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 7.1 p -83.99 -37.46 13.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.73 -0.388 . . . . 10.0 111.852 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 321' ' ' THR . 9.8 m-20 -95.53 -31.43 13.33 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 120.983 0.42 . . . . 10.0 110.869 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 53.8 p90 -151.83 142.09 22.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.706 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 327' ' ' ILE . . . . . 0.449 HG23 ' HB ' ' A' ' 334' ' ' ILE . 6.6 tp -115.8 124.18 71.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.057 -0.719 . . . . 10.0 109.057 178.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 49.8 t -102.26 119.6 50.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.19 -179.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 5.9 ptmm? -126.06 119.79 28.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.684 -0.689 . . . . 10.0 109.669 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 1.9 p30 48.93 29.14 2.22 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.145 0.978 . . . . 10.0 113.087 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 102.8 -23.04 35.08 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.743 -0.742 . . . . 10.0 112.857 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -77.81 114.31 16.55 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.953 0.406 . . . . 10.0 110.315 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 31.3 t -88.65 107.32 17.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.386 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 334' ' ' ILE . . . . . 0.449 ' HB ' HG23 ' A' ' 327' ' ' ILE . 68.3 mt -99.96 127.84 52.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.103 -0.499 . . . . 10.0 109.904 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 77.1 mt -78.51 132.86 31.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.699 0.285 . . . . 10.0 110.534 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 44.9 t -102.14 115.65 44.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.512 -0.551 . . . . 10.0 109.512 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -66.2 127.01 30.52 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.271 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 338' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 338' ' ' GLU . 17.4 tt0 -80.82 -7.65 59.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.71 -178.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 70.6 m80 -84.64 -60.8 1.95 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.27 -0.269 . . . . 10.0 111.717 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 30.1 p -111.89 3.72 17.77 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 65.93 41.35 95.43 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.602 -0.809 . . . . 10.0 112.079 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -101.53 138.44 38.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.899 0.38 . . . . 10.0 110.672 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -86.86 117.68 25.76 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.976 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 66.4 mtt -106.05 97.97 7.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.993 0.425 . . . . 10.0 110.223 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -89.54 -20.38 23.87 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.525 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -101.31 32.41 7.52 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.384 -0.687 . . . . 10.0 111.384 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -145.07 135.97 24.68 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.0 129.43 14.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.73 -0.214 . . . . 10.0 110.594 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 36.0 m95 -74.73 149.77 39.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.661 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.62 -161.26 0.82 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.579 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 351' ' ' ASP . . . . . 0.46 ' CG ' ' HE2' ' A' ' 308' ' ' HIS . 28.6 t70 64.4 10.11 5.46 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.364 0.602 . . . . 10.0 111.052 179.283 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 71.43 27.61 71.11 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.734 -0.746 . . . . 10.0 111.552 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.51 HD12 ' CZ ' ' A' ' 315' ' ' ARG . 4.2 tp -57.16 -41.98 80.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.817 0.341 . . . . 10.0 110.966 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 354' ' ' HIS . . . . . 0.479 ' CE1' HE22 ' A' ' 355' ' ' GLN . 13.6 p80 -98.58 -5.64 31.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 355' ' ' GLN . . . . . 0.479 HE22 ' CE1' ' A' ' 354' ' ' HIS . 1.4 mp0 -65.77 -38.91 90.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.441 0.638 . . . . 10.0 109.981 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 356' ' ' ALA . . . . . 0.436 ' HB1' ' HA ' ' A' ' 313' ' ' ALA . . . -70.33 -21.66 62.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.237 179.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 357' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 354' ' ' HIS . 33.7 t -73.23 -49.85 35.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.34 178.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.586 ' HA ' HG23 ' A' ' 363' ' ' VAL . 4.6 mt-10 -65.55 -26.15 67.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.432 -0.804 . . . . 10.0 110.671 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -80.35 -30.37 37.98 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.852 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -74.88 -47.7 28.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.602 -0.726 . . . . 10.0 111.074 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 361' ' ' GLU . . . . . 0.562 ' OE1' ' HD3' ' A' ' 322' ' ' ARG . 14.4 mt-10 -94.1 176.98 6.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.888 -179.34 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -84.01 75.2 2.4 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.084 -0.579 . . . . 10.0 112.861 -178.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 363' ' ' VAL . . . . . 0.586 HG23 ' HA ' ' A' ' 358' ' ' GLU . 0.0 OUTLIER -147.06 167.27 5.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 110.317 -0.253 . . . . 10.0 110.317 179.298 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.37 122.73 29.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.277 -0.42 . . . . 10.0 110.376 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 365' ' ' ILE . . . . . . . . . . . . . 53.4 mt -64.46 126.49 23.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.37 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -71.01 124.01 23.4 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.162 -0.472 . . . . 10.0 109.922 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -68.71 124.24 23.09 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.218 -179.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -79.66 154.86 28.35 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.483 ' O ' ' HB2' ' A' ' 370' ' ' GLN . 2.3 t-20 -127.69 -175.05 3.35 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 121.073 -0.251 . . . . 10.0 110.604 -179.349 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 370' ' ' GLN . . . . . 0.483 ' HB2' ' O ' ' A' ' 369' ' ' ASN . 43.5 mt-30 77.33 -175.1 0.1 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.396 0.678 . . . . 10.0 110.651 -179.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 3.0 m 73.64 93.86 0.08 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.006 -0.543 . . . . 10.0 112.21 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 372' ' ' LEU . . . . . 0.703 ' O ' ' HD2' ' A' ' 776' ' ' LYS . 0.4 OUTLIER -134.48 -69.24 0.53 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.838 178.751 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 373' ' ' ALA . . . . . 0.4 ' HB1' HD22 ' A' ' 187' ' ' LEU . . . -138.37 150.83 46.94 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.858 -0.423 . . . . 10.0 109.858 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 374' ' ' SER . . . . . 0.538 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 16.4 m -152.04 136.53 16.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.655 0.264 . . . . 10.0 111.161 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 17.2 tt -155.83 137.17 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.337 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.38 145.64 27.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.398 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 377' ' ' PHE . . . . . 0.436 ' HB2' ' O ' ' A' ' 218' ' ' GLU . 36.2 m-85 -57.53 -37.65 73.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.654 0.264 . . . . 10.0 110.657 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -57.32 -39.94 76.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.404 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -74.38 -39.16 62.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.024 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -63.68 -46.43 85.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.378 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -74.65 -16.78 60.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.831 0.308 . . . . 10.0 111.831 -179.16 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -80.7 -3.29 50.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.856 0.36 . . . . 10.0 110.539 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 60.7 mt -99.37 4.76 46.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.385 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.493 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 21.1 m-85 -99.79 143.68 29.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.147 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -79.27 -70.8 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.928 0.394 . . . . 10.0 110.526 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -89.13 91.92 8.99 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.627 -0.508 . . . . 10.0 109.627 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 54.5 tp -103.27 110.03 21.86 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.012 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -128.96 161.68 29.33 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.18 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.83 165.26 37.01 Favored Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.255 -0.974 . . . . 10.0 112.158 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 46.0 mtm -107.65 143.32 36.28 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.119 -0.326 . . . . 10.0 110.119 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 391' ' ' THR . . . . . 0.452 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 7.1 t -129.51 155.57 45.54 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -80.66 163.57 46.23 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.501 -0.856 . . . . 10.0 112.044 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.63 91.58 0.43 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.166 -0.309 . . . . 10.0 110.166 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 394' ' ' ALA . . . . . 0.602 ' HA ' HD22 ' A' ' 569' ' ' ASN . . . -151.58 -28.72 0.18 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.229 0.455 . . . . 10.0 112.229 -178.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 31.9 t70 58.83 -108.94 0.43 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 109.205 -0.665 . . . . 10.0 109.205 -178.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 6.7 m 58.81 -89.8 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.239 0.829 . . . . 10.0 113.239 177.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -88.76 22.75 2.53 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.003 0.371 . . . . 10.0 112.003 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -60.84 -35.19 75.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.044 0.449 . . . . 10.0 110.946 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -66.51 -20.05 65.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.487 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.64 -22.36 46.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.712 -0.222 . . . . 10.0 110.847 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -63.64 -46.69 84.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 10.0 110.556 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.36 -20.74 58.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.599 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 41.7 m -87.6 -42.5 12.66 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.328 0.492 . . . . 10.0 112.328 -178.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 56.4 mt -91.44 -61.56 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 N-CA-C 112.763 0.653 . . . . 10.0 112.763 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -88.11 -4.76 58.72 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt 60.48 44.42 11.95 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.788 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 407' ' ' LEU . . . . . 0.502 HD13 HD11 ' A' ' 99' ' ' ILE . 20.7 mt -109.8 141.4 42.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.828 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 408' ' ' ASP . . . . . 0.517 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 47.7 t0 -76.87 166.87 22.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 6.9 m -134.35 101.49 5.01 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.057 0.456 . . . . 10.0 111.149 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 62.0 t -106.84 133.53 51.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.068 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 23.6 t -87.15 126.08 40.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.509 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 54.2 t -86.69 128.46 56.43 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.385 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.96 146.35 82.38 Favored 'Trans proline' 0 N--CA 1.463 -0.292 0 C-N-CA 122.436 2.091 . . . . 10.0 112.095 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.75 145.4 45.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.873 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 415' ' ' ASN . . . . . 0.424 ' HB3' ' HG2' ' A' ' 578' ' ' GLN . 62.8 t30 -56.89 -38.03 72.21 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.268 0.556 . . . . 10.0 110.514 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 416' ' ' ARG . . . . . 0.437 ' HB2' ' O ' ' A' ' 578' ' ' GLN . 71.1 mtm180 -129.66 151.32 77.86 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.451 179.205 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -61.77 116.26 3.33 Favored 'Trans proline' 0 N--CA 1.465 -0.167 0 C-N-CA 122.6 2.2 . . . . 10.0 111.84 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 48.8 mtm -64.32 118.53 8.81 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.969 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 419' ' ' ILE . . . . . 0.437 HG13 ' HA ' ' A' ' 581' ' ' ALA . 6.4 pt -108.29 30.9 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.359 0.6 . . . . 10.0 110.348 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 420' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 420' ' ' ARG . 36.1 ttp180 -77.2 122.66 25.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.279 -0.873 . . . . 10.0 109.45 179.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 27.0 mmtp -88.76 101.47 14.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.996 0.427 . . . . 10.0 111.104 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -88.4 114.99 25.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.01 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 74.5 mt -94.32 156.09 39.14 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.493 -0.322 . . . . 10.0 110.542 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -65.94 170.28 11.88 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.694 2.263 . . . . 10.0 113.006 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -85.67 129.15 34.9 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.461 -0.791 . . . . 10.0 110.596 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.28 92.08 4.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.353 0.596 . . . . 10.0 110.189 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 427' ' ' VAL . . . . . 0.628 HG22 ' HB2' ' A' ' 588' ' ' LEU . 25.6 t -87.75 122.04 38.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.545 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 428' ' ' TYR . . . . . 0.424 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 2.5 m-85 -105.36 -176.71 3.16 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 429' ' ' MET . . . . . 0.426 ' HB2' ' OE2' ' A' ' 433' ' ' GLU . 12.8 mmt -78.09 -74.16 0.28 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.94 0.4 . . . . 10.0 111.342 -178.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 73.2 p -89.53 174.01 8.01 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.869 -178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -71.91 -36.04 69.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.39 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.63 -41.12 85.23 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.571 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 433' ' ' GLU . . . . . 0.426 ' OE2' ' HB2' ' A' ' 429' ' ' MET . 33.1 mt-10 -62.51 -45.38 93.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.143 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 434' ' ' LYS . . . . . 0.539 ' O ' HG13 ' A' ' 438' ' ' ILE . 38.7 ttpt -58.67 -50.46 73.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.706 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 435' ' ' ILE . . . . . 0.479 ' O ' HG12 ' A' ' 439' ' ' ILE . 49.7 mm -62.33 -43.48 98.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.905 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -59.6 -39.92 85.78 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.615 0.245 . . . . 10.0 110.886 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.35 87.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.338 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 438' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 434' ' ' LYS . 70.1 mt -65.53 -45.88 91.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.952 179.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 439' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 435' ' ' ILE . 50.2 mm -58.31 -40.48 78.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.893 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -63.96 -50.42 68.66 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.389 -0.368 . . . . 10.0 110.707 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -58.36 -42.06 86.1 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.127 0.489 . . . . 10.0 110.557 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.442 HG12 HG11 ' A' ' 452' ' ' VAL . 79.2 mt -67.26 -50.7 60.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.637 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -50.01 -49.31 51.21 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.372 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.431 ' O ' ' HD3' ' A' ' 448' ' ' LYS . 0.0 OUTLIER -56.74 -47.22 80.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.528 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 47.8 mtt-85 -74.34 -22.24 59.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.016 -0.538 . . . . 10.0 112.19 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 27.4 m -69.4 -39.46 77.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.175 0.512 . . . . 10.0 109.917 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -74.06 -34.17 63.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.943 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 448' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 444' ' ' GLU . 14.0 mptt -70.13 -58.57 3.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.143 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 127.88 35.9 0.5 Allowed Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.667 -0.778 . . . . 10.0 112.267 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -113.43 126.53 28.02 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 110.158 -0.312 . . . . 10.0 110.158 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.44 140.6 58.31 Favored 'Trans proline' 0 C--O 1.237 0.455 0 C-N-CA 122.524 2.149 . . . . 10.0 111.503 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.442 HG11 HG12 ' A' ' 442' ' ' ILE . 85.4 t -125.28 126.62 71.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.246 -178.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 37.6 tp -112.99 107.75 16.41 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.781 -0.645 . . . . 10.0 109.352 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 20.8 t -93.72 126.0 46.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.266 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -106.56 109.48 3.11 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.7 -0.762 . . . . 10.0 111.996 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 2.7 p -97.66 142.15 29.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.733 0.302 . . . . 10.0 110.72 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 30.3 pt -84.39 -20.76 8.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.789 0.328 . . . . 10.0 111.229 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 458' ' ' SER . . . . . 0.487 ' HB3' ' OE2' ' A' ' 460' ' ' GLU . 57.7 m -134.38 145.43 48.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.962 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 459' ' ' ILE . . . . . 0.407 HG12 HG21 ' A' ' 504' ' ' THR . 16.8 mt -62.93 -33.86 62.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.249 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.487 ' OE2' ' HB3' ' A' ' 458' ' ' SER . 2.7 mp0 -59.03 -35.73 73.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.343 -0.844 . . . . 10.0 111.143 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.61 -29.11 51.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.751 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 9.8 m -63.45 -41.21 98.63 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.342 0.591 . . . . 10.0 110.067 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -68.46 -30.58 69.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.488 -0.778 . . . . 10.0 110.656 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 57.0 tp -70.64 -53.81 14.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.828 -0.624 . . . . 10.0 111.144 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 14.6 p -63.51 -31.4 52.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 120.884 0.374 . . . . 10.0 110.836 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.9 t -66.3 -38.35 87.53 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.881 0.372 . . . . 10.0 110.021 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -61.67 -49.19 77.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.764 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -65.12 -40.49 94.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.329 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 27.0 mt -61.69 -34.94 76.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.939 0.399 . . . . 10.0 110.329 179.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 23.4 m -72.26 -33.55 67.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.162 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -67.39 -37.37 83.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.455 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -77.62 -23.73 49.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.141 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 87.41 33.78 11.26 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.948 -0.644 . . . . 10.0 111.844 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 78.3 mt -100.68 131.19 48.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.669 0.271 . . . . 10.0 110.828 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -63.05 124.64 21.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.116 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 50.2 p-80 -154.85 159.42 40.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.802 0.334 . . . . 10.0 111.216 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -141.37 132.77 26.73 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.166 178.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 478' ' ' VAL . . . . . 0.455 HG22 HD12 ' A' ' 502' ' ' ILE . 40.0 t -97.81 123.69 50.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.751 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.514 HD22 ' HG3' ' A' ' 487' ' ' GLU . 55.5 mt -81.36 146.48 30.31 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.419 -0.585 . . . . 10.0 109.419 179.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -157.78 135.78 10.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.124 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -60.04 -25.87 65.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.352 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -62.32 -33.44 74.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.231 0.539 . . . . 10.0 110.305 179.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -116.64 35.27 4.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.629 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -58.0 -24.86 59.94 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.289 -178.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -62.92 -42.97 99.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.928 0.395 . . . . 10.0 110.84 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -86.03 -28.24 24.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.956 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 487' ' ' GLU . . . . . 0.514 ' HG3' HD22 ' A' ' 479' ' ' LEU . 19.0 tt0 -55.42 -40.32 71.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.22 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -57.92 -29.11 64.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.942 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -84.03 -36.54 23.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.128 0.49 . . . . 10.0 110.418 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 53.9 mt -69.17 -45.93 78.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.095 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 71.9 t -61.09 -34.21 59.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.085 0.469 . . . . 10.0 110.946 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -65.91 -24.28 66.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.48 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 493' ' ' GLN . . . . . 0.474 ' NE2' ' H ' ' A' ' 518' ' ' SER . 53.7 mm-40 -115.44 16.84 16.63 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.826 0.346 . . . . 10.0 110.753 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.87 -12.97 61.85 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.402 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -89.19 7.69 81.53 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.781 -0.723 . . . . 10.0 112.211 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -69.84 141.53 89.91 Favored Pre-proline 0 C--N 1.328 -0.364 0 C-N-CA 122.319 0.248 . . . . 10.0 110.515 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -52.54 126.22 20.21 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.718 2.279 . . . . 10.0 113.04 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 67.92 24.92 7.88 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.487 -0.778 . . . . 10.0 112.57 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -94.88 110.28 22.18 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 10.0 110.261 178.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 38.6 t -92.16 109.71 21.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.106 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 1.2 m -116.4 130.16 56.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.799 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 502' ' ' ILE . . . . . 0.455 HD12 HG22 ' A' ' 478' ' ' VAL . 28.9 mt -105.6 115.26 47.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.042 -0.526 . . . . 10.0 109.734 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -103.67 111.3 23.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.907 0.384 . . . . 10.0 111.191 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 504' ' ' THR . . . . . 0.407 HG21 HG12 ' A' ' 459' ' ' ILE . 13.1 m -82.32 110.94 17.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.411 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 13.3 t30 62.79 91.61 0.07 Allowed 'General case' 0 N--CA 1.465 0.275 0 O-C-N 123.686 0.616 . . . . 10.0 111.0 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 1.3 mmt -75.05 113.8 12.8 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.762 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -64.95 168.71 6.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.98 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -58.98 142.11 46.63 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 121.165 -0.541 . . . . 10.0 113.026 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 69.26 -80.1 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.354 0.662 . . . . 10.0 111.502 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.17 143.42 11.4 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.732 -0.747 . . . . 10.0 112.165 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.81 147.02 35.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.905 0.383 . . . . 10.0 111.349 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -76.23 93.92 3.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.528 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 55.0 mt -69.55 121.85 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.482 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 7.4 t -90.27 133.52 31.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.671 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 61.2 mt -70.45 135.54 48.76 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.412 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 85.85 0.34 87.57 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.085 -0.579 . . . . 10.0 111.773 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 106.6 -170.0 15.83 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 110.784 -0.927 . . . . 10.0 110.784 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 518' ' ' SER . . . . . 0.474 ' H ' ' NE2' ' A' ' 493' ' ' GLN . 2.8 p -128.07 98.99 5.3 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 117.235 0.517 . . . . 10.0 110.918 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 33.2 p-90 -59.55 -28.47 67.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.076 0.465 . . . . 10.0 110.206 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -62.57 -32.26 73.22 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.646 -0.707 . . . . 10.0 110.681 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -85.12 -35.91 21.46 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.225 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -63.6 -45.56 89.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.899 -0.591 . . . . 10.0 111.013 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 33.8 m -70.74 -22.35 23.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.99 0.424 . . . . 10.0 110.806 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -81.13 -23.26 38.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.64 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -73.32 -21.83 60.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.532 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 91.7 mt -79.44 127.02 31.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.176 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -63.55 -33.76 76.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.299 0.571 . . . . 10.0 109.462 179.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -120.46 93.92 48.54 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 115.307 -0.861 . . . . 10.0 109.258 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -80.72 75.09 5.22 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.114 2.542 . . . . 10.0 111.956 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.97 144.6 55.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.598 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.97 -43.49 60.48 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.328 0.492 . . . . 10.0 112.328 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -59.8 -44.4 94.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.989 0.423 . . . . 10.0 110.949 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.08 -40.77 91.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.717 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 91.4 mt -60.92 -43.55 96.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -66.6 -41.86 87.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.319 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -62.04 -47.37 85.02 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.275 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 85.2 mt -66.29 -33.8 65.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.787 0.327 . . . . 10.0 110.544 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 31.4 ttmt -63.66 -49.81 71.73 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -66.37 -36.14 82.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.317 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 540' ' ' ASP . . . . . 0.6 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 19.7 t70 -62.9 -52.06 64.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.718 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 47.8 t90 -61.87 -37.96 86.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.866 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -50.98 -49.86 59.36 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.297 -0.41 . . . . 10.0 111.107 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 47.4 t -64.58 -45.1 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.994 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 544' ' ' ARG . . . . . 0.6 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 5.8 mtm180 -64.23 -35.79 81.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.936 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -68.94 -48.4 63.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.741 -0.663 . . . . 10.0 111.178 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -69.11 -26.01 64.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.626 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -65.46 -36.79 84.94 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.266 0.555 . . . . 10.0 109.576 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.2 -32.75 55.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.709 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 85.4 mt -61.84 -47.19 86.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.904 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -76.49 -18.9 58.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.737 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -75.4 -33.68 61.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.641 179.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 134.55 10.36 1.65 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.444 -0.884 . . . . 10.0 113.21 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 73.07 -168.28 53.74 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.859 -0.686 . . . . 10.0 112.672 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 40.9 tp -72.78 117.11 14.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.958 0.408 . . . . 10.0 110.078 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -92.7 113.79 26.16 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.011 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 10.9 mm -94.87 137.63 22.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.31 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 557' ' ' ILE . . . . . 0.486 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 23.7 mt -127.74 128.87 69.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.64 0.257 . . . . 10.0 110.343 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -106.8 120.25 6.18 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 111.404 -0.678 . . . . 10.0 111.404 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 17.3 p -74.71 -37.38 62.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.126 0.489 . . . . 10.0 110.907 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -138.61 140.76 39.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.081 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 561' ' ' ARG . . . . . 0.461 ' H ' HD21 ' A' ' 588' ' ' LEU . 23.4 mmt180 -82.81 141.39 32.34 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.74 151.15 23.64 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.9 -0.32 . . . . 10.0 110.377 -179.461 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -41.99 68.21 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 179.461 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 36.3 t -81.18 115.65 20.7 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.398 -0.819 . . . . 10.0 109.064 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -66.33 -27.87 68.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.657 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 566' ' ' ARG . . . . . 0.494 ' HA ' ' HB1' ' A' ' 394' ' ' ALA . 8.3 ttm180 -62.03 -37.09 83.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.064 0.459 . . . . 10.0 110.37 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 44.1 mt -88.71 -31.23 5.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.324 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -66.02 -44.77 83.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.185 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 569' ' ' ASN . . . . . 0.602 HD22 ' HA ' ' A' ' 394' ' ' ALA . 46.3 t30 -71.25 -23.64 62.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.885 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -63.2 -29.15 70.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.84 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 29.2 tp -72.1 -35.98 69.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.072 0.463 . . . . 10.0 110.167 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 572' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 572' ' ' ARG . 12.7 ttp180 -75.36 -31.09 60.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.256 0.55 . . . . 10.0 110.031 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -76.26 0.68 62.84 Favored Glycine 0 CA--C 1.519 0.303 0 CA-C-N 115.659 -0.701 . . . . 10.0 113.188 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.52 -33.35 72.68 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.794 0.33 . . . . 10.0 110.397 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 2.6 t -98.68 169.93 9.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.165 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 63.96 50.87 57.87 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.693 -0.765 . . . . 10.0 111.47 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 577' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' A' ' 580' ' ' ASP . 27.6 mtt180 -79.6 126.24 30.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.751 0.31 . . . . 10.0 110.996 -179.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 578' ' ' GLN . . . . . 0.601 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 7.4 tt0 56.76 32.6 21.51 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.626 -0.715 . . . . 10.0 110.746 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 78.18 43.08 14.06 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.797 -0.638 . . . . 10.0 112.651 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 580' ' ' ASP . . . . . 0.468 ' HB2' ' O ' ' A' ' 577' ' ' ARG . 0.9 OUTLIER -100.11 -170.3 1.86 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.714 0.292 . . . . 10.0 110.841 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 581' ' ' ALA . . . . . 0.437 ' HA ' HG13 ' A' ' 419' ' ' ILE . . . -83.89 172.37 12.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.114 -179.369 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 146.94 174.13 18.76 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.783 -0.723 . . . . 10.0 112.107 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 2.0 p -157.69 155.48 30.05 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.872 -0.418 . . . . 10.0 109.872 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 79.9 p -131.15 135.85 47.82 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.052 0.453 . . . . 10.0 110.578 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 585' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 1.6 tpm_? -139.29 116.97 11.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -108.47 148.02 30.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.99 0.424 . . . . 10.0 111.147 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 587' ' ' TYR . . . . . 0.535 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 84.4 m-85 -129.16 158.98 37.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.486 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 588' ' ' LEU . . . . . 0.628 ' HB2' HG22 ' A' ' 427' ' ' VAL . 13.2 mt -157.62 169.29 24.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.857 0.361 . . . . 10.0 110.922 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 589' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.7 OUTLIER -123.85 155.92 37.14 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.328 178.703 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 60.9 mmm -72.59 -15.22 61.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.292 0.568 . . . . 10.0 110.73 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 591' ' ' GLU . . . . . 0.41 ' H ' ' HG2' ' A' ' 591' ' ' GLU . 4.1 pt-20 -118.79 29.86 7.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.243 -0.89 . . . . 10.0 109.017 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 592' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 589' ' ' SER . 1.0 OUTLIER -82.25 176.96 9.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.188 -0.914 . . . . 10.0 111.798 -178.874 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.03 77.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.525 -0.761 . . . . 10.0 111.606 -179.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.556 ' O ' HG12 ' A' ' 597' ' ' ILE . 5.2 tp -68.69 -21.74 64.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.859 0.361 . . . . 10.0 110.945 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 13.1 mmt -77.27 9.58 3.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.416 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -106.16 -12.69 15.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.642 0.258 . . . . 10.0 110.542 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 594' ' ' LEU . 18.8 pt -88.33 -1.71 8.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.855 0.36 . . . . 10.0 111.375 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -82.29 -9.15 59.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.964 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 69.84 -59.63 0.5 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.99 0.806 . . . . 10.0 111.908 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.5 m -88.79 115.03 26.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.713 0.292 . . . . 10.0 110.864 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -64.06 -23.3 67.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.197 0.522 . . . . 10.0 110.538 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 3.0 mmt180 -59.01 -24.48 62.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.481 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 76.4 t -68.17 -49.68 65.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 1.4 m -65.27 -36.94 85.66 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.551 -0.75 . . . . 10.0 110.0 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -63.47 -39.11 97.34 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.01 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 61.1 tpp -74.52 -27.92 60.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.121 0.486 . . . . 10.0 110.619 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 39.7 mtt -74.29 -18.94 60.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.347 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 74.5 mtt-85 -77.5 6.11 7.68 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.053 0.454 . . . . 10.0 110.704 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -94.76 2.58 55.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.859 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 77.1 mt -80.93 -9.79 59.79 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.343 -0.389 . . . . 10.0 111.037 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 611' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 83.85 -50.84 4.47 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.914 -0.66 . . . . 10.0 111.934 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 612' ' ' MET . . . . . 0.442 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.7 OUTLIER 73.66 -61.07 0.51 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.834 0.853 . . . . 10.0 111.847 179.145 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? 62.85 93.17 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.301 0 O-C-N 123.536 0.523 . . . . 10.0 110.603 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 614' ' ' PRO . . . . . 0.424 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 38.2 Cg_exo -57.09 94.94 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.136 2.558 . . . . 10.0 112.269 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 142.85 -29.47 2.1 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.831 -0.699 . . . . 10.0 111.916 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.59 140.66 37.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.943 0.402 . . . . 10.0 110.981 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -95.72 114.15 25.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.071 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.08 -37.62 78.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.795 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 51.78 74.67 0.25 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.763 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.97 105.23 20.39 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 120.86 0.362 . . . . 10.0 110.726 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.91 -21.27 25.67 Favored 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.659 2.906 . . . . 10.0 114.585 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 9.5 p-90 -60.43 -29.3 68.91 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 120.662 -0.415 . . . . 10.0 110.493 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 60.3 t -65.54 -48.85 81.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 85.1 m -61.36 -37.97 85.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.408 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -64.67 -42.47 95.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.122 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.09 94.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.641 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.1 -50.44 76.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.447 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -62.76 -35.73 80.76 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.116 0.484 . . . . 10.0 110.797 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 629' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' A' ' 633' ' ' LYS . 63.2 t30 -65.85 -44.56 85.12 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.849 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -67.15 -42.11 84.91 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.08 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -58.64 -40.54 83.68 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.379 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -61.57 -38.45 87.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.377 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 633' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 629' ' ' ASN . 26.1 mmtp -65.37 -37.79 88.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.166 -179.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 53.7 t -62.34 -47.1 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.081 0.467 . . . . 10.0 110.36 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -69.24 -35.78 76.48 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.67 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 49.1 m -64.63 -36.51 84.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.019 0.438 . . . . 10.0 110.04 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -67.89 -31.92 72.05 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -66.95 -38.14 85.58 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -65.02 -37.14 86.67 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.006 -0.543 . . . . 10.0 109.735 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 640' ' ' ASP . . . . . 0.633 ' O ' ' HG2' ' A' ' 644' ' ' GLN . 25.6 t0 -60.54 -35.84 76.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.636 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 59.1 mt -80.02 -38.57 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.325 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 642' ' ' ARG . . . . . 0.474 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 14.0 mtm-85 -61.71 -43.14 99.42 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.648 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 643' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 12.1 pttm -66.0 -26.88 67.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.868 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 644' ' ' GLN . . . . . 0.633 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 16.2 mm100 -65.03 -45.75 84.18 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 48.5 mt -65.63 -41.7 92.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.039 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 646' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 90.7 mt -63.5 -29.63 70.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.372 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.69 -28.32 69.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.078 0.465 . . . . 10.0 110.738 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -96.84 -28.28 14.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.621 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -75.38 -34.64 61.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.184 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 650' ' ' ASP . . . . . 0.505 ' O ' ' HB3' ' A' ' 653' ' ' ASN . 2.6 t0 -66.36 -23.51 66.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.13 0.49 . . . . 10.0 110.512 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 36.2 t -67.2 -42.01 87.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.319 0.58 . . . . 10.0 109.466 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -73.71 -22.5 59.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.473 -0.785 . . . . 10.0 109.912 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 653' ' ' ASN . . . . . 0.505 ' HB3' ' O ' ' A' ' 650' ' ' ASP . 18.1 t30 -61.39 -48.95 78.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.441 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -62.09 -46.85 87.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.62 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -62.67 -45.48 92.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.781 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 656' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 656' ' ' ARG . 11.2 ttp-105 -63.57 -40.76 97.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.332 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 30.9 ttp85 -61.74 -50.49 72.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.64 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -62.02 -49.08 77.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.732 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 659' ' ' ILE . . . . . 0.444 ' O ' ' HB2' ' A' ' 663' ' ' ARG . 8.7 tp -66.1 -34.52 70.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 116.628 -0.26 . . . . 10.0 111.6 -178.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -69.84 -34.21 73.33 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.731 0.301 . . . . 10.0 110.266 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.3 m -63.0 -54.26 41.05 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.112 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -62.12 -39.2 91.74 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.688 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 659' ' ' ILE . 2.2 tmt_? -60.44 -34.07 73.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.621 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -83.36 -37.75 22.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.714 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 665' ' ' GLU . . . . . 0.443 ' O ' HG22 ' A' ' 669' ' ' VAL . 35.3 mt-10 -57.86 -48.44 79.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.418 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 45.7 mt -72.21 -14.72 61.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.21 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 34.9 tp -86.16 -44.38 12.25 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.492 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -68.1 -53.94 21.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.898 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 665' ' ' GLU . 29.4 m -59.99 150.9 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 112.26 0.467 . . . . 10.0 112.26 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.57 -50.6 5.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.482 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -83.48 150.37 26.05 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.238 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 672' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 676' ' ' ILE . 6.6 p -141.07 8.74 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.051 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 15.4 m -49.84 -49.28 49.62 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.681 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.94 -51.85 67.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.767 -178.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 675' ' ' THR . . . . . 0.488 ' O ' HG12 ' A' ' 679' ' ' ILE . 2.0 m -60.48 -50.49 73.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.158 -0.474 . . . . 10.0 112.084 -179.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 676' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 672' ' ' VAL . 14.1 mm -62.13 -38.59 81.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 121.152 -0.219 . . . . 10.0 111.518 -178.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -68.36 -42.77 78.72 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.167 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 45.0 m -58.09 -44.03 87.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.911 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 679' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 675' ' ' THR . 24.3 pt -79.6 -24.71 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.953 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 18.8 mtm-85 -61.32 -50.45 72.91 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.147 0.499 . . . . 10.0 110.059 178.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.98 -35.4 74.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.377 -0.829 . . . . 10.0 110.692 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -66.03 -47.21 75.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.639 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 44.5 t -61.9 -45.75 98.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.189 -0.459 . . . . 10.0 111.444 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -59.78 -42.68 93.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.585 -0.28 . . . . 10.0 110.618 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -62.47 -46.01 90.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.09 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.59 99.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.472 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 21.0 m -65.22 -45.92 82.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.695 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.98 -39.32 85.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 10.0 110.253 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.31 -28.1 62.76 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.788 -0.642 . . . . 10.0 112.111 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -70.26 -22.9 62.83 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.479 0.548 . . . . 10.0 112.479 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -119.86 -19.33 7.97 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.704 0.288 . . . . 10.0 111.544 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 692' ' ' ILE . . . . . 0.425 HG23 ' CD1' ' A' ' 701' ' ' TRP . 42.8 mt -128.82 103.67 19.0 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.908 179.207 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -67.45 139.39 49.16 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.675 2.25 . . . . 10.0 111.745 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -50.23 106.27 0.12 Allowed 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.05 2.5 . . . . 10.0 113.215 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 61.7 86.99 0.1 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.478 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 2.3 p -142.9 -165.86 2.16 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.193 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 62.4 mt -99.17 161.79 13.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.465 0.174 . . . . 10.0 110.945 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 698' ' ' GLU . . . . . 0.543 ' HA ' ' CE3' ' A' ' 701' ' ' TRP . 15.0 tt0 -58.07 -31.27 66.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.314 -179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -66.13 -24.14 66.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.179 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 54.9 mtp -95.57 4.57 53.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.389 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 701' ' ' TRP . . . . . 0.543 ' CE3' ' HA ' ' A' ' 698' ' ' GLU . 50.2 m0 -103.2 111.88 24.48 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.733 0.301 . . . . 10.0 111.297 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -81.91 78.59 8.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.75 -0.833 . . . . 10.0 108.75 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 703' ' ' ILE . . . . . 0.557 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 44.5 mm -56.39 -51.9 77.35 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.243 -0.889 . . . . 10.0 111.951 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 704' ' ' PRO . . . . . 0.557 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 35.9 Cg_exo -60.65 -44.33 27.14 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.679 1.586 . . . . 10.0 111.836 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -61.1 -39.2 96.79 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.947 -0.644 . . . . 10.0 112.744 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 64.1 tp -78.1 -45.17 24.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.655 0.264 . . . . 10.0 111.392 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -59.67 -49.68 76.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.277 -0.42 . . . . 10.0 111.017 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -65.98 -30.3 70.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.88 0.372 . . . . 10.0 110.291 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 709' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 709' ' ' ARG . 5.2 tpt180 -62.74 -49.69 74.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.164 179.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 710' ' ' LEU . . . . . 0.411 HD12 HD11 ' A' ' 720' ' ' ILE . 65.3 mt -67.23 -29.25 68.84 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.007 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 711' ' ' LYS . . . . . 0.408 ' HG2' ' HA ' ' A' ' 717' ' ' ASP . 20.1 mtpp -78.13 -18.15 56.0 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.402 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -108.09 -53.3 2.65 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.1 -35.96 69.34 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.665 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -105.87 -12.57 15.8 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 121.061 -0.256 . . . . 10.0 111.348 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.43 24.08 13.98 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.887 -0.597 . . . . 10.0 112.261 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 23.7 tp -113.7 126.95 55.81 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.689 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 717' ' ' ASP . . . . . 0.408 ' HA ' ' HG2' ' A' ' 711' ' ' LYS . 1.5 t0 -81.03 100.71 9.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.792 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.417 HD13 HG23 ' A' ' 739' ' ' ILE . 95.3 mt -113.57 114.15 47.58 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.432 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.69 66.57 8.05 Favored 'Trans proline' 0 CA--C 1.536 0.575 0 C-N-CA 122.93 2.42 . . . . 10.0 112.665 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 720' ' ' ILE . . . . . 0.411 HD11 HD12 ' A' ' 710' ' ' LEU . 68.0 mt -60.5 -46.83 94.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.65 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -64.0 -31.19 72.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.918 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -69.87 -40.88 75.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.566 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 45.0 m0 -66.86 -54.14 25.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.672 -0.694 . . . . 10.0 111.477 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 16.9 tp -63.01 -18.57 63.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 10.0 112.144 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -77.88 -37.39 48.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.48 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -102.21 -25.97 13.5 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.131 0.419 . . . . 10.0 112.131 -178.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -122.11 78.58 42.73 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 121.01 0.433 . . . . 10.0 110.222 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -72.49 -9.05 23.61 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.845 2.363 . . . . 10.0 112.564 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -78.55 -10.84 59.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.836 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 93.4 mt -69.64 -29.37 66.83 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.222 0.534 . . . . 10.0 109.829 178.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 51.53 -95.64 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.624 -1.171 . . . . 10.0 112.147 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -56.01 0.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.611 0.243 . . . . 10.0 111.526 -178.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -56.38 -54.34 46.78 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.797 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.46 -27.22 68.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.027 0.441 . . . . 10.0 110.756 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 25.3 tp -67.39 -43.49 81.19 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 33.7 mtt180 -61.65 -40.23 94.16 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.996 -0.547 . . . . 10.0 109.642 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -60.28 -45.51 93.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.379 -0.828 . . . . 10.0 110.687 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 23.1 mmm-85 -61.08 -45.43 94.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.807 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 739' ' ' ILE . . . . . 0.417 HG23 HD13 ' A' ' 718' ' ' LEU . 97.0 mt -60.99 -52.78 57.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.707 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 21.1 tp -58.25 -46.33 86.16 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.789 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.61 99.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.376 -0.374 . . . . 10.0 111.181 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -62.98 -42.2 99.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.314 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.14 -41.71 98.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.701 0.286 . . . . 10.0 110.797 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 82.3 mt -67.05 -43.18 89.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.84 0.352 . . . . 10.0 110.232 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.97 -44.9 83.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.868 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 85.0 t -70.4 -40.22 77.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.716 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -59.19 -41.45 88.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.795 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -60.48 -31.54 70.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.439 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 749' ' ' ARG . . . . . 0.479 ' O ' HG23 ' A' ' 753' ' ' VAL . 0.1 OUTLIER -66.23 -45.8 79.41 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 179.16 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -64.77 -37.79 88.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.719 -0.673 . . . . 10.0 109.516 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.516 ' HA ' ' HG3' ' A' ' 759' ' ' MET . 27.1 tt0 -62.57 -41.78 99.15 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.17 -0.923 . . . . 10.0 110.963 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -63.22 -41.08 99.08 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.511 -0.313 . . . . 10.0 111.4 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 753' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 749' ' ' ARG . 39.6 t -67.22 -47.17 82.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.272 -0.422 . . . . 10.0 112.021 -179.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 39.7 t -77.26 -42.06 30.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.207 0.527 . . . . 10.0 111.106 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 120.51 122.55 2.96 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 110.527 -1.029 . . . . 10.0 110.527 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 756' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -51.01 -46.03 61.39 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.163 0.431 . . . . 10.0 112.163 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.61 -46.15 91.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.984 0.421 . . . . 10.0 110.949 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 15.6 tpt -66.62 -39.66 88.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.283 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 759' ' ' MET . . . . . 0.516 ' HG3' ' HA ' ' A' ' 751' ' ' GLU . 80.9 mmm -61.79 -41.24 97.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.211 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.9 mmp_? -60.29 -39.0 85.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.236 0.541 . . . . 10.0 110.119 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -73.2 -34.83 66.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.802 -0.635 . . . . 10.0 109.644 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 762' ' ' PHE . . . . . 0.415 ' O ' HG23 ' A' ' 766' ' ' VAL . 45.5 t80 -66.86 -48.21 69.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.318 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -57.19 -46.06 83.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.082 0.467 . . . . 10.0 110.294 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -60.73 -42.57 97.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.082 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -64.72 -43.3 96.5 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 111.408 -0.677 . . . . 10.0 111.408 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 766' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 762' ' ' PHE . 63.8 t -60.74 -43.23 94.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 11.9 mtp -60.96 -48.2 82.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.085 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 80.9 mt -60.55 -46.64 89.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.704 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -60.88 -52.68 64.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.361 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 9.4 m -60.2 -44.26 95.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.847 0.356 . . . . 10.0 111.358 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -64.32 -42.62 96.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.238 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 772' ' ' ASP . . . . . 0.621 ' O ' ' HG2' ' A' ' 776' ' ' LYS . 15.7 t70 -61.97 -51.27 68.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.806 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 773' ' ' SER . . . . . 0.549 ' HA ' ' HB3' ' B' ' 22' ' ' MET . 68.5 m -59.12 -44.48 92.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.079 -0.51 . . . . 10.0 112.371 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 23.5 mt -66.53 -35.02 79.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.712 0.291 . . . . 10.0 111.113 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -64.38 -37.6 88.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.991 0.424 . . . . 10.0 110.009 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.703 ' HD2' ' O ' ' A' ' 372' ' ' LEU . 26.6 mmtp -66.63 -41.32 88.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.398 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -63.02 -48.25 79.59 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 778' ' ' HIS . . . . . 0.608 ' O ' ' HG2' ' A' ' 782' ' ' MET . 72.0 t60 -58.78 -35.97 73.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.034 -0.984 . . . . 10.0 111.199 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 21.3 mt -59.55 -47.92 83.66 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.872 0.368 . . . . 10.0 110.306 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -69.51 -38.61 77.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.165 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 781' ' ' ALA . . . . . 0.46 ' HB1' HG12 ' A' ' 304' ' ' ILE . . . -59.32 -36.03 74.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.412 -0.813 . . . . 10.0 111.192 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 782' ' ' MET . . . . . 0.608 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 98.6 mmm -60.56 -41.16 94.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.048 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.93 -41.67 70.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 10.0 110.096 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -62.15 -42.01 98.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.286 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 785' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 789' ' ' ILE . 11.6 tp -67.94 -39.34 83.46 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.154 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -55.12 -36.53 65.83 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.721 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -76.19 -36.86 58.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.535 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -70.65 -16.27 73.96 Favored Glycine 0 N--CA 1.452 -0.24 0 CA-C-N 115.748 -0.66 . . . . 10.0 112.956 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 789' ' ' ILE . . . . . 0.519 HG12 ' O ' ' A' ' 785' ' ' LEU . 38.6 mm -58.97 -22.78 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 CA-C-O 121.128 0.489 . . . . 10.0 110.97 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 16.6 m80 -65.23 -21.24 66.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.695 179.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' A' ' 274' ' ' LEU . 73.7 mt -110.42 -35.54 6.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.495 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 3.7 mmt85 -65.4 -37.86 88.22 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.458 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -86.93 72.31 2.62 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.854 -0.688 . . . . 10.0 111.4 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 23.8 p90 -69.6 177.5 2.94 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.958 0.408 . . . . 10.0 111.175 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 795' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' A' ' 796' ' ' GLN . . . -60.11 149.71 31.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.7 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 796' ' ' GLN . . . . . 0.42 ' HB2' ' O ' ' A' ' 795' ' ' ALA . 11.8 mm100 72.24 16.72 5.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.299 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -139.01 147.09 41.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.064 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 798' ' ' ASP . . . . . 0.401 ' OD2' ' HB2' ' A' ' 800' ' ' LYS . 27.2 t70 -91.73 114.21 61.2 Favored Pre-proline 0 C--N 1.324 -0.531 0 C-N-CA 121.087 -0.245 . . . . 10.0 110.574 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -53.17 -31.25 54.35 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.15 2.567 . . . . 10.0 113.131 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 800' ' ' LYS . . . . . 0.401 ' HB2' ' OD2' ' A' ' 798' ' ' ASP . 28.1 mtmm -66.26 -55.23 17.15 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -63.64 -38.6 91.74 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.677 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.7 -48.39 82.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.04 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -59.91 -40.64 89.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.406 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -62.83 -47.81 81.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.792 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 37.0 ttp85 -62.44 -44.55 96.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.68 0.276 . . . . 10.0 111.002 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -58.5 -52.78 64.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.261 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 11.5 p -65.28 -39.56 92.74 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.297 0.481 . . . . 10.0 112.297 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -65.99 -44.68 84.14 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 121.032 -0.267 . . . . 10.0 110.89 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 17.5 m -65.71 -38.26 88.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.167 0.508 . . . . 10.0 110.102 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 35.0 ttm -63.85 -35.32 80.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.197 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -65.97 -38.9 89.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.271 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.88 92.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.353 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.46 73.86 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.468 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 17.7 ttp -64.53 -42.87 95.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.823 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 815' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 818' ' ' LEU . 81.0 mt -66.07 -36.27 82.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.414 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -64.57 -38.05 89.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.227 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 13.0 m -73.51 -30.14 62.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.105 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 818' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 815' ' ' LEU . 14.1 tp -58.77 -61.64 2.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.134 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 819' ' ' LYS . . . . . 0.415 ' O ' HG12 ' A' ' 823' ' ' ILE . 44.0 pttt -60.01 -36.24 76.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.011 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -60.08 -57.41 12.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.196 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -63.74 -37.67 88.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.836 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 41.1 t -57.91 -51.85 65.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.891 0.377 . . . . 10.0 110.71 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 823' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 819' ' ' LYS . 30.4 mm -68.22 -37.92 78.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.647 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 46.4 t -60.01 -48.42 81.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.169 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 24.6 m -60.43 -40.61 91.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.494 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 96.0 mt -69.65 -23.03 63.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.275 -0.421 . . . . 10.0 111.812 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 7.5 m -93.4 -36.42 12.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.801 0.334 . . . . 10.0 110.481 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 51.2 mttm -67.5 -28.3 67.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.783 -0.644 . . . . 10.0 112.133 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 6.6 p -65.51 112.13 1.68 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 121.573 0.701 . . . . 10.0 109.842 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -94.97 117.59 30.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.188 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 12.1 t -110.28 141.5 25.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.559 -0.746 . . . . 10.0 109.214 179.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.85 114.62 1.48 Allowed 'General case' 0 C--N 1.33 -0.249 0 O-C-N 123.636 0.585 . . . . 10.0 110.639 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 77.8 mtp -102.36 113.99 65.62 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.633 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.36 161.69 44.82 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 122.591 2.194 . . . . 10.0 112.074 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -69.07 113.73 6.71 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.07 179.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 . . . . . 0 C--O 1.245 0.858 0 CA-C-O 118.666 -0.683 . . . . 10.0 110.774 -179.437 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 110.32 -0.252 . . . . 10.0 110.32 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -65.55 127.24 31.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.209 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 pt -72.94 94.79 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.503 0.668 . . . . 10.0 110.987 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.65 27.48 0.97 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.086 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 88.5 mt -77.37 71.45 3.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.638 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -154.67 123.28 6.12 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.461 -0.79 . . . . 10.0 109.739 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 ttpt -58.82 112.64 1.71 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.962 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -103.52 70.54 1.04 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.961 0.41 . . . . 10.0 111.599 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.46 ' HA ' ' HE ' ' B' ' 9' ' ' ARG . 0.0 OUTLIER -156.49 129.01 7.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.832 -0.622 . . . . 10.0 109.533 178.782 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -60.47 134.49 57.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.741 -0.663 . . . . 10.0 112.575 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 61.0 tp -96.27 109.94 49.93 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.422 178.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -61.14 -25.59 81.26 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.008 2.472 . . . . 10.0 112.626 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.453 HD21 ' HB3' ' A' ' 234' ' ' GLU . 62.7 tp -60.08 -27.15 66.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.973 -0.558 . . . . 10.0 111.628 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' ALA . . . . . 0.435 ' HB3' ' HB ' ' A' ' 291' ' ' ILE . . . -66.59 -46.33 76.33 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -74.14 -27.48 22.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.758 0.313 . . . . 10.0 110.847 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.34 -26.85 68.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.098 0.475 . . . . 10.0 110.429 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 13' ' ' LEU . 95.3 t -81.24 -39.77 17.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.073 178.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.13 -48.66 80.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.557 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.59 -1.28 45.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.812 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -86.44 4.86 85.72 Favored Glycine 0 N--CA 1.45 -0.407 0 CA-C-N 116.063 -0.517 . . . . 10.0 112.977 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 87.5 t -63.33 -29.71 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.476 0.655 . . . . 10.0 110.277 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.549 ' HB3' ' HA ' ' A' ' 773' ' ' SER . 17.0 tpt -114.5 92.53 3.99 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.511 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 1.1 m -71.36 143.83 50.08 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.345 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.62 -8.55 59.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.068 0.461 . . . . 10.0 110.626 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -85.41 90.93 8.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.355 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.17 131.01 55.47 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.401 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -98.6 12.22 35.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.548 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.364 -0.827 . . . . 10.0 111.014 -179.75 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.48 1.032 0 CA-C-O 120.878 0.371 . . . . 10.0 110.441 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -90.39 140.33 29.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.569 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.41 176.0 14.22 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.899 -0.667 . . . . 10.0 112.541 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.5 127.72 32.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.946 0.403 . . . . 10.0 110.506 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.581 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 8.7 mmt180 -70.22 144.52 51.86 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.62 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 73.35 -63.13 0.44 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.097 -0.956 . . . . 10.0 112.059 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.94 -54.47 21.67 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -178.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -86.31 -25.86 25.22 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.966 0.728 . . . . 10.0 112.966 -178.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.0 p -60.61 -46.68 89.37 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.72 -0.392 . . . . 10.0 110.685 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.2 mt -64.46 -31.79 73.15 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.784 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -67.62 -45.78 74.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.072 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -67.4 -44.17 79.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.51 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 39.6 mtt -63.55 -34.04 76.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.88 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.5 tpp180 -61.32 -35.7 78.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.944 0.402 . . . . 10.0 110.304 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -65.52 -39.8 92.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.808 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -69.04 -39.45 79.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.915 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.42 HG13 HD12 ' A' ' 88' ' ' LEU . 52.7 t -58.33 -37.51 63.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 121.277 0.56 . . . . 10.0 109.935 178.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -65.45 -38.74 90.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.334 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 72.1 mt -66.64 -45.02 89.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.075 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.5 mt -59.33 -41.76 85.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.642 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -67.55 -27.69 67.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.074 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.25 -26.66 30.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.064 0.459 . . . . 10.0 110.597 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 8.6 tpt -83.95 -18.72 36.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.629 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.493 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 37.2 tt0 -56.98 -52.01 77.32 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.304 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.493 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 71.5 Cg_exo -53.47 -33.41 67.37 Favored 'Trans proline' 0 C--N 1.36 1.159 0 C-N-CA 121.927 1.751 . . . . 10.0 112.178 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -70.52 -40.31 73.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.168 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.3 mmt -66.59 -29.83 69.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.579 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -66.14 -23.09 66.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.562 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.0 mtpt -83.32 -24.2 32.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.046 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp -76.92 142.19 40.2 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.542 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.7 p -82.48 171.12 14.48 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.041 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -57.03 -38.78 73.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.312 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -68.43 -36.33 78.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.904 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.9 -32.11 70.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.285 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.98 -45.4 94.93 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -67.44 -31.45 71.63 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.951 -1.022 . . . . 10.0 109.725 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.81 -37.59 95.11 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.56 -0.746 . . . . 10.0 111.736 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -67.28 -36.26 81.18 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.724 -0.472 . . . . 10.0 109.724 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 19.1 m -58.18 -48.16 81.16 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.162 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.54 -35.25 80.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.342 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.18 -43.2 99.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.553 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -58.79 -43.06 90.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.738 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.7 mtp180 -61.81 -44.23 97.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.656 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' A' ' 56' ' ' LYS . . . -66.67 -39.41 88.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.267 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 -62.83 -39.29 93.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.555 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 mt -58.09 -37.36 74.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.317 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.15 -37.14 72.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.321 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 52' ' ' ALA . 28.4 mtpp -72.72 -9.19 58.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.958 -0.565 . . . . 10.0 111.204 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.67 61.67 0.66 Allowed Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.757 -0.735 . . . . 10.0 111.983 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -116.91 146.1 43.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.718 -0.475 . . . . 10.0 109.718 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 38.2 t -85.84 133.18 30.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.182 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.417 HD11 ' O ' ' A' ' 118' ' ' LEU . 17.8 tp -61.09 -43.89 98.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.918 0.389 . . . . 10.0 110.464 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -65.83 -21.54 66.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.17 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -81.23 -17.36 49.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.243 0.544 . . . . 10.0 110.151 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.1 mt -84.65 -13.29 51.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.079 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.51 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 73.9 mt -50.23 -52.55 52.91 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 113.054 0.761 . . . . 10.0 113.054 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.51 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.0 Cg_exo -53.46 -34.77 73.35 Favored 'Trans proline' 0 C--N 1.36 1.151 0 C-N-CA 122.362 2.041 . . . . 10.0 113.444 -179.355 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.471 ' O ' HG23 ' A' ' 70' ' ' VAL . 38.4 mt-10 -89.58 -46.59 8.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.46 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.482 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -58.8 -47.92 83.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.996 -178.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -63.33 -32.34 73.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.675 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.91 -43.63 78.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.257 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 66' ' ' GLU . 58.3 t -61.08 -47.72 92.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.107 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 67' ' ' ALA . 46.7 t -59.5 -45.21 94.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.34 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.431 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 19.0 ttm180 -61.0 -44.86 96.8 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.604 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 29.1 tp10 -61.05 -48.4 81.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.376 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.99 -33.27 74.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.079 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 29.8 m -61.04 -35.89 78.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.746 0.307 . . . . 10.0 111.059 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -75.06 -16.89 60.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.296 -0.411 . . . . 10.0 112.028 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -104.24 -35.83 7.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.762 0.315 . . . . 10.0 111.518 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 92.8 t -81.41 -52.52 13.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.614 -0.266 . . . . 10.0 111.64 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -104.22 -14.05 15.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.656 0.265 . . . . 10.0 111.562 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.22 29.09 66.96 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.714 -0.755 . . . . 10.0 111.552 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.5 mtt -126.49 141.23 51.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.799 0.333 . . . . 10.0 110.791 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 37.0 ttt85 -85.59 122.67 30.03 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.95 111.06 1.52 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -47.23 141.12 4.76 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 124.139 0.9 . . . . 10.0 112.307 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -64.17 -34.42 78.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.338 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 m -69.58 -25.19 28.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.847 0.355 . . . . 10.0 110.839 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -71.67 -28.4 63.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.826 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.42 HD12 HG13 ' A' ' 25' ' ' VAL . 85.2 mt -62.03 -36.78 82.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.055 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 36.0 mt -66.15 -47.88 72.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.826 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -63.14 -36.45 93.46 Favored Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.712 -0.677 . . . . 10.0 112.164 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.76 -34.57 89.12 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.195 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.416 ' HG3' ' O ' ' A' ' 88' ' ' LEU . 38.4 mtt -74.21 -35.87 63.93 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.2 t -65.47 -43.05 94.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 10.0 110.02 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 84.3 mt -72.92 -5.35 37.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.268 -0.878 . . . . 10.0 111.966 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -83.29 -24.67 32.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.892 0.377 . . . . 10.0 110.383 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -103.37 -146.33 0.37 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.585 -179.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 97' ' ' ARG . 28.7 ttt85 -108.07 58.98 0.61 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.168 0.509 . . . . 10.0 110.189 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 408' ' ' ASP . 0.0 OUTLIER -137.57 150.19 47.28 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.335 0.588 . . . . 10.0 111.981 -178.862 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.552 HD12 HG11 ' A' ' 211' ' ' VAL . 50.7 mm -93.46 132.55 37.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.373 -0.831 . . . . 10.0 108.881 178.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -107.6 120.11 41.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.735 0.302 . . . . 10.0 111.703 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -85.47 125.68 33.22 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.4 mtm -122.48 140.6 52.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.076 0.465 . . . . 10.0 110.886 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.497 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 11.5 mmm180 -77.1 152.19 35.08 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.563 -0.744 . . . . 10.0 111.082 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.65 94.68 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.9 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.2 -33.48 1.23 Allowed Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.824 -0.703 . . . . 10.0 112.353 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.623 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 2.2 mm-40 -65.56 -49.42 68.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.013 0.435 . . . . 10.0 110.292 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 143.79 168.03 12.08 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.753 -0.737 . . . . 10.0 112.085 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.97 -82.63 0.65 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.93 0.395 . . . . 10.0 110.461 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.03 -20.86 66.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.166 0.508 . . . . 10.0 111.117 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 27.7 tp -70.02 -19.96 63.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.252 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 3.2 m -95.72 -36.6 11.13 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.194 0.521 . . . . 10.0 110.654 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.624 ' HB1' HD21 ' A' ' 207' ' ' LEU . . . -75.98 -4.66 42.35 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.863 0.69 . . . . 10.0 112.863 -178.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.06 -24.28 61.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.947 0.403 . . . . 10.0 111.27 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.409 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 17.7 mt -71.15 -57.13 4.95 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-N 116.11 -0.495 . . . . 10.0 111.795 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 29.4 Cg_endo -61.92 -30.62 83.98 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 122.17 1.914 . . . . 10.0 112.222 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.55 -47.16 73.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.635 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.434 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 65.4 t80 -61.25 -46.15 91.59 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.068 0.461 . . . . 10.0 110.477 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.417 ' O ' HD11 ' A' ' 60' ' ' LEU . 20.5 tp -61.86 -50.39 72.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.629 -0.714 . . . . 10.0 112.007 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -68.2 -28.42 67.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.24 -28.51 67.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.396 0.141 . . . . 10.0 111.34 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 85.9 mt -55.38 -29.24 58.08 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 76.7 p -66.29 -26.82 67.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.632 -0.258 . . . . 10.0 111.363 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.36 -1.33 87.41 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.389 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -76.53 -21.41 55.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.717 0.294 . . . . 10.0 110.953 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 101.12 138.04 10.05 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.708 -0.758 . . . . 10.0 113.778 178.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 68.4 t -107.04 121.39 59.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -98.41 102.7 14.52 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.67 0.271 . . . . 10.0 110.782 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 26.2 t -95.59 125.06 48.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.905 0.384 . . . . 10.0 110.447 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 79.3 t -110.48 117.59 55.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.453 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.87 160.76 14.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.955 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 13.2 m -67.24 -35.25 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -145.63 161.35 40.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.518 -0.31 . . . . 10.0 110.187 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -67.37 -28.83 68.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.697 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -55.3 -53.7 52.83 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.132 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.3 mt -74.23 -32.92 63.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.877 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -53.83 -49.98 67.19 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.833 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -72.1 -36.41 69.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.856 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 17.6 ttp180 -62.61 -59.64 4.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.966 -0.561 . . . . 10.0 112.13 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.63 -29.31 69.32 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.667 -178.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.45 88.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 10.0 110.55 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -75.8 -26.0 56.88 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.154 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ASN . . . . . 0.435 ' O ' ' HD2' ' A' ' 145' ' ' PRO . 11.3 t30 -73.43 -40.82 63.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.021 0.439 . . . . 10.0 110.634 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -86.92 -6.81 58.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.367 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.512 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 61.7 ttm-85 -60.01 -49.46 91.06 Favored Pre-proline 0 CA--C 1.537 0.467 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' PRO . . . . . 0.512 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 34.1 Cg_exo -63.81 -10.37 22.25 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 122.155 1.903 . . . . 10.0 112.886 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 20.3 tp -96.07 -48.92 5.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.935 0.398 . . . . 10.0 110.424 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -71.54 -51.11 25.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.012 -0.54 . . . . 10.0 112.18 -178.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -65.27 -23.48 67.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.677 0.275 . . . . 10.0 111.438 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -67.17 -28.92 68.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.105 0.479 . . . . 10.0 110.037 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 43.9 mt -96.9 -2.41 43.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.006 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 98.82 22.8 12.81 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.598 -0.811 . . . . 10.0 113.502 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 43.2 mt -109.76 121.8 46.05 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.7 p -78.4 130.32 35.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.016 0.436 . . . . 10.0 112.024 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 48.3 t -104.74 127.88 58.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.933 -0.576 . . . . 10.0 109.971 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -123.02 142.72 14.73 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.613 -0.803 . . . . 10.0 112.264 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 6.6 tp -112.85 134.55 55.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -121.34 110.29 15.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.856 0.36 . . . . 10.0 110.247 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 161' ' ' MET . 94.1 mt -102.4 147.75 34.44 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.617 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 159' ' ' PRO . . . . . 0.519 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 16.7 Cg_endo -58.49 114.26 1.91 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.7 2.267 . . . . 10.0 112.232 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 99.63 6.96 54.36 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.771 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' MET . . . . . 0.49 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.1 OUTLIER -67.27 144.8 98.36 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 110.529 -0.174 . . . . 10.0 110.529 179.57 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -57.3 149.56 64.0 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.635 2.223 . . . . 10.0 112.301 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' ALA . . . . . 0.507 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.09 -49.86 82.03 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 112.769 0.655 . . . . 10.0 112.769 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.507 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 53.0 Cg_exo -57.15 -41.39 74.66 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 121.774 1.65 . . . . 10.0 112.029 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -63.08 -44.42 95.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.661 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.459 ' HE2' ' O ' ' A' ' 161' ' ' MET . 59.6 mttm -60.86 -45.44 94.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.432 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -57.83 -42.69 84.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.821 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 164' ' ' PRO . 58.2 mt-10 -66.28 -39.12 89.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.784 0.326 . . . . 10.0 111.024 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -69.44 -42.56 74.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.584 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -74.7 -31.2 61.8 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.449 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.12 3.26 18.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.882 0.372 . . . . 10.0 110.832 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -84.59 -179.17 7.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.148 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -79.22 -42.59 25.62 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.1 mp -128.78 121.51 54.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.281 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.7 m -108.74 123.34 48.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.84 0.352 . . . . 10.0 111.353 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -102.71 131.26 49.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.747 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.62 176.74 44.05 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.568 -0.825 . . . . 10.0 112.202 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.79 155.79 16.63 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.77 0.319 . . . . 10.0 111.158 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -59.99 -35.4 74.95 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.237 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -55.63 -57.87 10.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.037 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.519 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.6 tp10 -69.53 -36.61 76.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.381 -178.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -58.1 -38.87 77.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.904 0.383 . . . . 10.0 111.308 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -78.23 -42.4 15.29 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.715 -0.755 . . . . 10.0 111.921 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -64.56 -38.17 90.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.767 0.318 . . . . 10.0 111.077 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 185' ' ' ASP . . . . . 0.412 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 10.9 m-20 -60.6 -41.55 94.98 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.47 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -64.51 -38.33 90.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.411 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 18.6 mt -63.85 -44.78 92.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.777 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 39.0 mtm-85 -72.03 -36.05 69.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.868 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -64.14 -47.29 80.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.287 0.565 . . . . 10.0 110.917 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -74.69 -8.91 57.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.804 -0.634 . . . . 10.0 112.258 -178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 17.8 ttp -101.08 14.71 31.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.169 0.509 . . . . 10.0 110.75 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -76.42 160.13 29.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.843 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -102.69 -24.16 13.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.176 0.513 . . . . 10.0 110.029 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 67.7 m -129.0 140.84 39.8 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.716 -0.674 . . . . 10.0 109.625 178.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.0 -24.96 75.83 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.847 2.364 . . . . 10.0 112.846 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.83 -9.35 58.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.585 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -91.66 -6.93 51.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.854 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 198' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 198' ' ' ARG . 19.4 mtt85 -58.97 155.94 12.52 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.148 0.499 . . . . 10.0 111.875 -179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 16.1 m -137.43 -16.29 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.514 -0.766 . . . . 10.0 111.047 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -84.87 -178.5 6.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.324 0.583 . . . . 10.0 111.799 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -143.02 177.22 8.51 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.218 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 32.9 tttm -60.88 133.74 56.39 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.203 0.525 . . . . 10.0 111.201 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 17.4 mt -84.94 69.93 10.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.612 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 204' ' ' HIS . . . . . 0.409 ' HA ' ' OE2' ' A' ' 385' ' ' GLU . 18.3 t-80 -81.09 -64.66 1.14 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.905 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -124.69 133.76 53.1 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.935 0.397 . . . . 10.0 111.288 -178.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.582 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -119.99 123.3 43.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.626 179.065 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 207' ' ' LEU . . . . . 0.624 HD21 ' HB1' ' A' ' 112' ' ' ALA . 53.6 tp -117.09 100.36 7.68 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.073 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -94.04 128.59 45.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.052 0.454 . . . . 10.0 110.579 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -55.99 -72.15 0.08 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.324 -0.853 . . . . 10.0 111.905 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.39 105.45 13.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.638 0.256 . . . . 10.0 110.681 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.552 HG11 HD12 ' A' ' 99' ' ' ILE . 27.4 m -68.38 -22.32 27.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.537 -0.302 . . . . 10.0 111.178 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 212' ' ' ASP . . . . . 0.567 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.2 m-20 -45.04 -64.08 0.79 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.026 0.828 . . . . 10.0 111.878 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.449 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 68.7 m -96.62 -37.08 10.5 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.801 0.667 . . . . 10.0 112.801 -178.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 73.4 mt -64.21 -38.62 82.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -178.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 12.7 mt -102.25 -50.82 3.52 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 216' ' ' ILE . . . . . 0.567 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 50.5 mm -73.62 -56.31 9.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.979 0.733 . . . . 10.0 112.979 -177.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 217' ' ' ASP . . . . . 0.449 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 79.0 m-20 -63.45 -45.74 89.47 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.133 0.42 . . . . 10.0 112.133 -178.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -93.26 28.91 2.05 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -66.97 -48.38 68.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.972 0.415 . . . . 10.0 111.644 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 220' ' ' ARG . . . . . 0.41 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -98.59 18.8 15.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.063 -179.007 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 85.0 m -84.57 113.0 46.41 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.319 -0.401 . . . . 10.0 110.465 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -92.82 135.1 1.25 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.806 2.337 . . . . 10.0 113.17 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 223' ' ' LEU . . . . . 0.642 ' O ' ' HA ' ' A' ' 374' ' ' SER . 96.9 mt -94.48 120.17 34.3 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 21.6 mt -113.99 132.76 62.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.241 0.46 . . . . 10.0 112.241 -178.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 27.9 mt -113.51 107.4 22.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 108.767 -0.827 . . . . 10.0 108.767 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 4.3 m -114.01 109.84 19.1 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.98 0.419 . . . . 10.0 111.453 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 227' ' ' GLY . . . . . 0.734 ' H ' HD12 ' A' ' 372' ' ' LEU . . . -125.42 80.09 0.36 Allowed Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 111.277 -0.729 . . . . 10.0 111.277 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -62.34 130.32 29.88 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.718 2.279 . . . . 10.0 112.525 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -98.3 93.05 6.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.839 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 74.22 116.93 0.05 Allowed 'General case' 0 N--CA 1.467 0.378 0 O-C-N 124.185 0.928 . . . . 10.0 111.786 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 231' ' ' ASP . . . . . 0.437 ' HA ' ' HB2' ' A' ' 367' ' ' ASN . 2.0 m-20 -74.67 72.64 1.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.351 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 38.1 m -156.79 104.74 2.15 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.341 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 49.1 m -140.35 83.82 1.93 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.94 0.4 . . . . 10.0 110.888 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 234' ' ' GLU . . . . . 0.469 ' HA ' HD12 ' A' ' 365' ' ' ILE . 1.4 tp10 -70.08 -2.8 13.93 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.125 -0.488 . . . . 10.0 111.63 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -57.98 -41.87 83.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.914 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -65.81 -26.87 67.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.012 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 237' ' ' LYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 241' ' ' LYS . 4.2 ttmt -69.34 -37.29 77.61 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 52.0 mmm-85 -67.57 -47.75 68.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.61 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 239' ' ' VAL . . . . . 0.416 ' O ' HG12 ' A' ' 242' ' ' ILE . 4.2 p -69.37 -21.33 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 116.286 -0.415 . . . . 10.0 111.5 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -89.39 -14.33 35.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.444 0.64 . . . . 10.0 109.572 179.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 241' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 237' ' ' LYS . 0.1 OUTLIER -97.98 9.89 41.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.21 -179.132 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 242' ' ' ILE . . . . . 0.467 HG22 ' HG3' ' A' ' 289' ' ' GLU . 26.5 pt -75.23 -16.4 15.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.063 0.458 . . . . 10.0 109.966 178.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 243' ' ' ILE . . . . . . . . . . . . . 5.5 pt -124.36 74.98 61.29 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.996 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 244' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -81.54 -19.72 7.37 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.209 1.939 . . . . 10.0 112.144 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -110.84 105.25 14.01 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.712 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 246' ' ' LEU . . . . . 0.422 HD22 ' HB3' ' A' ' 253' ' ' ASP . 23.6 mt -83.93 167.42 16.98 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.161 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 66.3 mt -125.05 -32.82 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.66 -0.245 . . . . 10.0 110.853 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? 57.33 33.92 23.99 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.706 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 -153.77 -57.33 0.12 Allowed 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.936 -0.306 . . . . 10.0 111.268 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -136.53 132.15 34.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.566 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.539 ' H ' HD22 ' A' ' 281' ' ' LEU . 55.7 pttt 51.08 -178.55 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.982 1.313 . . . . 10.0 113.953 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 252' ' ' GLU . . . . . 0.507 ' HG2' ' HG3' ' A' ' 251' ' ' LYS . 5.3 mm-40 64.11 -74.36 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 114.813 -1.085 . . . . 10.0 113.267 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 253' ' ' ASP . . . . . 0.422 ' HB3' HD22 ' A' ' 246' ' ' LEU . 6.1 p-10 -113.76 29.59 7.89 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.285 0.846 . . . . 10.0 113.285 -177.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 9.7 m -73.57 144.1 46.18 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 122.093 -0.379 . . . . 10.0 110.498 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 255' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 318' ' ' ALA . 0.0 OUTLIER -85.78 -43.88 12.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.486 0.66 . . . . 10.0 109.944 179.722 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 55.0 m -156.24 -50.4 0.08 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.383 -0.826 . . . . 10.0 109.124 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 9.6 t80 60.02 -81.51 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.268 -0.878 . . . . 10.0 112.115 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 10.7 tp60 63.1 15.07 8.19 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.023 0.529 . . . . 10.0 110.766 -179.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 86.92 -16.42 47.15 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.834 -0.621 . . . . 10.0 113.078 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -101.75 -47.59 4.56 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.719 0.295 . . . . 10.0 111.682 -178.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 87.13 -132.32 11.1 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.555 -0.831 . . . . 10.0 111.632 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -145.51 172.05 13.78 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.357 -0.238 . . . . 10.0 110.357 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -74.79 171.69 13.52 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 18.3 m -77.17 67.56 3.16 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.107 0.479 . . . . 10.0 110.819 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 5.3 m -133.22 -32.72 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.293 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -168.31 -173.42 1.98 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.493 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -131.13 5.87 4.52 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.757 0.313 . . . . 10.0 111.133 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 268' ' ' LYS . . . . . . . . . . . . . 19.9 mttp -114.57 105.99 13.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.295 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 58.0 m -81.51 89.94 6.21 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 47.3 mtp85 -85.18 60.49 6.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.924 -178.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.28 -18.07 20.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.01 179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 15.3 t 51.65 76.51 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.33 -0.85 . . . . 10.0 110.78 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -153.94 -51.56 0.1 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.077 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 74.5 mt 71.1 153.04 0.12 Allowed 'General case' 0 N--CA 1.472 0.675 0 O-C-N 123.697 0.623 . . . . 10.0 110.446 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -149.88 -84.95 0.09 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.76 0.652 . . . . 10.0 112.76 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 57.69 52.37 8.3 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.76 0.79 . . . . 10.0 109.838 -177.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -85.64 13.21 7.34 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.203 -0.908 . . . . 10.0 110.182 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . -102.87 -21.33 10.35 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.514 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 59.05 40.79 21.71 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.215 0.531 . . . . 10.0 109.856 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 13.6 p -124.15 -18.67 3.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.805 -0.634 . . . . 10.0 111.14 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 281' ' ' LEU . . . . . 0.539 HD22 ' H ' ' A' ' 251' ' ' LYS . 47.1 mt -92.98 -42.27 9.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.826 0.346 . . . . 10.0 110.277 -179.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 32.8 pt -82.03 9.07 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.21 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -66.6 -59.54 3.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.57 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -87.58 11.82 14.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.189 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 1.7 tt -72.75 -27.66 62.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.047 0.451 . . . . 10.0 110.074 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 286' ' ' LEU . . . . . 0.441 HD21 ' HB2' ' A' ' 298' ' ' LEU . 48.8 mt -86.79 -169.97 2.87 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.854 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 287' ' ' VAL . . . . . . . . . . . . . 3.3 t 60.37 34.81 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 CA-C-O 121.802 0.811 . . . . 10.0 110.372 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm -138.16 128.29 25.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.675 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 289' ' ' GLU . . . . . 0.467 ' HG3' HG22 ' A' ' 242' ' ' ILE . 3.0 mm-40 67.78 -165.81 0.2 Allowed 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.827 0.704 . . . . 10.0 111.379 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -88.01 141.25 16.88 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.893 -0.67 . . . . 10.0 111.942 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 291' ' ' ILE . . . . . . . . . . . . . 1.4 tt 90.85 143.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 124.389 1.076 . . . . 10.0 109.394 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 60.4 mtm 68.7 16.99 8.95 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.864 0.84 . . . . 10.0 108.851 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -102.83 -4.33 25.03 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.5 -1.227 . . . . 10.0 110.434 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -85.95 -34.97 20.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.487 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 133.21 28.92 0.52 Allowed Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.609 -0.805 . . . . 10.0 113.165 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -86.23 172.05 10.8 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.864 0.332 . . . . 10.0 110.379 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 297' ' ' SER . . . . . 0.421 ' HB3' ' CE1' ' A' ' 299' ' ' TYR . 44.8 m -113.24 131.2 56.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.882 0.372 . . . . 10.0 110.717 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.441 ' HB2' HD21 ' A' ' 286' ' ' LEU . 20.4 tp -75.37 -29.13 59.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.873 -0.603 . . . . 10.0 112.027 -178.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 299' ' ' TYR . . . . . 0.421 ' CE1' ' HB3' ' A' ' 297' ' ' SER . 55.2 p90 -79.74 -7.73 58.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.446 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 44.7 m -89.39 146.95 37.01 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.969 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 301' ' ' PRO . . . . . 0.46 ' HA ' ' HB ' ' A' ' 304' ' ' ILE . 18.6 Cg_endo -59.8 -14.83 28.91 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 123.441 2.761 . . . . 10.0 113.13 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -68.71 -41.28 79.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.04 0.448 . . . . 10.0 110.744 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -110.81 26.85 10.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.558 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 304' ' ' ILE . . . . . 0.46 ' HB ' ' HA ' ' A' ' 301' ' ' PRO . 9.3 tp -60.82 -26.39 38.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.512 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -44.07 95.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.091 0.472 . . . . 10.0 109.745 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -67.88 -36.15 79.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.757 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 13.5 tpt -60.68 -36.94 80.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.828 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -78.01 -15.14 59.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.603 -0.272 . . . . 10.0 110.813 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -84.14 -42.98 15.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.897 0.38 . . . . 10.0 110.121 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 18.0 m -71.05 -33.5 51.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.108 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.83 -26.35 66.01 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.319 0.58 . . . . 10.0 109.868 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 312' ' ' ALA . . . . . 0.624 ' O ' ' HG2' ' A' ' 315' ' ' ARG . . . -72.46 -43.16 64.13 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 178.201 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -62.8 -38.05 89.12 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.392 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 3.7 mp -70.07 -43.48 71.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.335 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 315' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 312' ' ' ALA . 12.1 ptp180 -64.33 -28.31 69.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.824 0.345 . . . . 10.0 110.49 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -85.92 9.18 17.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.929 0.395 . . . . 10.0 110.898 179.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -110.55 -42.66 4.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.392 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.402 ' CB ' ' HB3' ' A' ' 255' ' ' GLU . . . -113.65 -31.62 6.43 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.019 0.748 . . . . 10.0 113.019 -178.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 319' ' ' LEU . . . . . 0.562 ' HB2' ' O ' ' A' ' 315' ' ' ARG . 3.7 mm? -79.64 -58.09 3.36 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.858 -0.337 . . . . 10.0 110.383 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -86.45 108.06 18.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.87 0.367 . . . . 10.0 110.088 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 321' ' ' THR . . . . . 0.535 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 0.2 OUTLIER -94.97 140.77 29.48 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.176 -179.383 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 322' ' ' ARG . . . . . 0.43 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 6.8 tpt180 -64.49 141.83 58.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.688 -0.687 . . . . 10.0 111.48 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 323' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 94.1 m-20 77.71 -53.19 0.53 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.228 1.011 . . . . 10.0 113.189 177.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 324' ' ' VAL . . . . . 0.535 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 3.0 p -74.66 -46.78 41.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.543 0 N-CA-C 112.742 0.645 . . . . 10.0 112.742 -178.201 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -87.06 -26.27 23.78 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.822 0.344 . . . . 10.0 111.515 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -158.56 152.49 23.65 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.31 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 327' ' ' ILE . . . . . 0.43 HG23 ' HB ' ' A' ' 334' ' ' ILE . 6.9 tp -124.49 119.52 56.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.232 0.539 . . . . 10.0 110.105 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 55.3 t -95.26 108.62 21.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.023 -0.535 . . . . 10.0 109.989 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.13 140.39 34.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.554 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 63.43 16.6 9.68 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.044 0.45 . . . . 10.0 110.452 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 85.84 2.26 86.57 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 111.557 -0.617 . . . . 10.0 111.557 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -100.07 137.89 37.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.666 0.269 . . . . 10.0 110.497 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 42.8 t -100.0 91.93 2.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.134 0.493 . . . . 10.0 109.698 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 334' ' ' ILE . . . . . 0.43 ' HB ' HG23 ' A' ' 327' ' ' ILE . 87.2 mt -86.88 128.47 39.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.432 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 4.2 mp -80.74 133.85 28.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.411 -0.358 . . . . 10.0 110.478 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 60.2 t -111.72 127.15 69.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.39 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 337' ' ' ASP . . . . . 0.567 ' HB3' ' H ' ' A' ' 342' ' ' ARG . 0.9 OUTLIER -72.83 122.4 21.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.916 178.968 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -75.65 -16.09 60.24 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.844 -0.616 . . . . 10.0 112.184 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -75.67 -58.57 3.2 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.383 0.512 . . . . 10.0 112.383 -178.129 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -122.69 13.19 9.99 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.67 0.619 . . . . 10.0 112.67 -178.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 61.78 59.29 9.95 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.552 -0.832 . . . . 10.0 111.911 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.567 ' H ' ' HB3' ' A' ' 337' ' ' ASP . 0.0 OUTLIER -103.25 141.92 35.07 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.702 0.287 . . . . 10.0 110.606 -179.756 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 6.9 m -88.75 116.81 27.29 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.228 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 43.7 mtm -118.52 82.04 1.78 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.023 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -90.28 -20.71 22.62 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.769 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -105.04 53.59 0.66 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.595 -0.812 . . . . 10.0 112.13 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -146.41 145.15 30.15 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -117.04 156.81 26.89 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.023 0.439 . . . . 10.0 110.725 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 349' ' ' TRP . . . . . 0.464 ' O ' ' HD2' ' A' ' 354' ' ' HIS . 68.5 m95 -128.25 105.39 8.32 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.427 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 24.2 m -72.47 -171.61 0.82 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.619 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 35.4 t70 70.04 6.71 5.89 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.586 0.708 . . . . 10.0 110.834 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 84.39 16.07 67.43 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.717 -0.674 . . . . 10.0 112.836 179.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 4.5 mp -55.98 -60.82 2.93 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.782 0.325 . . . . 10.0 111.726 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 354' ' ' HIS . . . . . 0.464 ' HD2' ' O ' ' A' ' 349' ' ' TRP . 13.6 p80 -75.47 -19.81 59.19 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.923 -0.311 . . . . 10.0 111.379 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 355' ' ' GLN . . . . . 0.563 ' HA ' ' NE2' ' A' ' 355' ' ' GLN . 0.0 OUTLIER -66.35 -32.23 73.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.896 0.379 . . . . 10.0 110.829 -179.177 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -73.12 -28.15 62.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.82 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 93.6 t -69.52 -49.11 62.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.068 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.504 ' OE1' ' HG2' ' A' ' 366' ' ' GLN . 15.7 mt-10 -66.8 -15.74 63.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.967 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -91.68 -25.47 19.1 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.135 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -78.04 -54.46 6.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.745 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -94.87 178.28 5.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.811 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -79.11 69.69 2.9 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.202 -0.523 . . . . 10.0 112.543 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 2.1 t -126.55 156.54 37.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.972 -0.381 . . . . 10.0 109.972 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 6.5 tm0? -76.15 125.11 28.54 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.264 -0.643 . . . . 10.0 109.264 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 365' ' ' ILE . . . . . 0.469 HD12 ' HA ' ' A' ' 234' ' ' GLU . 25.9 mt -86.63 132.68 31.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.866 0.365 . . . . 10.0 111.849 -178.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 366' ' ' GLN . . . . . 0.504 ' HG2' ' OE1' ' A' ' 358' ' ' GLU . 32.0 mm-40 -79.21 -172.59 3.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.583 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 367' ' ' ASN . . . . . 0.528 ' OD1' HG13 ' B' ' 21' ' ' VAL . 2.2 t-20 -103.2 -2.61 26.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.796 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 66.6 -171.45 0.19 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.556 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -90.92 -59.17 2.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.967 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 67.58 151.85 0.08 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.425 0.898 . . . . 10.0 113.425 178.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 1.7 m -101.77 69.61 1.21 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.048 -0.978 . . . . 10.0 108.934 178.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 372' ' ' LEU . . . . . 0.734 HD12 ' H ' ' A' ' 227' ' ' GLY . 33.1 mt -66.52 -27.1 67.5 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.9 -1.045 . . . . 10.0 112.791 -177.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -161.21 131.16 4.92 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 374' ' ' SER . . . . . 0.642 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 1.4 t -156.41 142.55 18.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.115 0.483 . . . . 10.0 111.516 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 14.3 tt -146.9 147.39 17.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.794 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.96 142.37 30.54 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -56.74 -49.18 76.0 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 123.036 0.21 . . . . 10.0 111.215 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 378' ' ' GLN . . . . . 0.441 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.5 tm0? -57.07 -43.89 82.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.028 0.442 . . . . 10.0 110.715 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -73.54 -11.36 60.42 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.72 -0.673 . . . . 10.0 111.768 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -93.69 -44.88 7.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.911 0.386 . . . . 10.0 110.329 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -69.36 -21.7 63.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.136 -0.483 . . . . 10.0 111.313 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -72.88 -4.18 30.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.134 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 56.9 mt -97.42 8.57 44.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.937 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.582 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 27.6 m-85 -99.17 146.44 26.15 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.818 0.342 . . . . 10.0 110.793 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 385' ' ' GLU . . . . . 0.409 ' OE2' ' HA ' ' A' ' 204' ' ' HIS . 34.4 mt-10 -70.37 -65.8 0.68 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.091 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -102.63 104.09 14.43 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.45 HD23 HD21 ' A' ' 407' ' ' LEU . 61.5 tp -110.72 110.61 21.33 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.641 -179.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -131.92 165.66 23.41 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.783 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -163.84 162.7 35.31 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.403 -0.903 . . . . 10.0 112.409 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 63.3 mtm -107.82 156.85 18.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.989 0.424 . . . . 10.0 110.399 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 391' ' ' THR . . . . . 0.41 ' HB ' HG22 ' A' ' 211' ' ' VAL . 15.3 t -153.59 165.68 35.15 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.21 179.026 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -101.9 -171.25 27.58 Favored Glycine 0 N--CA 1.441 -1.006 0 N-CA-C 110.613 -0.995 . . . . 10.0 110.613 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 393' ' ' THR . . . . . 0.497 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 3.1 m -74.67 66.26 1.43 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.536 0.684 . . . . 10.0 110.589 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 394' ' ' ALA . . . . . 0.533 ' HB1' ' HG2' ' A' ' 566' ' ' ARG . . . -102.76 -45.72 4.92 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.125 -0.943 . . . . 10.0 110.274 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 395' ' ' ASP . . . . . 0.426 ' CG ' ' H ' ' A' ' 396' ' ' THR . 10.0 t70 56.78 -144.35 0.66 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.615 -0.721 . . . . 10.0 110.214 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 396' ' ' THR . . . . . 0.426 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 3.0 m 70.02 -79.88 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.851 0.686 . . . . 10.0 112.851 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -79.31 26.98 0.26 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 10.0 111.683 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 398' ' ' ALA . . . . . 0.465 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -66.21 -35.89 81.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.138 0.494 . . . . 10.0 110.992 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -72.76 -15.58 61.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.598 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -83.88 -21.32 31.99 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.651 -0.25 . . . . 10.0 111.047 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 401' ' ' PHE . . . . . 0.465 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 24.7 m-85 -59.61 -46.67 88.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.056 0.455 . . . . 10.0 110.546 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.55 -0.15 36.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.733 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.3 m -108.26 -43.71 4.3 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.772 0.286 . . . . 10.0 111.772 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 44.6 mt -86.41 -55.18 6.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 405' ' ' TYR . . . . . 0.441 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 60.8 m-85 -100.04 -4.81 29.14 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 31.4 mmtt 60.98 51.09 4.69 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.365 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 407' ' ' LEU . . . . . 0.476 HD13 HD11 ' A' ' 99' ' ' ILE . 26.4 mt -117.65 149.77 40.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.896 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 408' ' ' ASP . . . . . 0.581 ' OD2' ' HD2' ' A' ' 13' ' ' ARG . 21.0 t70 -85.2 170.25 13.04 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 18.2 m -138.71 120.73 15.59 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.835 -0.541 . . . . 10.0 111.605 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 14.0 t -127.35 137.11 58.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.326 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 87.4 t -93.45 133.33 34.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.648 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 59.2 t -91.3 127.07 52.52 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.795 -0.446 . . . . 10.0 109.795 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.66 142.1 69.18 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.522 2.148 . . . . 10.0 112.634 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' A' ' 416' ' ' ARG . 0.2 OUTLIER -64.1 151.55 42.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.584 -0.735 . . . . 10.0 111.604 -179.868 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -70.0 -26.85 64.27 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.178 0.514 . . . . 10.0 110.492 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 416' ' ' ARG . . . . . 0.509 ' HB2' ' O ' ' A' ' 578' ' ' GLN . 58.3 mtm180 -134.14 157.9 76.55 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.84 122.49 11.06 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.28 1.987 . . . . 10.0 111.445 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 3.8 mtm -76.53 100.42 5.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.034 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.6 pt -95.24 51.39 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.303 0.573 . . . . 10.0 110.602 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 30.4 ttp-105 -94.2 116.02 28.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.494 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -84.43 105.04 14.95 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.148 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -88.54 112.47 23.05 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 26.5 mt -93.06 150.62 39.53 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.547 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -62.68 163.69 20.75 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.52 2.147 . . . . 10.0 112.381 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -83.7 133.97 34.78 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.937 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 31.3 mt -105.88 94.72 5.33 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.148 0.499 . . . . 10.0 110.389 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 427' ' ' VAL . . . . . 0.641 HG22 ' HB3' ' A' ' 588' ' ' LEU . 21.8 t -90.24 119.43 37.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.345 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 428' ' ' TYR . . . . . 0.533 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 3.3 m-85 -105.22 177.86 4.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.043 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 8.8 mmm -77.21 -77.62 0.14 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.862 -0.335 . . . . 10.0 111.409 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 41.4 p -86.09 165.65 16.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.972 0.415 . . . . 10.0 111.431 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 431' ' ' GLU . . . . . 0.448 ' O ' HG12 ' A' ' 435' ' ' ILE . 2.9 tp10 -62.44 -40.17 95.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.691 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.97 82.01 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.129 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -60.96 -42.03 97.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.272 0.558 . . . . 10.0 109.972 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 434' ' ' LYS . . . . . 0.54 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 28.4 ttpt -65.79 -52.42 50.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.369 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 435' ' ' ILE . . . . . 0.602 ' O ' HG12 ' A' ' 439' ' ' ILE . 32.3 mm -61.04 -44.1 97.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.342 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.56 -36.99 74.77 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.72 0.295 . . . . 10.0 110.985 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.91 -37.36 70.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.312 179.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 438' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 434' ' ' LYS . 81.1 mt -62.65 -45.59 98.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.155 179.153 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 439' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 435' ' ' ILE . 37.8 mm -59.89 -39.95 81.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.6 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -65.66 -43.78 88.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.601 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -60.35 -40.75 91.86 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.167 0.508 . . . . 10.0 110.136 179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.414 HG12 HG11 ' A' ' 452' ' ' VAL . 71.9 mt -70.74 -42.48 77.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.724 179.425 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -60.07 -42.52 94.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.035 -0.529 . . . . 10.0 111.147 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -73.38 0.79 11.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.159 -0.473 . . . . 10.0 112.202 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 70.3 mtt-85 -117.41 -31.25 5.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.855 0.359 . . . . 10.0 110.917 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.19 -28.31 65.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.229 0.538 . . . . 10.0 109.859 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -80.82 -3.47 51.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.38 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -108.89 -38.85 5.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.876 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 121.05 18.6 3.8 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.722 -0.752 . . . . 10.0 113.004 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -98.5 125.51 42.68 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 122.541 -0.388 . . . . 10.0 111.081 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.12 144.96 48.18 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.767 2.311 . . . . 10.0 111.226 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.414 HG11 HG12 ' A' ' 442' ' ' ILE . 84.0 t -125.62 128.04 72.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.978 0.418 . . . . 10.0 111.464 -178.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 58.2 tp -108.46 111.2 22.96 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.182 -0.673 . . . . 10.0 109.182 178.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 47.5 t -94.72 124.42 47.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.523 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -111.3 114.52 3.68 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.839 -0.696 . . . . 10.0 111.898 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 22.8 p -106.17 145.21 31.81 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.712 0.291 . . . . 10.0 110.882 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 23.1 pt -92.71 -2.63 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.781 0.324 . . . . 10.0 111.142 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 59.5 m -149.66 141.48 23.69 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.433 -0.348 . . . . 10.0 110.234 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 17.1 mt -61.69 -34.38 61.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-O 121.111 0.482 . . . . 10.0 110.603 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -56.89 -40.31 75.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.539 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.407 ' HG2' ' OE2' ' A' ' 560' ' ' GLU . 0.6 OUTLIER -71.36 -33.53 69.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.475 179.833 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.5 m -62.44 -48.08 81.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.352 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -62.55 -37.78 87.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.203 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 55.8 tp -62.94 -54.85 32.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.341 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.5 p -65.7 -32.65 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.621 -0.263 . . . . 10.0 111.632 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 60.0 m -65.68 -37.56 86.82 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.777 0.322 . . . . 10.0 110.644 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -64.41 -48.47 75.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.523 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 468' ' ' GLU . . . . . 0.519 ' HG3' HG21 ' A' ' 435' ' ' ILE . 20.9 mm-40 -61.91 -41.24 97.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.122 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 26.4 mt -60.91 -36.05 78.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.675 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.3 m -70.45 -34.89 72.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.11 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 42.5 mtpt -63.98 -37.21 86.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.336 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.48 -16.68 51.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.129 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 81.47 29.02 41.43 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.307 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 60.9 mt -94.64 121.31 45.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 110.263 -0.273 . . . . 10.0 110.263 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -59.16 125.67 24.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.658 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 53.0 p-80 -148.6 151.59 35.29 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.762 -178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -134.8 141.06 46.32 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.4 t -105.81 131.29 55.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.818 0.342 . . . . 10.0 110.836 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.45 HD12 ' HB2' ' A' ' 503' ' ' ALA . 67.8 mt -73.08 105.53 4.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.107 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.89 123.84 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.48 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -82.58 -8.82 59.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.043 -0.526 . . . . 10.0 112.209 -178.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -92.85 -53.09 4.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.174 0.512 . . . . 10.0 110.014 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -102.49 96.61 7.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.37 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' HIS . . . . . 0.425 ' HA ' ' HB3' ' A' ' 487' ' ' GLU . 9.9 m170 -66.6 -15.48 63.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.685 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -57.98 -49.26 77.44 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.032 0.444 . . . . 10.0 110.6 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 486' ' ' ASN . . . . . 0.495 ' O ' HG13 ' A' ' 490' ' ' ILE . 64.8 t30 -72.56 -41.52 65.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.73 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 487' ' ' GLU . . . . . 0.425 ' HB3' ' HA ' ' A' ' 484' ' ' HIS . 1.7 tt0 -55.36 -57.14 13.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.575 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -57.94 -34.2 69.64 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.571 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -67.88 -41.84 82.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.776 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 490' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 486' ' ' ASN . 45.7 mt -69.5 -45.81 77.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.809 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 491' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 487' ' ' GLU . 89.8 t -56.22 -38.38 54.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.402 -179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -60.82 -26.47 67.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.743 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -124.3 27.61 6.98 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.818 0.342 . . . . 10.0 110.721 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -73.72 -19.81 60.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.124 0.487 . . . . 10.0 110.943 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -90.58 10.39 74.74 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.669 -0.777 . . . . 10.0 112.023 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -67.26 140.29 95.33 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 110.269 -0.271 . . . . 10.0 110.269 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -51.9 123.91 13.47 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.616 2.211 . . . . 10.0 112.918 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 63.62 39.96 8.37 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.388 -0.824 . . . . 10.0 112.483 178.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -109.03 118.86 37.89 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 37.1 t -97.07 112.81 29.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.029 0.442 . . . . 10.0 110.426 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.8 m -111.91 128.37 56.12 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.41 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 43.4 mt -109.34 124.76 66.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.896 0.379 . . . . 10.0 110.328 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 503' ' ' ALA . . . . . 0.45 ' HB2' HD12 ' A' ' 479' ' ' LEU . . . -120.45 128.98 53.67 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.865 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 14.4 m -103.86 120.75 41.65 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.578 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 58.49 77.19 0.31 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.368 0.604 . . . . 10.0 110.453 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.56 133.3 34.45 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.449 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.67 -178.37 4.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.806 -0.633 . . . . 10.0 110.945 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -73.07 164.15 54.93 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.166 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 68.89 -75.44 0.07 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.116 0.567 . . . . 10.0 111.34 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 84.24 143.86 6.05 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.976 -0.631 . . . . 10.0 112.095 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.93 150.73 23.55 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.853 0.359 . . . . 10.0 111.463 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -75.67 95.93 3.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.014 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 71.4 mt -85.47 115.71 27.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.986 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 19.0 t -90.51 140.15 16.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.94 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 61.0 mt -67.91 128.85 38.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.302 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 87.28 9.11 73.59 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.438 -0.665 . . . . 10.0 111.438 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 91.8 -171.7 34.79 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 111.064 -0.814 . . . . 10.0 111.064 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 25.5 p -128.65 110.59 12.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.121 0.46 . . . . 10.0 110.441 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 61.7 p-90 -59.31 -25.32 64.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.568 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -59.75 -41.63 91.44 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.451 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -73.23 -32.8 64.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.921 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -70.06 -47.49 61.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.194 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.8 m -68.14 -25.5 32.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.937 0.398 . . . . 10.0 110.232 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -80.52 -8.58 59.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.574 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -97.19 10.08 40.42 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.276 0.56 . . . . 10.0 110.645 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 70.8 mt -105.16 141.18 37.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.941 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 48.8 mp0 -73.99 -33.05 63.68 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.248 0.547 . . . . 10.0 109.769 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -137.96 82.08 26.18 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.547 -0.751 . . . . 10.0 109.692 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -78.18 95.01 1.06 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.835 2.357 . . . . 10.0 111.734 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 1.4 p -77.69 160.15 28.66 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.68 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.08 -44.12 70.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 10.0 111.437 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -63.55 -39.95 95.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.437 -0.347 . . . . 10.0 111.238 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.71 -42.37 95.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.669 0.271 . . . . 10.0 110.65 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 92.3 mt -59.88 -44.77 95.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.192 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.19 -36.97 69.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.149 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -64.26 -47.63 78.85 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.583 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 87.9 mt -64.04 -40.41 88.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.652 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -60.78 -37.63 82.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.826 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -65.32 -39.83 92.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.725 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.43 -40.02 67.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.013 -0.54 . . . . 10.0 109.978 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 56.8 t90 -57.69 -40.34 79.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.68 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 64.6 tp60 -56.43 -42.74 78.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.497 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.5 -44.67 93.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.451 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -69.93 -37.49 75.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.8 -0.637 . . . . 10.0 110.525 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 17.6 t-80 -61.26 -51.18 70.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.855 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -68.19 -31.36 70.84 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.639 -0.71 . . . . 10.0 111.312 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -63.67 -36.24 83.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.161 0.505 . . . . 10.0 110.179 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 71.7 t -78.74 -40.1 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.466 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 19.4 tp -59.3 -48.02 83.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.543 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -78.48 2.32 19.38 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.613 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -101.15 -5.06 26.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.808 0.337 . . . . 10.0 110.979 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 116.71 3.31 18.47 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.639 -0.791 . . . . 10.0 112.861 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 75.04 -162.5 53.81 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.993 -0.622 . . . . 10.0 112.632 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 44.3 tp -73.89 120.5 19.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.875 0.369 . . . . 10.0 110.576 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -94.47 123.28 37.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.999 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 36.7 mm -103.2 129.63 54.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.264 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 557' ' ' ILE . . . . . 0.4 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 10.7 mt -123.84 118.22 53.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.923 0.392 . . . . 10.0 110.207 178.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.16 118.27 5.81 Favored Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 111.28 -0.728 . . . . 10.0 111.28 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 18.8 p -68.89 -38.83 79.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.144 0.497 . . . . 10.0 110.195 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 560' ' ' GLU . . . . . 0.407 ' OE2' ' HG2' ' A' ' 461' ' ' LYS . 28.0 mp0 -144.34 158.86 43.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.124 -0.944 . . . . 10.0 109.638 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 561' ' ' ARG . . . . . 0.44 ' H ' HD22 ' A' ' 594' ' ' LEU . 93.0 mtt-85 -104.89 -160.12 0.74 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.62 -0.881 . . . . 10.0 108.62 178.127 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -152.32 150.92 30.26 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.769 -0.372 . . . . 10.0 110.552 178.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 563' ' ' GLU . . . . . 0.432 ' H ' ' CD ' ' A' ' 563' ' ' GLU . 1.8 mp0 -51.14 -47.54 62.04 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 123.882 0.739 . . . . 10.0 110.377 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 564' ' ' SER . . . . . 0.45 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.7 OUTLIER -69.2 104.45 2.2 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.225 178.918 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 565' ' ' ARG . . . . . 0.409 ' HB3' ' CG2' ' A' ' 396' ' ' THR . 25.4 tpt180 -69.86 -19.99 63.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.105 -178.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 566' ' ' ARG . . . . . 0.533 ' HG2' ' HB1' ' A' ' 394' ' ' ALA . 16.1 ttm180 -59.01 -40.92 86.43 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.3 0.572 . . . . 10.0 109.771 178.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 48.0 mt -79.09 -36.33 18.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.718 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.59 -54.79 41.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.642 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -61.97 -40.1 94.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.149 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -65.0 -31.55 72.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.816 0.341 . . . . 10.0 110.884 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 37.2 tp -76.06 -31.28 58.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.136 0.493 . . . . 10.0 110.355 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 9.6 ttp180 -76.81 -36.4 56.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.66 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.15 36.61 2.37 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 121.071 -0.585 . . . . 10.0 114.137 -178.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 574' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 574' ' ' ARG . 3.2 mmt180 -83.89 -44.02 14.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 117.134 0.467 . . . . 10.0 110.095 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 5.9 m -81.76 175.55 10.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.072 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 67.5 45.93 73.87 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.435 -0.888 . . . . 10.0 111.689 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -70.64 118.28 13.24 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.354 -0.239 . . . . 10.0 110.354 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 578' ' ' GLN . . . . . 0.623 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 9.7 tt0 62.45 30.48 17.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.471 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 82.11 51.93 4.25 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.836 -0.62 . . . . 10.0 112.266 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.41 -167.62 1.21 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.375 -0.231 . . . . 10.0 110.375 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -87.03 175.44 8.11 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.252 0.549 . . . . 10.0 111.87 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 153.65 164.62 12.83 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.546 -0.752 . . . . 10.0 111.924 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.0 p -148.06 125.41 11.59 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 110.368 -0.234 . . . . 10.0 110.368 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.17 128.08 54.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.169 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 585' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 1.2 ttm180 -138.62 120.61 15.54 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -111.14 155.53 22.74 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.022 0.439 . . . . 10.0 110.61 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 587' ' ' TYR . . . . . 0.54 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 56.6 m-85 -129.27 166.17 19.97 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.852 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 588' ' ' LEU . . . . . 0.641 ' HB3' HG22 ' A' ' 427' ' ' VAL . 15.8 tp -161.69 158.31 25.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.533 -0.303 . . . . 10.0 110.274 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 589' ' ' SER . . . . . 0.448 ' OG ' ' HD3' ' A' ' 434' ' ' LYS . 0.7 OUTLIER -123.34 143.82 49.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.306 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 590' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 92.0 mmm -71.39 -11.64 61.0 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.361 -0.381 . . . . 10.0 111.252 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -108.76 7.64 26.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.538 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -81.66 158.24 24.35 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.341 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -67.38 -30.05 69.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.816 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.44 HD22 ' H ' ' A' ' 561' ' ' ARG . 13.4 tp -66.89 -25.14 66.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.698 0.285 . . . . 10.0 111.53 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 4.1 tpt -74.2 0.65 13.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.128 0.489 . . . . 10.0 111.127 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -94.52 1.07 55.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.269 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 594' ' ' LEU . 41.5 pt -72.99 -7.79 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-O 120.637 0.255 . . . . 10.0 111.664 -179.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -81.07 -7.67 59.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.61 -0.268 . . . . 10.0 110.842 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.4 -64.56 0.38 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.498 0.719 . . . . 10.0 111.196 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 600' ' ' SER . . . . . 0.509 ' HB2' HG23 ' A' ' 603' ' ' VAL . 4.0 m -77.64 116.59 18.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.795 0.331 . . . . 10.0 110.473 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -62.71 -26.04 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.125 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 76.0 mmt-85 -60.45 -29.44 69.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.21 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 603' ' ' VAL . . . . . 0.509 HG23 ' HB2' ' A' ' 600' ' ' SER . 59.9 t -66.68 -51.66 53.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 604' ' ' SER . . . . . 0.555 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 0.7 OUTLIER -63.25 -38.05 89.65 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.989 179.063 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -61.48 -38.69 96.2 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.922 -0.581 . . . . 10.0 112.507 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 42.5 tpp -74.29 -33.52 63.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.955 0.407 . . . . 10.0 110.679 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 51.2 mtt -68.68 -17.91 64.17 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.047 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 608' ' ' ARG . . . . . 0.555 ' HG3' ' O ' ' A' ' 604' ' ' SER . 63.7 mtt180 -77.6 -5.46 50.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.155 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -91.92 8.46 37.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.986 0.422 . . . . 10.0 110.306 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 25.0 tp -73.15 -16.33 61.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 10.0 111.186 -179.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 98.79 -43.78 1.82 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.981 -0.628 . . . . 10.0 111.671 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 70.62 -54.97 0.64 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.687 0.795 . . . . 10.0 112.596 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt 59.64 76.13 0.45 Allowed Pre-proline 0 N--CA 1.463 0.219 0 O-C-N 123.448 0.467 . . . . 10.0 110.485 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 614' ' ' PRO . . . . . 0.533 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 32.3 Cg_exo -58.38 96.95 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.454 2.769 . . . . 10.0 113.064 -178.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 130.17 -13.66 5.72 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.778 -0.725 . . . . 10.0 111.92 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -117.16 142.54 46.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.86 0.362 . . . . 10.0 110.253 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -80.59 107.32 13.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.387 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.63 -30.31 49.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.962 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 41.5 74.25 0.11 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.564 0.746 . . . . 10.0 112.68 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 22.6 m170 -117.61 100.37 52.53 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -57.01 -29.28 82.24 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 123.415 2.744 . . . . 10.0 113.982 -178.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 68.3 p-90 -68.79 -20.4 64.33 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.746 -0.382 . . . . 10.0 111.075 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.88 -48.96 73.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.705 -0.48 . . . . 10.0 109.705 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.28 -39.27 82.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.42 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -69.68 -36.29 75.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.891 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -65.15 -44.7 87.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.402 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 75.7 mt -64.44 -42.99 96.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.024 -0.534 . . . . 10.0 110.254 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.81 -38.63 86.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.482 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -67.47 -39.92 85.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.141 179.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -65.69 -44.11 87.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.652 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -61.45 -42.32 98.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.109 0.481 . . . . 10.0 109.743 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -62.28 -30.38 71.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.632 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 633' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' A' ' 633' ' ' LYS . 66.1 mmtt -64.7 -39.32 93.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.521 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 13.3 t -64.52 -43.13 96.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.45 ' OE2' ' HA ' ' A' ' 564' ' ' SER . 3.6 mm-40 -65.0 -35.7 82.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.865 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 27.9 m -62.92 -42.95 99.97 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.701 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 637' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 637' ' ' ARG . 41.7 ttm180 -63.33 -41.74 98.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.394 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -59.01 -43.5 91.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.298 -0.865 . . . . 10.0 110.322 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -67.76 -39.3 84.18 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.869 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 640' ' ' ASP . . . . . 0.53 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 27.0 t70 -60.06 -35.56 75.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.202 -0.453 . . . . 10.0 110.394 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 66.6 mt -83.29 -36.16 12.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.795 178.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -57.74 -40.47 79.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.419 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 643' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 20.2 pttm -69.15 -28.34 66.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.312 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 644' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 16.0 mm100 -66.9 -38.26 85.9 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.908 0.385 . . . . 10.0 110.181 -179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 26.8 mt -66.73 -38.41 86.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.878 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 646' ' ' LEU . . . . . . . . . . . . . 94.9 mt -64.0 -35.02 79.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.698 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.73 -19.81 65.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.969 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -100.57 -45.86 5.39 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.323 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -72.1 -28.47 63.32 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.029 0.751 . . . . 10.0 113.029 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -67.16 -22.79 65.75 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.05 0.452 . . . . 10.0 110.554 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 18.7 t -68.88 -48.87 68.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -68.18 -29.52 68.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.437 -0.801 . . . . 10.0 109.579 178.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -60.12 -51.53 69.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.615 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -60.92 -45.83 93.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.769 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -61.32 -42.78 99.24 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.458 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 4.3 ttp-105 -63.39 -42.55 98.82 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.924 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -62.21 -44.35 96.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.592 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.73 -48.68 76.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.592 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.45 -34.64 58.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.599 -0.273 . . . . 10.0 111.547 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -64.98 -44.34 89.64 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.0 m -61.62 -41.75 97.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.014 -0.539 . . . . 10.0 109.921 179.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -65.05 -46.64 80.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.727 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 23.8 ttt-85 -65.08 -43.62 91.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.724 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -66.61 -35.12 79.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.734 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -62.65 -51.2 68.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.081 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 666' ' ' LEU . . . . . 0.485 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 54.4 mt -65.28 -28.81 69.6 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.227 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 27.9 tp -71.21 -40.76 70.95 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.962 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.8 -41.8 74.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.812 -178.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 33.0 m -82.6 158.7 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.38 . . . . 10.0 111.223 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 50.8 m -102.97 -34.04 9.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.752 0.31 . . . . 10.0 111.111 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -90.31 117.07 28.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.848 0.356 . . . . 10.0 110.409 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 8.1 p -123.21 -1.01 6.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.656 0.741 . . . . 10.0 109.947 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 673' ' ' SER . . . . . 0.431 ' OG ' ' HD3' ' A' ' 760' ' ' ARG . 0.3 OUTLIER -54.15 -39.09 66.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.868 -1.06 . . . . 10.0 111.846 -179.209 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -59.44 -48.19 82.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.833 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 675' ' ' THR . . . . . 0.404 ' O ' HG12 ' A' ' 679' ' ' ILE . 1.8 m -64.68 -44.27 90.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.664 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 44.4 mm -57.72 -48.34 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.689 -0.687 . . . . 10.0 111.438 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -66.53 -39.83 88.8 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.605 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 46.3 m -64.42 -46.01 85.09 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.867 0.321 . . . . 10.0 111.867 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 679' ' ' ILE . . . . . 0.54 ' O ' HG23 ' A' ' 683' ' ' VAL . 37.9 pt -71.67 -25.29 24.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.472 -0.491 . . . . 10.0 110.642 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 3.4 ttm-85 -58.55 -39.41 80.16 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.848 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -63.23 -43.76 97.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.667 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -70.56 -36.9 73.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.129 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 683' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 679' ' ' ILE . 69.1 t -59.5 -52.21 63.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 120.928 0.394 . . . . 10.0 110.429 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -63.41 -38.75 92.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.919 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 10.2 tttm -58.02 -52.53 65.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.24 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -61.46 -37.69 84.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.033 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 35.8 m -64.14 -41.58 97.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.543 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 94.2 mt -70.53 -42.44 78.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.241 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -56.3 -30.35 62.4 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.042 0.449 . . . . 10.0 111.725 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -66.33 -25.26 66.74 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.77 0.656 . . . . 10.0 112.77 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -120.86 -24.14 5.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.917 0.389 . . . . 10.0 111.445 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 692' ' ' ILE . . . . . 0.574 HG23 ' CD1' ' A' ' 701' ' ' TRP . 71.3 mt -127.65 103.76 21.77 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.4 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -68.58 128.79 17.69 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.027 1.818 . . . . 10.0 111.338 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -54.79 123.03 12.73 Favored 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 122.695 2.263 . . . . 10.0 112.784 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 61.55 78.76 0.28 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.251 -0.886 . . . . 10.0 111.406 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 17.5 p -145.93 -167.72 2.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.134 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 79.4 mt -85.65 152.54 23.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.64 0.257 . . . . 10.0 110.51 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.73 -31.49 68.35 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.741 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -76.63 -3.42 37.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.591 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.45 3.63 35.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.055 0.455 . . . . 10.0 110.238 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 701' ' ' TRP . . . . . 0.574 ' CD1' HG23 ' A' ' 692' ' ' ILE . 34.2 m0 -100.9 107.78 19.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.939 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -82.34 82.48 7.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.207 0.527 . . . . 10.0 109.582 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 703' ' ' ILE . . . . . 0.557 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 46.8 mm -58.6 -50.82 85.95 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.443 -0.799 . . . . 10.0 111.65 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 704' ' ' PRO . . . . . 0.557 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.2 Cg_exo -57.23 -42.94 57.47 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 121.91 1.74 . . . . 10.0 112.078 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -60.45 -42.96 99.21 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.128 -0.558 . . . . 10.0 111.993 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 47.5 tp -67.73 -39.95 84.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.97 0.414 . . . . 10.0 110.135 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -64.37 -49.29 72.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.482 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -58.29 -35.92 72.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.005 0.431 . . . . 10.0 110.26 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -66.35 -52.36 47.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.673 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 93.8 mt -65.69 -38.66 89.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.751 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -78.33 0.02 27.13 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.847 0.684 . . . . 10.0 112.847 -178.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -127.33 -53.58 1.37 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.846 0.355 . . . . 10.0 111.69 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 713' ' ' ASP . . . . . 0.561 ' O ' ' HE2' ' A' ' 828' ' ' LYS . 0.9 OUTLIER -76.15 -39.08 55.82 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.591 -178.461 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -100.6 -14.67 18.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.607 0.225 . . . . 10.0 111.607 -179.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.48 33.06 18.72 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.337 0.589 . . . . 10.0 110.678 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 49.3 tp -115.45 114.09 24.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.171 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -83.53 115.43 22.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.881 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 50.2 mt -133.14 129.52 20.96 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.121 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -86.04 61.6 5.01 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 123.116 2.544 . . . . 10.0 112.035 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 31.3 mt -60.62 -36.95 73.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.274 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -62.69 -30.86 71.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.972 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.12 -39.31 29.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.157 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 34.0 m0 -61.06 -48.36 82.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.155 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 55.2 tp -69.0 -20.02 64.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.682 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -87.61 -46.01 9.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.762 0.315 . . . . 10.0 111.384 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -81.86 -31.69 31.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.464 -0.334 . . . . 10.0 111.698 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -123.16 76.59 51.68 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 116.622 -0.263 . . . . 10.0 110.959 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.5 -18.87 60.54 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.38 2.053 . . . . 10.0 111.784 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.09 -15.95 63.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.301 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 67.3 mt -66.43 -23.35 66.28 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.766 0.317 . . . . 10.0 110.456 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 57.19 -101.98 0.14 Allowed 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 115.528 -0.76 . . . . 10.0 111.303 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -144.8 -47.02 0.24 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.022 0.439 . . . . 10.0 109.907 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -59.5 -51.07 71.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.118 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 3.1 m -62.69 -31.69 72.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.126 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 8.3 mt -60.74 -42.01 96.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.898 0.38 . . . . 10.0 110.198 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -62.69 -43.44 98.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.707 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -62.07 -39.28 91.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.35 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 27.4 mmm-85 -64.48 -46.41 83.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.317 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 90.2 mt -61.94 -43.47 97.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.278 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 54.1 tp -61.5 -52.67 63.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.912 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -58.8 -41.03 85.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.124 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -62.7 -40.75 98.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.967 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 24.3 p -64.46 -30.13 71.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.903 0.382 . . . . 10.0 110.453 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 744' ' ' ILE . . . . . 0.446 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 78.1 mt -73.28 -47.95 44.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 10.0 109.898 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -49.24 78.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.105 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 76.1 t -60.89 -38.12 78.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.064 0.459 . . . . 10.0 110.401 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -65.5 -42.94 91.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.041 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 748' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 97.6 mt-30 -63.02 -37.36 86.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.367 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 -59.59 -34.97 73.41 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.355 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -76.75 -36.83 56.84 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -61.4 -35.64 78.06 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.016 -0.993 . . . . 10.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -68.88 -14.6 63.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.759 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.47 -37.57 5.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.754 0.312 . . . . 10.0 111.639 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.7 t -84.15 -42.75 17.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.864 0.364 . . . . 10.0 111.364 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 126.07 130.69 3.46 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.905 -0.878 . . . . 10.0 110.905 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 756' ' ' ALA . . . . . 0.601 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -56.35 -54.22 48.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.749 0.309 . . . . 10.0 111.603 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -64.1 -38.1 89.82 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.089 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 14.3 tpt -64.86 -43.85 91.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.318 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 70.0 mmm -60.26 -43.97 95.7 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 116.06 -0.518 . . . . 10.0 111.151 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.601 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 15.6 mmp_? -55.23 -41.78 72.52 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.244 0.545 . . . . 10.0 111.06 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -72.97 -35.2 66.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.265 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -66.84 -45.24 78.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.273 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 760' ' ' ARG . 61.8 mt-10 -58.15 -47.07 84.47 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.641 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 764' ' ' LYS . . . . . 0.485 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 83.0 tttt -61.52 -45.72 92.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.785 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -59.88 -48.31 86.72 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.01 -0.614 . . . . 10.0 111.992 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 55.8 t -63.05 -44.63 99.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.617 0.246 . . . . 10.0 110.879 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 21.4 ttt -60.11 -47.91 83.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.813 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 48.0 mt -63.04 -43.01 99.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.644 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -60.39 -48.27 82.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.926 0.393 . . . . 10.0 110.538 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 11.9 m -62.43 -44.17 97.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.735 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 4.4 tt -61.35 -47.33 86.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.622 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 772' ' ' ASP . . . . . 0.578 ' O ' ' HG3' ' A' ' 776' ' ' LYS . 1.9 t70 -62.03 -47.39 84.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.091 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 29.6 m -59.15 -48.06 82.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.424 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 74.5 mt -65.91 -30.35 70.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.979 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -65.48 -40.88 93.64 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.578 ' HG3' ' O ' ' A' ' 772' ' ' ASP . 51.5 mttm -63.01 -39.14 93.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.913 -0.585 . . . . 10.0 109.767 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 777' ' ' GLU . . . . . 0.582 ' HB2' ' HB2' ' B' ' 19' ' ' ALA . 1.3 tp10 -64.73 -42.96 94.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.416 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 778' ' ' HIS . . . . . 0.492 ' O ' ' HG2' ' A' ' 782' ' ' MET . 47.1 t60 -63.49 -41.02 98.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.371 -0.831 . . . . 10.0 110.575 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 39.5 mt -56.26 -50.59 70.9 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 123.335 0.397 . . . . 10.0 110.421 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -65.62 -44.04 87.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.78 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.2 73.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.671 -179.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 782' ' ' MET . . . . . 0.492 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 91.6 mmm -61.0 -41.98 97.56 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.909 0.385 . . . . 10.0 110.929 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -75.49 -33.35 60.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.583 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -60.86 -39.26 88.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.932 0.396 . . . . 10.0 110.257 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.1 tp -76.23 -32.16 58.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.576 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -65.63 -38.96 90.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.617 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -65.7 -48.5 71.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.529 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -82.93 25.34 4.74 Favored Glycine 0 CA--C 1.518 0.258 0 CA-C-N 115.849 -0.614 . . . . 10.0 113.539 -178.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 10.2 tp -64.0 -18.13 21.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.996 0.427 . . . . 10.0 110.779 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -61.98 -29.86 70.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.855 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 99.3 mt -94.94 -12.39 26.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.413 -179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -94.57 -35.85 12.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.856 0.36 . . . . 10.0 110.859 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -91.87 75.62 1.42 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.579 -0.82 . . . . 10.0 112.781 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -84.54 -172.39 4.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.718 0.294 . . . . 10.0 110.614 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -70.22 150.03 46.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.691 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 65.12 22.58 12.31 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.612 -0.722 . . . . 10.0 111.665 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -148.14 133.09 18.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.432 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 798' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 799' ' ' PRO . 19.5 t70 -76.46 120.95 83.9 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.964 -0.384 . . . . 10.0 109.964 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 799' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 798' ' ' ASP . 35.9 Cg_exo -58.44 -30.12 90.52 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.049 2.499 . . . . 10.0 113.533 -179.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 800' ' ' LYS . . . . . 0.547 ' HB2' ' HZ2' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -78.64 -47.06 17.8 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.859 -0.336 . . . . 10.0 110.354 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -61.92 -40.89 97.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.545 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -64.09 -43.73 94.49 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 92.0 t80 -60.6 -43.34 97.52 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.219 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -58.3 -50.85 72.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.847 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -59.29 -45.9 90.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.864 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.2 -41.8 93.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.531 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 26.7 m -65.51 -34.76 79.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.904 -0.589 . . . . 10.0 111.146 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 21.6 m-30 -65.81 -43.2 89.35 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.975 0.417 . . . . 10.0 110.042 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 32.2 m -65.93 -36.34 83.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.428 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 29.2 ttm -65.49 -37.59 87.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.25 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -67.98 -43.04 79.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.21 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 812' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 816' ' ' GLU . . . -59.47 -49.14 78.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.965 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.89 -32.33 73.57 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.941 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 29.5 ttp -65.82 -44.55 85.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.008 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.53 -36.48 83.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.511 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 816' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 812' ' ' ALA . 18.0 mm-40 -63.37 -42.03 98.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.299 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 12.8 m -74.09 -29.82 62.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.523 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 50.6 tp -60.46 -58.47 8.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.757 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 40.4 pttt -60.73 -32.63 71.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.541 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -64.57 -59.01 4.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.645 -0.707 . . . . 10.0 111.322 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -60.87 -39.74 90.36 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.339 0.496 . . . . 10.0 112.339 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 54.7 t -57.66 -50.24 78.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.841 0.353 . . . . 10.0 110.66 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.1 -38.72 72.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.904 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 38.6 m -61.93 -40.1 94.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.626 0.25 . . . . 10.0 110.615 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 74.7 m -63.94 -41.26 97.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.709 0.29 . . . . 10.0 110.769 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 87.7 mt -69.76 -19.63 63.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.235 0.54 . . . . 10.0 110.871 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 16.9 m -92.42 -36.82 12.91 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.753 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 828' ' ' LYS . . . . . 0.561 ' HE2' ' O ' ' A' ' 713' ' ' ASP . 44.1 mttm -69.66 -28.99 66.34 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.966 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 5.7 p -66.82 108.15 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.688 0.756 . . . . 10.0 109.908 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -98.73 99.88 11.03 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.75 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 21.7 t -79.72 133.95 28.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.991 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 832' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 832' ' ' ARG . 7.0 ptt-85 -71.82 98.35 1.97 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.371 0.605 . . . . 10.0 110.356 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 15.2 ptp -91.63 140.12 25.13 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.64 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -64.87 158.68 49.85 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.334 2.023 . . . . 10.0 111.426 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 -51.96 113.7 1.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.778 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.601 -0.714 . . . . 10.0 110.224 -179.587 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 22.0 ttt . . . . . 0 N--CA 1.479 0.976 0 N-CA-C 110.108 -0.33 . . . . 10.0 110.108 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 26.0 ttp -62.34 140.9 58.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.478 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.0 mt -82.23 86.56 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.906 0.384 . . . . 10.0 110.281 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.41 135.02 55.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.893 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 35.0 tp -76.17 131.95 39.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.704 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.414 ' H ' ' HG2' ' B' ' 6' ' ' ARG . 18.3 ptt-85 -79.35 62.91 3.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.319 0.58 . . . . 10.0 111.291 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 40.7 tttp -80.68 78.26 7.45 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.843 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' B' ' 8' ' ' ARG . 3.0 mmp_? -122.03 5.45 9.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.31 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -120.45 125.53 48.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.204 179.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -147.11 106.67 3.93 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.032 0.444 . . . . 10.0 110.347 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.0 tp -130.21 86.01 55.29 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.497 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -75.16 -2.67 12.85 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.961 2.441 . . . . 10.0 112.17 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 77.4 mt -83.2 6.34 19.73 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.501 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.26 -41.26 96.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.028 0.442 . . . . 10.0 110.269 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.469 ' HB ' ' OE1' ' A' ' 777' ' ' GLU . 4.0 m -82.71 -26.74 8.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.622 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.05 -32.29 69.62 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.326 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 48.2 t -75.61 -27.2 18.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.067 0.46 . . . . 10.0 110.297 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.08 -41.4 25.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.332 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.582 ' HB2' ' HB2' ' A' ' 777' ' ' GLU . . . -76.46 -41.15 48.35 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.928 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -82.33 40.58 2.72 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.783 -0.644 . . . . 10.0 113.349 -178.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.528 HG13 ' OD1' ' A' ' 367' ' ' ASN . 3.1 t -76.04 -20.47 15.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.357 0.599 . . . . 10.0 109.823 179.219 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.487 ' HB2' HD13 ' A' ' 372' ' ' LEU . 9.2 ttt -106.76 23.49 14.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.855 -0.612 . . . . 10.0 111.105 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -71.83 137.24 47.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.844 0.354 . . . . 10.0 110.685 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.44 85.63 1.51 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.194 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -158.99 138.48 11.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.687 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -137.14 155.26 49.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.841 0.353 . . . . 10.0 111.357 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.27 -10.55 1.26 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.388 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.533 -0.746 . . . . 10.0 110.547 179.856 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -99.39 139.45 35.02 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.96 0.409 . . . . 10.0 110.635 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 130.38 178.84 15.64 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.903 -0.665 . . . . 10.0 111.972 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.2 m -68.64 116.58 9.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.801 0.334 . . . . 10.0 110.181 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.53 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 17.3 mmt180 -67.54 155.16 39.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.042 -0.527 . . . . 10.0 111.345 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.3 m120 73.65 -49.56 0.69 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.264 -0.88 . . . . 10.0 112.318 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -90.53 -71.26 0.63 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.824 0.675 . . . . 10.0 112.824 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -65.2 -18.25 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 -177.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.51 -52.74 64.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.684 0.278 . . . . 10.0 111.159 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 mt -67.06 -33.4 75.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.946 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 19' ' ' ARG . 12.4 ttp-105 -66.78 -45.05 79.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.384 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.54 -28.41 64.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.129 0.49 . . . . 10.0 109.996 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.554 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 45.3 mtt -76.22 -36.23 58.66 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.842 179.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -60.97 -35.64 77.31 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -60.37 -38.0 82.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.432 -0.803 . . . . 10.0 109.532 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -77.1 -35.36 22.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.848 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.9 t -58.13 -36.16 55.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.95 178.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.5 -37.44 87.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.729 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.3 mt -68.3 -44.0 84.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.716 -0.674 . . . . 10.0 109.704 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 77.6 mt -59.78 -40.57 82.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.774 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -63.64 -38.42 91.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.377 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.56 -28.32 65.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.006 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 53.4 mtt -84.11 -17.53 39.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.138 -0.483 . . . . 10.0 111.61 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.509 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 17.9 tt0 -57.46 -54.62 53.11 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-O 119.271 -0.395 . . . . 10.0 111.646 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 38.2 Cg_exo -61.05 -28.25 85.74 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.755 1.637 . . . . 10.0 111.516 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -69.51 -43.99 71.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.613 -0.722 . . . . 10.0 109.924 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 25.9 mmt -69.37 -29.03 66.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.355 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -62.68 -27.24 69.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.768 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -79.97 -16.45 55.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.709 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp -84.01 147.8 27.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.301 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 p -76.6 165.56 24.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.103 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.54 -43.17 84.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.865 0.364 . . . . 10.0 111.449 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -68.59 -28.08 66.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.922 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -69.79 -33.09 71.9 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.669 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.5 mt -61.94 -40.38 95.32 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -67.23 -32.4 73.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.14 -0.936 . . . . 10.0 109.552 178.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.97 -35.99 92.84 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.474 -0.785 . . . . 10.0 111.687 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -65.6 -37.3 86.23 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 28.1 m -61.38 -47.35 86.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.282 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.82 -30.02 70.1 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.236 0.541 . . . . 10.0 110.144 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -66.26 -45.66 79.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.441 -0.799 . . . . 10.0 110.564 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -59.64 -37.95 80.07 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.048 0.452 . . . . 10.0 110.252 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -57.95 -41.74 83.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.729 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.16 -41.47 61.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.994 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -60.48 -36.37 78.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.35 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.39 -38.13 89.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.771 0.319 . . . . 10.0 111.035 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -70.37 -28.12 64.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.421 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -69.16 -33.57 73.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.368 179.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 132.19 16.77 1.34 Allowed Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.532 -0.842 . . . . 10.0 113.069 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -77.3 149.55 35.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.926 0.393 . . . . 10.0 110.145 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.1 t -86.86 131.82 33.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.19 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.541 HD11 ' O ' ' A' ' 118' ' ' LEU . 18.8 tp -58.8 -39.87 82.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.135 0.493 . . . . 10.0 110.864 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.408 ' HG3' ' ND2' ' A' ' 95' ' ' ASN . 14.6 mp0 -68.0 -10.49 54.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.39 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -97.91 -13.52 21.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.301 0.572 . . . . 10.0 110.112 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.5 mt -91.6 -7.06 51.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.887 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.509 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 75.2 mt -49.99 -51.52 60.84 Favored Pre-proline 0 CA--C 1.541 0.622 0 N-CA-C 113.192 0.812 . . . . 10.0 113.192 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.509 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 62.2 Cg_exo -52.08 -51.17 11.73 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 122.085 1.856 . . . . 10.0 113.209 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -71.25 -42.75 68.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.65 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.427 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -61.05 -49.72 76.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.806 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -63.84 -35.2 79.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.321 -0.399 . . . . 10.0 111.025 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.28 -45.58 90.79 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 120.872 0.367 . . . . 10.0 110.494 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 70.1 t -61.74 -47.14 94.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.469 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 67' ' ' ALA . 63.4 t -61.73 -41.97 92.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.955 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.458 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 7.0 ttm180 -59.43 -49.36 78.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.927 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.45 ' HA ' ' OE1' ' A' ' 73' ' ' GLU . 35.1 tp10 -65.83 -40.21 91.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.917 0.389 . . . . 10.0 110.39 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.71 -32.46 71.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.136 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 17.2 m -68.27 -33.5 74.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.416 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.1 mtmm -72.35 -24.07 61.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.25 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 67.7 mtt180 -97.16 -50.35 4.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 96.8 t -67.5 -61.52 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.713 0.292 . . . . 10.0 111.24 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -82.75 -59.62 2.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.849 0.357 . . . . 10.0 110.937 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 131.08 -27.95 3.74 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.535 -0.626 . . . . 10.0 111.535 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -90.69 138.4 31.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.897 0.379 . . . . 10.0 110.594 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 82' ' ' ARG . 12.4 ttp180 -80.86 139.69 35.8 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.596 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.27 109.0 2.93 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -53.35 147.03 11.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.799 -0.637 . . . . 10.0 111.967 -178.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.07 -35.54 77.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.318 -0.855 . . . . 10.0 111.165 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.2 m -65.62 -28.94 45.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.83 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -75.02 -30.56 61.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.22 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.5 mt -63.31 -36.26 83.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.235 -0.439 . . . . 10.0 109.866 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.433 ' O ' HG23 ' A' ' 93' ' ' VAL . 48.9 mt -64.98 -47.94 75.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.83 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -64.75 -39.36 96.59 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.908 -0.663 . . . . 10.0 111.961 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.9 -35.2 91.7 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.021 -0.609 . . . . 10.0 112.301 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.554 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 18.5 ttm -71.03 -34.47 71.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.04 0.447 . . . . 10.0 110.008 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 89' ' ' LEU . 68.7 t -67.56 -37.04 78.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.505 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.35 6.28 2.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.533 -0.758 . . . . 10.0 112.915 -178.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.408 ' ND2' ' HG3' ' A' ' 61' ' ' GLU . 50.0 t30 -88.82 -20.75 24.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.301 0.572 . . . . 10.0 109.882 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -117.31 -176.95 3.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.405 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.579 ' HA ' ' O ' ' A' ' 387' ' ' LEU . 6.7 ttt85 -76.36 74.95 3.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.121 0.486 . . . . 10.0 111.037 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -142.81 154.66 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.235 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.535 HD12 HG11 ' A' ' 211' ' ' VAL . 36.3 mm -108.61 124.2 64.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.013 -0.736 . . . . 10.0 109.013 178.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -100.75 111.54 23.79 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.744 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.43 125.39 29.88 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.914 -0.772 . . . . 10.0 108.914 178.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 47.9 ttm -130.56 147.6 52.26 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.006 0.431 . . . . 10.0 110.793 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.527 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 13.0 mmm180 -76.59 153.93 34.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.964 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.32 99.25 1.91 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.022 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 139.42 -23.78 2.82 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.471 -0.871 . . . . 10.0 112.839 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -68.78 -20.48 64.35 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.932 0.396 . . . . 10.0 111.073 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.16 70.48 1.32 Allowed Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 121.039 -0.6 . . . . 10.0 113.065 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.3 ptmm? -68.34 -32.79 73.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.329 . . . . 10.0 110.974 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -36.02 80.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 10.0 111.192 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 24.2 tp -78.07 -18.32 55.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.212 0.529 . . . . 10.0 110.474 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 60.2 m -82.11 -29.43 31.71 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.365 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.44 -23.89 67.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.563 -0.744 . . . . 10.0 112.205 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.18 -23.92 66.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.234 0.457 . . . . 10.0 112.234 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 58.3 mt -70.65 -59.26 3.89 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.156 0.428 . . . . 10.0 112.156 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.36 -28.25 63.15 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.929 1.752 . . . . 10.0 111.883 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.72 -50.19 65.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.459 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.442 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 63.0 t80 -60.87 -45.89 92.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.026 0.441 . . . . 10.0 110.504 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.541 ' O ' HD11 ' A' ' 60' ' ' LEU . 23.9 tp -59.47 -54.61 44.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.865 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -70.5 -20.54 62.83 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.413 0.523 . . . . 10.0 112.413 -178.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.549 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -71.9 -29.79 64.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.729 0.3 . . . . 10.0 110.763 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 65.4 mt -56.8 -25.53 55.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.791 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 73.1 p -69.22 -25.15 64.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.887 0.375 . . . . 10.0 111.35 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 82.15 -1.13 87.81 Favored Glycine 0 CA--C 1.519 0.318 0 C-N-CA 121.019 -0.61 . . . . 10.0 112.624 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -74.13 -33.95 63.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.92 0.39 . . . . 10.0 110.813 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 115.8 131.57 4.91 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.493 -0.86 . . . . 10.0 113.341 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 73.9 t -106.22 112.96 41.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -94.13 105.41 17.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.887 0.375 . . . . 10.0 110.481 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 55.4 t -91.73 116.91 33.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.165 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 82.8 t -98.11 112.54 30.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.323 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.27 158.47 15.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.528 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 16.0 m -66.74 -24.11 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -154.81 170.69 21.04 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.965 -0.383 . . . . 10.0 109.965 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -78.54 -24.24 45.77 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.177 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -62.49 -55.04 31.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.956 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.9 mt -71.11 -29.25 65.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.558 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.67 -53.53 56.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.782 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.21 -30.09 64.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.459 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -63.55 -54.74 31.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.296 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ASP . . . . . 0.464 ' HA ' ' HB3' ' A' ' 142' ' ' ASN . 0.5 OUTLIER -75.87 -20.02 58.41 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.711 -0.396 . . . . 10.0 112.034 -178.402 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.65 -35.74 81.54 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -84.47 -27.94 27.13 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.189 -0.914 . . . . 10.0 110.05 178.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ASN . . . . . 0.464 ' HB3' ' HA ' ' A' ' 139' ' ' ASP . 38.8 t30 -67.82 -47.57 68.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.093 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -86.48 -4.92 59.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.541 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.503 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 56.1 ttm-85 -58.82 -49.86 91.14 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' PRO . . . . . 0.503 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 27.6 Cg_exo -63.6 -7.3 12.35 Favored 'Trans proline' 0 C--N 1.36 1.171 0 C-N-CA 122.32 2.013 . . . . 10.0 113.031 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 19.8 tp -100.35 -50.14 4.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.948 0.404 . . . . 10.0 110.346 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -65.83 -50.6 64.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.667 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -67.12 -21.15 65.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.885 0.374 . . . . 10.0 111.119 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -69.4 -34.63 74.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.312 0.577 . . . . 10.0 109.613 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.415 HD13 ' CE1' ' A' ' 117' ' ' TYR . 39.5 mt -89.26 -22.65 22.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.262 -0.881 . . . . 10.0 110.72 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.7 4.44 11.74 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.21 -0.995 . . . . 10.0 113.831 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 36.6 mt -88.86 134.15 34.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.949 0.375 . . . . 10.0 110.135 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 7.0 p -83.4 128.1 34.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.388 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.464 HG21 ' HA ' ' A' ' 144' ' ' ARG . 4.8 t -104.52 111.87 35.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.858 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -107.91 145.03 16.18 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 111.647 -0.581 . . . . 10.0 111.647 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.4 tp -122.08 127.36 75.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 120.798 0.332 . . . . 10.0 110.153 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -112.21 115.08 28.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.122 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 92.2 mt -107.97 148.29 37.14 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.31 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' PRO . . . . . 0.501 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 19.2 Cg_endo -58.91 112.46 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 122.71 2.273 . . . . 10.0 112.691 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.75 -1.53 48.74 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.689 -0.767 . . . . 10.0 112.927 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' MET . . . . . 0.516 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 49.9 ttm -59.2 138.31 88.31 Favored Pre-proline 0 C--N 1.326 -0.424 0 C-N-CA 122.195 0.198 . . . . 10.0 110.745 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -53.68 144.42 53.49 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.812 2.341 . . . . 10.0 112.654 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' ALA . . . . . 0.468 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.18 -49.08 86.7 Favored Pre-proline 0 CA--C 1.54 0.584 0 N-CA-C 113.202 0.816 . . . . 10.0 113.202 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 31.9 Cg_exo -60.38 -32.78 94.38 Favored 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 121.771 1.647 . . . . 10.0 112.26 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.13 -37.85 63.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.577 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.516 ' HE2' ' O ' ' A' ' 161' ' ' MET . 60.6 mttm -60.49 -40.5 91.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.708 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -64.23 -27.97 69.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.116 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -78.12 -18.92 55.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.971 0.415 . . . . 10.0 110.779 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -96.27 -39.64 9.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.932 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -73.08 -27.02 61.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.327 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 171' ' ' ALA . . . . . 0.47 ' HA ' ' NE ' ' A' ' 201' ' ' ARG . . . -82.99 -3.23 56.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.959 0.409 . . . . 10.0 110.784 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -80.25 169.64 17.5 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.408 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' ASP . . . . . 0.549 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 11.9 m-20 -64.9 -47.25 78.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.199 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.8 mp -124.04 130.33 73.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.142 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.7 m -118.49 112.19 19.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.853 0.359 . . . . 10.0 111.16 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -88.73 137.54 32.23 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.492 -0.558 . . . . 10.0 109.492 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -174.63 174.88 46.8 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.219 -0.991 . . . . 10.0 112.898 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.59 149.06 21.86 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.608 0.242 . . . . 10.0 110.777 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -58.4 -38.02 76.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.729 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -59.19 -52.26 66.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.364 -179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.501 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.5 tp10 -68.18 -38.02 81.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.836 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -57.99 -37.59 74.54 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.99 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -73.54 -43.35 37.23 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.929 -0.653 . . . . 10.0 111.848 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -65.51 -38.84 90.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.695 0.283 . . . . 10.0 110.628 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 185' ' ' ASP . . . . . 0.449 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 20.2 m-20 -60.54 -44.13 96.44 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.008 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -61.94 -39.97 93.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.568 -0.742 . . . . 10.0 110.449 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 75.8 mt -66.98 -44.1 81.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.509 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 56.9 mtm-85 -63.81 -41.69 97.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.781 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 189' ' ' ASP . . . . . 0.427 ' OD1' HG22 ' A' ' 199' ' ' VAL . 0.4 OUTLIER -64.44 -31.22 72.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.267 0.556 . . . . 10.0 110.88 179.732 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -80.1 -14.87 58.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.163 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 35.6 mtp -103.66 17.08 24.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.963 0.411 . . . . 10.0 111.099 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -80.35 162.24 24.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.333 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -104.13 -25.12 13.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.342 0.592 . . . . 10.0 109.927 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -128.6 139.3 35.18 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.56 -0.746 . . . . 10.0 109.357 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.58 -22.7 73.35 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.528 2.152 . . . . 10.0 111.983 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 48.0 mp0 -71.83 -15.88 62.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.14 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -84.61 -17.78 37.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.272 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 24.6 mtt85 -55.36 137.85 47.0 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 123.481 0.488 . . . . 10.0 111.53 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 199' ' ' VAL . . . . . 0.427 HG22 ' OD1' ' A' ' 189' ' ' ASP . 22.6 m -110.15 -20.38 6.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.998 -0.547 . . . . 10.0 111.287 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -90.74 -175.09 4.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.339 0.59 . . . . 10.0 111.552 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 201' ' ' ARG . . . . . 0.47 ' NE ' ' HA ' ' A' ' 171' ' ' ALA . 11.2 mtm180 -140.29 -174.41 3.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.611 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 26.5 mttm -55.61 137.83 48.24 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.239 0.542 . . . . 10.0 111.804 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 18.5 mt -86.37 66.65 9.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.619 -0.719 . . . . 10.0 109.692 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -74.68 -72.7 0.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.661 -0.7 . . . . 10.0 112.235 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 205' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' A' ' 386' ' ' LYS . 29.1 t80 -122.33 135.91 54.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.008 0.432 . . . . 10.0 111.778 -177.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.49 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -128.07 123.74 35.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.369 -0.832 . . . . 10.0 109.499 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 64.4 tp -119.83 110.52 16.86 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.334 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -100.54 130.62 49.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.355 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -58.47 -65.38 0.66 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.798 -0.637 . . . . 10.0 111.984 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 210' ' ' GLU . . . . . 0.469 ' OE2' ' HA ' ' A' ' 391' ' ' THR . 17.6 tp10 -112.75 110.39 20.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.006 0.432 . . . . 10.0 110.482 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.535 HG11 HD12 ' A' ' 99' ' ' ILE . 28.4 m -82.91 -18.83 10.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.237 -0.438 . . . . 10.0 112.083 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 212' ' ' ASP . . . . . 0.483 ' OD1' ' HD2' ' A' ' 566' ' ' ARG . 7.2 t70 -51.87 -72.22 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.23 19.24 2.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.749 0.648 . . . . 10.0 112.749 -177.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 214' ' ' ILE . . . . . 0.4 ' O ' ' HB2' ' A' ' 218' ' ' GLU . 36.3 mt -125.04 -50.52 2.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.624 -0.431 . . . . 10.0 112.002 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 18.8 mt -82.7 -30.31 29.25 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 35.0 mm -98.43 -50.99 10.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.785 -0.366 . . . . 10.0 111.466 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.56 -46.54 72.42 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.02 0.378 . . . . 10.0 112.02 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 218' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 214' ' ' ILE . 5.8 mm-40 -95.89 31.97 1.99 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.687 0.28 . . . . 10.0 111.602 -178.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 219' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 378' ' ' GLN . . . -72.91 -51.94 16.61 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.826 0.346 . . . . 10.0 111.789 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 220' ' ' ARG . . . . . 0.474 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -93.8 22.06 5.95 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -178.085 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 4.1 m -88.74 108.99 26.46 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.94 -0.392 . . . . 10.0 109.94 178.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 222' ' ' PRO . . . . . 0.474 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 87.0 Cg_endo -93.47 134.16 0.98 Allowed 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.054 2.503 . . . . 10.0 113.789 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 223' ' ' LEU . . . . . 0.582 ' O ' ' HA ' ' A' ' 374' ' ' SER . 86.5 mt -94.04 110.46 22.15 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.875 -0.787 . . . . 10.0 108.875 178.081 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 224' ' ' ILE . . . . . 0.414 HG12 ' OG ' ' A' ' 374' ' ' SER . 22.1 mt -105.72 125.59 61.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 120.809 0.338 . . . . 10.0 111.32 -179.082 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 54.0 mt -82.17 110.6 17.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.88 101.79 0.88 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.286 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -120.67 93.41 0.53 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.017 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -73.97 81.13 1.99 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.764 2.31 . . . . 10.0 112.218 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -145.02 109.34 4.87 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.397 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 230' ' ' GLU . . . . . 0.401 ' HG2' ' H ' ' A' ' 231' ' ' ASP . 15.5 tt0 -167.72 165.43 14.22 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 231' ' ' ASP . . . . . 0.481 ' HB3' HG13 ' B' ' 17' ' ' VAL . 2.7 t0 -123.44 56.81 1.18 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.538 0.685 . . . . 10.0 109.909 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -18.65 57.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.297 -0.865 . . . . 10.0 110.758 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -31.24 64.18 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.255 -0.884 . . . . 10.0 111.881 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -107.83 -41.14 5.07 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 121.119 -0.232 . . . . 10.0 111.017 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 235' ' ' MET . . . . . 0.669 ' HB2' HG11 ' B' ' 17' ' ' VAL . 22.9 tpp -54.73 -56.49 18.68 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -73.36 -31.1 63.74 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.956 0.354 . . . . 10.0 111.956 -178.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -70.1 -39.57 75.43 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.567 -0.288 . . . . 10.0 111.19 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 11.6 tpp180 -69.95 -45.51 67.3 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.856 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 11.1 p -66.84 -33.49 63.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.752 0.31 . . . . 10.0 111.742 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 240' ' ' ASN . . . . . 0.411 ' ND2' ' HA ' ' A' ' 360' ' ' LYS . 66.7 t30 -90.06 15.96 9.22 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.151 0.5 . . . . 10.0 110.893 -179.591 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.68 -7.87 23.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.018 0.437 . . . . 10.0 110.537 179.306 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 10.5 tp -101.76 -27.33 3.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.938 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 243' ' ' ILE . . . . . 0.423 ' HB ' ' HD3' ' A' ' 244' ' ' PRO . 42.6 mt -62.56 -47.65 88.0 Favored Pre-proline 0 CA--C 1.539 0.524 0 N-CA-C 112.254 0.464 . . . . 10.0 112.254 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 244' ' ' PRO . . . . . 0.423 ' HD3' ' HB ' ' A' ' 243' ' ' ILE . 9.4 Cg_exo -73.6 32.54 0.32 Allowed 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 122.284 1.99 . . . . 10.0 112.655 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 245' ' ' HIS . . . . . 0.407 ' H ' ' C ' ' A' ' 243' ' ' ILE . 7.4 t-80 -141.27 8.24 2.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.035 0.445 . . . . 10.0 109.922 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 40.7 mt -94.13 -166.0 1.42 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.763 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 247' ' ' ILE . . . . . 0.446 ' O ' ' HB3' ' A' ' 253' ' ' ASP . 73.4 mt -107.1 114.51 46.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 109.017 -0.735 . . . . 10.0 109.017 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 248' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 248' ' ' ARG . 0.2 OUTLIER -66.03 73.2 0.07 Allowed 'General case' 0 N--CA 1.466 0.337 0 O-C-N 123.732 0.645 . . . . 10.0 112.223 -178.447 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -179.21 -44.55 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.346 -0.843 . . . . 10.0 109.576 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -126.43 -167.88 1.78 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.982 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt 42.31 46.77 4.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.875 0.87 . . . . 10.0 112.375 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 252' ' ' GLU . . . . . 0.403 ' HB2' HD11 ' A' ' 285' ' ' LEU . 6.8 mm-40 64.88 -1.73 0.79 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.867 1.432 . . . . 10.0 114.867 177.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 253' ' ' ASP . . . . . 0.446 ' HB3' ' O ' ' A' ' 247' ' ' ILE . 46.4 t0 -80.12 70.35 6.71 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.659 0.663 . . . . 10.0 110.466 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 4.8 p 179.48 -105.69 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.117 -0.947 . . . . 10.0 109.641 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -149.0 12.47 0.86 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 256' ' ' THR . . . . . 0.403 HG21 ' HA ' ' A' ' 276' ' ' GLU . 4.6 m 53.11 69.77 0.66 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 114.664 -1.153 . . . . 10.0 111.878 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 257' ' ' PHE . . . . . 0.554 ' CD1' ' HA2' ' A' ' 261' ' ' GLY . 56.7 m-85 -87.15 0.63 55.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.058 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 258' ' ' GLN . . . . . 0.401 ' HB2' ' HG3' ' A' ' 277' ' ' ARG . 42.6 tt0 67.3 -75.51 0.06 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.339 -0.846 . . . . 10.0 111.075 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -165.1 41.03 0.29 Allowed Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.87 -0.681 . . . . 10.0 111.983 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -157.37 -82.39 0.06 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.892 0.377 . . . . 10.0 110.939 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 261' ' ' GLY . . . . . 0.554 ' HA2' ' CD1' ' A' ' 257' ' ' PHE . . . 103.03 -112.25 4.2 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.849 -0.691 . . . . 10.0 111.793 -179.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -145.71 -83.33 0.13 Allowed 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.29 -0.263 . . . . 10.0 110.29 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -169.61 172.45 6.91 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.238 -0.653 . . . . 10.0 109.238 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 15.7 m -65.52 99.32 0.42 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.078 0.466 . . . . 10.0 111.23 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 7.1 p -159.76 -42.97 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.103 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -161.19 176.62 11.07 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.53 3.5 27.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.002 0.43 . . . . 10.0 110.378 -179.436 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 268' ' ' LYS . . . . . 0.444 ' HD3' ' O ' ' A' ' 318' ' ' ALA . 2.2 ptpp? -143.9 171.91 13.58 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.628 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 3.1 m -116.48 -142.76 0.37 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.245 179.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -156.2 -22.86 0.1 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.698 -0.401 . . . . 10.0 111.934 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 13.7 pm0 -78.18 -16.03 58.27 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.491 0.182 . . . . 10.0 111.491 -179.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 272' ' ' VAL . . . . . 0.89 HG22 ' HG ' ' A' ' 319' ' ' LEU . 23.7 t 70.34 -73.14 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 122.886 0.474 . . . . 10.0 110.486 -179.12 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.02 44.09 26.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.978 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 2.8 mm? 61.04 -158.79 0.33 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.672 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 5.5 t -154.5 -179.68 8.2 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.23 -0.285 . . . . 10.0 110.23 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 276' ' ' GLU . . . . . 0.403 ' HA ' HG21 ' A' ' 256' ' ' THR . 0.4 OUTLIER 70.34 135.54 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 O-C-N 124.23 0.956 . . . . 10.0 111.655 -179.397 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 277' ' ' ARG . . . . . 0.401 ' HG3' ' HB2' ' A' ' 258' ' ' GLN . 1.0 OUTLIER 176.47 22.69 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.655 -1.157 . . . . 10.0 109.074 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.419 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . -122.01 -35.52 0.77 Allowed Glycine 0 N--CA 1.442 -0.9 0 C-N-CA 120.453 -0.88 . . . . 10.0 112.621 -178.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 278' ' ' GLY . 3.5 mm? 70.87 -50.14 0.68 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.275 0.63 . . . . 10.0 111.561 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 10.5 p -75.43 -21.96 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.197 0.522 . . . . 10.0 110.649 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 281' ' ' LEU . . . . . 0.415 HD13 ' HA3' ' A' ' 278' ' ' GLY . 4.6 mp -72.86 -37.5 67.36 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.038 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 43.3 pt -79.21 -10.02 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 N-CA-C 111.721 0.267 . . . . 10.0 111.721 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -63.79 -39.23 93.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.07 0.462 . . . . 10.0 109.88 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.12 22.58 1.41 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.635 -0.712 . . . . 10.0 111.148 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 285' ' ' LEU . . . . . 0.403 HD11 ' HB2' ' A' ' 252' ' ' GLU . 15.1 mt -113.23 -20.13 11.53 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.334 0.588 . . . . 10.0 109.516 178.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 5.5 mt -111.85 -179.75 3.78 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.527 -0.76 . . . . 10.0 110.171 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 287' ' ' VAL . . . . . 0.444 ' HA ' ' HA ' ' A' ' 293' ' ' ASP . 12.0 t 55.35 67.16 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 O-C-N 123.606 0.566 . . . . 10.0 111.673 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.71 150.1 0.64 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.528 178.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 67.78 -76.99 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 O-C-N 124.052 0.845 . . . . 10.0 111.445 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 290' ' ' GLY . . . . . 0.437 ' O ' ' HB ' ' A' ' 291' ' ' ILE . . . 171.14 154.19 9.52 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.366 -0.921 . . . . 10.0 112.429 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 291' ' ' ILE . . . . . 0.446 HD11 ' O ' ' B' ' 11' ' ' LEU . 88.4 mt 77.57 110.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.258 0.623 . . . . 10.0 110.317 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 292' ' ' MET . . . . . 0.458 ' O ' ' HG2' ' A' ' 292' ' ' MET . 25.0 ttp 70.64 5.26 5.34 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.705 0.764 . . . . 10.0 110.206 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 293' ' ' ASP . . . . . 0.444 ' HA ' ' HA ' ' A' ' 287' ' ' VAL . 10.3 p-10 -77.03 -13.63 59.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.777 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -64.26 -34.13 77.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.431 179.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 133.67 106.89 0.97 Allowed Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.779 -0.646 . . . . 10.0 111.908 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -153.57 -172.6 4.28 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 297' ' ' SER . . . . . 0.521 ' HB2' ' OG ' ' A' ' 300' ' ' SER . 4.6 m -115.15 141.26 48.26 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.962 0.411 . . . . 10.0 110.408 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.9 tp -83.28 11.11 7.1 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.995 0.426 . . . . 10.0 111.131 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -131.49 9.73 4.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.086 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 300' ' ' SER . . . . . 0.521 ' OG ' ' HB2' ' A' ' 297' ' ' SER . 11.7 m -64.49 145.47 98.47 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.86 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -51.48 -42.81 53.65 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 123.244 2.629 . . . . 10.0 113.269 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -78.92 -8.25 58.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.836 0.351 . . . . 10.0 111.445 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -106.65 15.08 26.15 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.134 0.492 . . . . 10.0 110.492 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 8.7 tp -63.75 -29.15 46.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.657 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 15.5 tmm? -61.63 -50.86 70.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.775 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 29.7 tp -69.42 -39.23 78.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.136 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 19.3 ttt -57.71 -41.61 82.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.864 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -80.53 -15.37 56.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.747 0.308 . . . . 10.0 111.009 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 28.3 m170 -87.15 -42.43 13.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.662 -0.245 . . . . 10.0 110.583 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 27.0 m -68.02 -33.58 61.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.817 0.341 . . . . 10.0 110.834 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 1.3 p -68.61 -23.45 64.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.912 0.387 . . . . 10.0 111.058 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 312' ' ' ALA . . . . . 0.467 ' HA ' ' NE ' ' A' ' 315' ' ' ARG . . . -69.67 -51.86 30.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.089 0.471 . . . . 10.0 109.936 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 313' ' ' ALA . . . . . 0.411 ' HA ' ' HB1' ' A' ' 356' ' ' ALA . . . -71.14 -24.02 62.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.632 -0.713 . . . . 10.0 111.131 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 314' ' ' LEU . . . . . 0.402 HD11 ' O ' ' A' ' 252' ' ' GLU . 12.4 tp -78.13 -46.15 21.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.673 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 315' ' ' ARG . . . . . 0.467 ' NE ' ' HA ' ' A' ' 312' ' ' ALA . 3.7 ptp180 -67.3 -27.85 67.52 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.005 0.431 . . . . 10.0 110.171 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 316' ' ' ALA . . . . . 0.445 ' O ' ' HE2' ' A' ' 360' ' ' LYS . . . -82.39 3.31 28.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.061 0.457 . . . . 10.0 110.319 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -99.53 -10.24 22.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.053 -0.522 . . . . 10.0 111.078 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.444 ' O ' ' HD3' ' A' ' 268' ' ' LYS . . . -144.73 -51.8 0.29 Allowed 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.066 0.395 . . . . 10.0 112.066 -179.229 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 319' ' ' LEU . . . . . 0.89 ' HG ' HG22 ' A' ' 272' ' ' VAL . 2.4 mm? -67.5 -34.66 77.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.552 -0.295 . . . . 10.0 111.622 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -107.14 112.46 25.37 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.027 0.442 . . . . 10.0 110.117 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.62 123.14 47.66 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.701 -179.115 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 322' ' ' ARG . . . . . 0.562 ' HB3' ' CZ ' ' A' ' 326' ' ' TYR . 7.9 ptm180 -70.71 160.77 32.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.574 -0.284 . . . . 10.0 110.672 179.411 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 323' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 78.54 -12.27 1.1 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.007 0.923 . . . . 10.0 111.585 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 15.0 p -134.26 -42.36 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 111.758 0.281 . . . . 10.0 111.758 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -90.88 -24.0 20.35 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.456 0.646 . . . . 10.0 109.713 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 326' ' ' TYR . . . . . 0.562 ' CZ ' ' HB3' ' A' ' 322' ' ' ARG . 31.9 p90 -163.11 150.67 13.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.149 -0.932 . . . . 10.0 109.09 179.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 8.9 tp -127.58 133.68 67.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.89 0.376 . . . . 10.0 110.067 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 328' ' ' VAL . . . . . 0.405 HG21 ' HG3' ' A' ' 361' ' ' GLU . 42.2 t -104.61 126.38 59.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.817 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 329' ' ' LYS . . . . . 0.509 ' O ' ' HG3' ' A' ' 329' ' ' LYS . 3.8 pttp -146.2 132.46 19.49 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.75 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 61.11 21.28 11.69 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.907 0.384 . . . . 10.0 111.436 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 87.0 2.04 84.21 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.924 -0.655 . . . . 10.0 112.311 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -101.76 136.72 41.12 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 39.4 t -99.35 107.24 20.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.557 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 64.8 mt -92.58 126.4 45.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.072 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 20.5 mt -79.95 120.37 31.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.683 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 46.7 t -103.58 125.25 58.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.905 0.383 . . . . 10.0 110.162 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 337' ' ' ASP . . . . . 0.448 ' HB3' ' H ' ' A' ' 342' ' ' ARG . 9.9 t70 -73.0 119.03 16.67 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.03 15.38 2.34 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.832 0.679 . . . . 10.0 112.832 -177.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 -104.78 -60.95 1.53 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.043 0.449 . . . . 10.0 110.309 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 24.9 p -104.29 -13.0 16.31 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.25 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 83.18 47.49 5.75 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.791 -0.719 . . . . 10.0 111.626 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.448 ' H ' ' HB3' ' A' ' 337' ' ' ASP . 2.8 tpp180 -98.18 138.19 35.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.631 0.253 . . . . 10.0 110.911 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.42 110.2 22.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.905 0.383 . . . . 10.0 110.886 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 66.1 mtt -113.39 102.49 10.38 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.865 0.364 . . . . 10.0 110.645 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -93.09 -24.3 18.34 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.437 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -92.29 53.87 2.81 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.18 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -144.53 160.96 40.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.797 0.332 . . . . 10.0 110.22 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -133.21 108.45 8.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.369 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -61.87 139.54 58.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.403 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.1 m -71.45 166.77 21.02 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.311 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 351' ' ' ASP . . . . . 0.403 ' HB3' HD12 ' A' ' 353' ' ' LEU . 5.4 t70 60.18 -157.32 0.33 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.657 -0.702 . . . . 10.0 110.859 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . -99.51 26.32 24.82 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.533 -0.842 . . . . 10.0 113.177 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.403 HD12 ' HB3' ' A' ' 351' ' ' ASP . 1.6 mp -59.33 -58.05 10.33 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.963 0.411 . . . . 10.0 110.968 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 354' ' ' HIS . . . . . 0.457 ' HE1' ' OE1' ' A' ' 368' ' ' GLU . 21.7 p80 -68.96 -32.45 72.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.381 -179.2 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 355' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.09 -38.76 87.4 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.087 0.47 . . . . 10.0 110.633 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 356' ' ' ALA . . . . . 0.411 ' HB1' ' HA ' ' A' ' 313' ' ' ALA . . . -74.58 -28.92 61.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.418 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 23.0 t -66.45 -43.61 90.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.033 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.46 ' HB3' ' HA ' ' A' ' 365' ' ' ILE . 15.7 mt-10 -64.53 -26.27 68.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.569 179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -94.11 -1.74 53.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.748 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 360' ' ' LYS . . . . . 0.445 ' HE2' ' O ' ' A' ' 316' ' ' ALA . 27.3 ttpp -99.18 -44.61 6.2 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.676 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 361' ' ' GLU . . . . . 0.462 ' OE1' ' HD2' ' A' ' 322' ' ' ARG . 23.5 mm-40 -84.46 173.24 11.02 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.147 -0.479 . . . . 10.0 109.811 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -78.59 57.55 4.17 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 121.151 -0.547 . . . . 10.0 112.128 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 16.4 m -134.75 -166.01 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -122.94 136.15 54.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.836 0.35 . . . . 10.0 110.845 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 365' ' ' ILE . . . . . 0.492 ' H ' HD12 ' A' ' 365' ' ' ILE . 4.0 mp -60.94 143.87 14.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.223 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -69.52 -101.82 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.694 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -178.0 -65.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.137 -0.32 . . . . 10.0 110.137 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 368' ' ' GLU . . . . . 0.457 ' OE1' ' HE1' ' A' ' 354' ' ' HIS . 1.9 mp0 55.65 -105.24 0.26 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.456 -0.793 . . . . 10.0 110.692 -179.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 65.9 -67.04 0.15 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.532 0.733 . . . . 10.0 111.332 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 37.48 45.89 0.61 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.643 1.177 . . . . 10.0 113.59 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 14.5 t -140.25 152.12 45.69 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.898 0.38 . . . . 10.0 110.789 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 10.8 mt -158.63 -70.89 0.09 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.68 -0.691 . . . . 10.0 109.484 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -136.76 153.3 50.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.683 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 374' ' ' SER . . . . . 0.582 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 7.5 t -155.55 147.82 23.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.809 0.338 . . . . 10.0 111.031 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.3 tt -157.06 147.08 11.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.021 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 4.0 p -97.31 148.77 22.8 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -57.68 -41.75 82.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.712 0.291 . . . . 10.0 110.889 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 378' ' ' GLN . . . . . 0.4 ' HB3' ' O ' ' A' ' 219' ' ' ALA . 0.0 OUTLIER -61.17 -33.06 72.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.375 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 -90.01 -8.44 51.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.775 0.321 . . . . 10.0 111.119 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -87.61 -43.52 11.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.113 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -72.96 -11.25 60.5 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.267 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 44.5 mtp180 -77.86 -9.72 59.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.023 0.439 . . . . 10.0 110.304 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 30.3 mt -94.77 -8.25 38.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.502 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.49 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 18.5 m-85 -84.96 132.89 34.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.684 0.278 . . . . 10.0 111.208 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -64.15 -56.09 17.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.197 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 386' ' ' LYS . . . . . 0.457 ' O ' ' HA ' ' A' ' 205' ' ' TYR . 69.1 mttt -110.56 113.14 25.53 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.579 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 41.5 tp -122.25 124.68 44.34 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.257 -0.428 . . . . 10.0 110.082 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -140.64 160.04 40.88 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.595 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -166.53 164.21 37.51 Favored Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.381 -0.914 . . . . 10.0 112.368 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 62.4 mtm -119.03 171.65 8.11 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.877 -0.416 . . . . 10.0 109.877 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 391' ' ' THR . . . . . 0.469 ' HA ' ' OE2' ' A' ' 210' ' ' GLU . 1.9 t -162.55 158.31 23.32 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.881 0.372 . . . . 10.0 110.782 179.093 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -81.76 -171.32 45.62 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.916 -0.659 . . . . 10.0 111.843 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 393' ' ' THR . . . . . 0.527 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 1.9 m -73.56 79.59 1.47 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.228 0.537 . . . . 10.0 111.136 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -119.89 -60.86 1.67 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.56 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 395' ' ' ASP . . . . . 0.449 ' CG ' ' H ' ' A' ' 396' ' ' THR . 9.9 t70 58.8 -145.84 0.54 Allowed 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.262 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 396' ' ' THR . . . . . 0.686 HG21 ' HB3' ' A' ' 565' ' ' ARG . 5.3 m 69.56 -79.53 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.101 0.56 . . . . 10.0 112.169 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -86.26 26.49 1.04 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.129 0.49 . . . . 10.0 110.444 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -69.86 -29.72 67.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 10.0 111.238 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -64.13 -23.87 67.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.063 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 400' ' ' GLU . . . . . 0.471 ' HA ' ' OE1' ' A' ' 400' ' ' GLU . 5.0 mm-40 -68.93 -24.06 64.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.875 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 401' ' ' PHE . . . . . 0.464 ' HB3' ' HB2' ' A' ' 407' ' ' LEU . 39.2 m-85 -64.09 -31.81 73.14 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 178.355 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.23 -27.41 26.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.262 -0.881 . . . . 10.0 110.539 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 2.6 m -73.01 -39.54 65.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.806 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 17.4 mt -98.96 -53.66 7.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 113.451 0.908 . . . . 10.0 113.451 -177.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -99.64 -2.0 36.62 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.802 0.667 . . . . 10.0 112.802 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt 63.16 29.8 16.05 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.45 0.469 . . . . 10.0 111.659 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 407' ' ' LEU . . . . . 0.496 HD13 HD11 ' A' ' 99' ' ' ILE . 5.3 mt -84.94 138.58 32.41 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.617 -0.265 . . . . 10.0 111.065 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 408' ' ' ASP . . . . . 0.53 ' OD2' ' HD2' ' A' ' 13' ' ' ARG . 22.0 t70 -81.41 160.09 24.14 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 6.8 m -114.4 115.5 27.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.986 0.422 . . . . 10.0 111.733 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.61 138.28 54.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.016 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 44.7 t -104.32 125.55 59.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.73 0.3 . . . . 10.0 110.752 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 94.4 t -84.0 127.66 66.03 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.497 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.32 136.6 47.88 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.665 2.244 . . . . 10.0 112.41 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.43 HG23 ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.8 149.87 45.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.651 -0.704 . . . . 10.0 111.016 179.257 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -58.4 -50.23 74.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.146 0.498 . . . . 10.0 110.066 179.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -114.34 158.71 39.12 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.94 114.12 2.16 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.239 1.959 . . . . 10.0 111.333 178.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 54.0 ttp -68.55 113.44 6.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.092 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 34.3 mt -98.67 73.12 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.335 0.588 . . . . 10.0 109.827 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -102.04 116.48 32.77 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.024 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -84.96 99.23 10.85 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.71 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.23 110.52 16.78 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.734 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 424' ' ' PRO . 51.4 mt -100.55 132.28 22.58 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.101 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 424' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 423' ' ' LEU . 50.6 Cg_exo -53.86 144.7 54.28 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.936 2.424 . . . . 10.0 113.544 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.83 138.83 48.57 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.506 -0.77 . . . . 10.0 109.825 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 15.4 mt -113.56 118.54 34.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.991 0.424 . . . . 10.0 110.549 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 91.3 t -99.7 122.23 51.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.598 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 428' ' ' TYR . . . . . 0.471 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 5.0 m-85 -109.76 176.36 5.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.252 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -80.25 -79.28 0.15 Allowed 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.972 -0.291 . . . . 10.0 110.99 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 70.1 p -82.24 160.23 23.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.737 0.303 . . . . 10.0 110.993 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -62.5 -33.52 75.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.371 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.79 80.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.595 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.51 -42.77 99.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.247 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 434' ' ' LYS . . . . . 0.435 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 38.3 ttpt -62.09 -50.08 73.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.566 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 435' ' ' ILE . . . . . 0.496 ' O ' HG12 ' A' ' 439' ' ' ILE . 51.4 mm -62.88 -44.3 99.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.598 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.6 -41.88 86.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.615 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.23 -36.97 85.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.339 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 438' ' ' ILE . . . . . 0.428 HG23 HG21 ' A' ' 557' ' ' ILE . 90.6 mt -64.24 -47.92 87.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.769 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 439' ' ' ILE . . . . . 0.496 HG12 ' O ' ' A' ' 435' ' ' ILE . 46.6 mm -59.78 -40.24 82.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.081 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -62.05 -44.57 96.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.443 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -63.58 -36.62 84.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.609 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.488 HG12 HG11 ' A' ' 452' ' ' VAL . 96.4 mt -72.24 -42.75 66.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.445 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -48.52 -53.93 16.28 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.971 0.73 . . . . 10.0 112.971 -179.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -62.49 -41.84 99.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.967 0.413 . . . . 10.0 111.866 -178.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.419 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 76.2 mtt-85 -71.26 -35.79 71.51 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.18 0.437 . . . . 10.0 112.18 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 24.8 m -66.43 -33.89 76.72 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.258 0.551 . . . . 10.0 110.146 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -70.69 -46.14 63.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.37 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.63 -44.89 76.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.357 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 120.9 32.45 1.08 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.43 -0.891 . . . . 10.0 112.97 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 450' ' ' GLN . . . . . 0.419 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 61.9 tt0 -104.04 125.82 33.41 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.871 0.335 . . . . 10.0 110.16 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.38 136.51 47.31 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.553 2.168 . . . . 10.0 111.697 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.488 HG11 HG12 ' A' ' 442' ' ' ILE . 59.5 t -124.57 122.61 64.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.04 0.448 . . . . 10.0 111.62 -178.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 52.2 tp -108.33 110.0 21.46 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 19.9 t -89.61 113.83 26.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.464 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -93.66 123.78 7.56 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.79 -0.719 . . . . 10.0 111.664 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 34.2 p -122.9 130.47 52.89 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.591 0.234 . . . . 10.0 110.695 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 30.0 pt -95.73 -8.76 9.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.103 0.478 . . . . 10.0 110.296 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 458' ' ' SER . . . . . 0.415 ' HB2' ' HD3' ' A' ' 461' ' ' LYS . 0.9 OUTLIER -124.79 126.13 45.13 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.769 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 47.0 mt -57.73 -37.09 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-O 121.051 0.453 . . . . 10.0 111.517 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -56.19 -42.95 77.94 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.142 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.415 ' HD3' ' HB2' ' A' ' 458' ' ' SER . 0.8 OUTLIER -72.91 -28.93 62.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.314 -178.922 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.5 m -62.44 -47.65 83.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.247 0.546 . . . . 10.0 109.685 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -68.45 -35.4 77.54 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.718 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 50.7 tp -63.79 -52.45 60.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.799 -0.637 . . . . 10.0 111.356 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 8.8 p -67.16 -31.62 54.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.847 0.356 . . . . 10.0 110.812 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 5.6 t -65.59 -38.96 90.98 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.72 -0.474 . . . . 10.0 109.72 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -62.35 -51.05 69.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.41 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -60.58 -41.19 94.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.39 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.64 -38.42 87.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.761 0.315 . . . . 10.0 110.755 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.0 m -68.51 -36.88 79.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.326 0.584 . . . . 10.0 110.058 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -67.64 -23.31 65.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.854 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -95.5 -3.09 47.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.009 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 72.65 14.15 77.91 Favored Glycine 0 C--N 1.329 0.169 0 C-N-CA 121.013 -0.613 . . . . 10.0 112.481 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 94.5 mt -78.4 120.86 30.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.837 0.351 . . . . 10.0 110.23 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -65.93 117.34 8.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.019 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -145.56 158.21 43.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.171 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -132.1 144.76 50.95 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.255 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 17.2 t -104.63 132.12 52.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.967 -0.382 . . . . 10.0 109.967 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.4 HD12 ' HB2' ' A' ' 503' ' ' ALA . 88.4 mt -86.31 93.84 9.19 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.122 0.486 . . . . 10.0 110.425 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -85.37 119.81 26.15 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.413 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -64.62 -25.06 67.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.901 -0.59 . . . . 10.0 112.179 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -69.68 -23.1 63.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.042 0.449 . . . . 10.0 110.701 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -120.06 64.84 0.82 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.644 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' HIS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 487' ' ' GLU . 0.0 OUTLIER -64.58 -24.36 67.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.593 -178.756 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.38 -33.22 75.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.085 0.469 . . . . 10.0 110.05 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -89.88 -40.49 12.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.955 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 487' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 484' ' ' HIS . 0.1 OUTLIER -54.01 -51.92 62.43 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.659 -0.7 . . . . 10.0 111.515 -179.81 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -56.46 -32.47 64.97 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 112.4 0.518 . . . . 10.0 112.4 -178.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -73.49 -37.52 65.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.033 0.444 . . . . 10.0 110.754 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 28.8 mt -76.55 -41.43 34.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.329 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 66.6 t -57.22 -34.75 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-O 121.073 0.463 . . . . 10.0 110.744 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -63.43 -22.34 66.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.57 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 -120.03 22.44 11.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.64 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -71.6 -16.66 62.3 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.997 0.427 . . . . 10.0 111.144 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -95.39 16.44 61.26 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.854 -0.688 . . . . 10.0 111.862 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -74.39 141.09 76.44 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 110.134 -0.321 . . . . 10.0 110.134 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.38 125.6 19.7 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.452 2.101 . . . . 10.0 112.51 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.24 29.8 4.48 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.697 -0.683 . . . . 10.0 112.35 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -105.66 114.61 28.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.832 0.348 . . . . 10.0 110.341 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 23.4 t -98.7 118.4 45.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.198 -0.455 . . . . 10.0 109.892 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.62 138.18 54.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.061 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 41.2 mt -109.98 129.36 65.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.727 -0.471 . . . . 10.0 109.727 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 503' ' ' ALA . . . . . 0.4 ' HB2' HD12 ' A' ' 479' ' ' LEU . . . -121.42 129.45 53.01 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.818 0.342 . . . . 10.0 111.066 -179.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 7.4 m -104.89 119.55 39.28 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.464 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 66.8 t30 59.21 77.3 0.32 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.953 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -78.03 123.61 27.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.482 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -70.51 172.74 7.96 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.172 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -65.64 152.95 51.49 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.044 -0.598 . . . . 10.0 112.578 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 67.78 -81.91 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.162 0.585 . . . . 10.0 111.502 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 87.33 149.15 15.23 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.967 -0.635 . . . . 10.0 112.37 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.96 151.07 31.39 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 122.666 0.387 . . . . 10.0 111.527 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -76.27 103.65 6.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.447 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 66.8 mt -84.97 111.29 20.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.209 -0.45 . . . . 10.0 109.98 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 18.4 t -80.5 132.49 31.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.736 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 65.4 mt -67.42 130.39 42.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.703 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 94.32 -11.42 70.41 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.986 -0.626 . . . . 10.0 111.786 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 117.13 -170.78 13.56 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 110.914 -0.874 . . . . 10.0 110.914 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 5.1 p -129.19 99.49 5.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 117.206 0.503 . . . . 10.0 110.993 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 20.0 p-90 -58.28 -28.48 65.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.88 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -62.88 -31.38 72.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.871 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -86.48 -34.26 20.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.057 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -64.76 -40.76 95.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.716 -0.675 . . . . 10.0 111.169 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.9 m -73.42 -19.9 18.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.979 0.419 . . . . 10.0 110.708 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -87.31 -6.81 58.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.728 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -91.47 3.57 54.65 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.486 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 16.5 mt -97.83 150.33 21.39 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.26 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -74.83 -49.08 21.89 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -126.63 90.59 49.41 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.535 -0.542 . . . . 10.0 109.535 179.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.3 113.46 2.26 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.765 2.31 . . . . 10.0 112.504 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -104.18 149.0 25.66 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.525 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.38 -37.17 64.68 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.689 0.281 . . . . 10.0 111.465 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -58.19 -36.28 72.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.87 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -81.95 -40.49 22.18 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.793 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 76.7 mt -58.81 -48.04 87.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.353 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -72.41 -29.07 63.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.81 0.338 . . . . 10.0 110.859 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -69.59 -50.74 41.66 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 94.2 mt -62.81 -36.23 74.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.141 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -59.78 -42.16 92.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.023 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -70.06 -45.29 67.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.566 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.19 -47.08 84.54 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.331 0.586 . . . . 10.0 110.065 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -62.46 -40.66 97.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.334 -0.848 . . . . 10.0 110.427 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -55.21 -42.51 73.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.854 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 61.9 t -65.79 -47.81 84.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.437 179.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 10.0 mtp180 -62.67 -37.84 88.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.572 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -60.71 -49.05 79.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.326 -0.852 . . . . 10.0 111.058 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -70.15 -27.34 64.47 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.537 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -65.27 -35.55 81.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.106 0.479 . . . . 10.0 109.991 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 95.6 t -73.46 -33.97 41.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.576 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 88.6 mt -58.88 -50.4 74.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.322 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -69.07 -24.78 64.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.916 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -72.12 -23.42 61.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.24 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 122.46 5.15 8.69 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.362 -0.923 . . . . 10.0 113.477 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 79.24 -169.03 53.61 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.732 -0.747 . . . . 10.0 112.678 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 52.9 tp -69.2 123.06 20.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.865 0.364 . . . . 10.0 110.693 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -101.59 123.23 45.27 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.965 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 21.8 mm -106.89 131.49 56.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.335 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 557' ' ' ILE . . . . . 0.428 HG21 HG23 ' A' ' 438' ' ' ILE . 25.5 mt -119.24 124.41 73.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.054 178.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 558' ' ' GLY . . . . . 0.537 ' HA3' ' CD2' ' A' ' 586' ' ' PHE . . . -101.68 125.6 8.61 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.991 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 2.0 p -83.02 -30.41 28.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.24 0.543 . . . . 10.0 110.428 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -153.6 152.75 31.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.043 -0.98 . . . . 10.0 109.134 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 37.4 mtt-85 -101.16 158.76 15.79 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.195 -0.298 . . . . 10.0 110.195 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -87.41 152.58 22.13 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.012 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.25 -45.25 95.31 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 3.9 p -89.22 128.61 35.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.487 -0.779 . . . . 10.0 109.874 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 565' ' ' ARG . . . . . 0.686 ' HB3' HG21 ' A' ' 396' ' ' THR . 16.2 tpt180 -70.91 -21.59 62.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.535 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 566' ' ' ARG . . . . . 0.483 ' HD2' ' OD1' ' A' ' 212' ' ' ASP . 3.2 mtm180 -54.65 -52.6 61.79 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.954 0.407 . . . . 10.0 110.796 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 46.5 mt -80.03 -30.75 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.54 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -62.42 -40.34 96.23 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.77 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -69.13 -31.81 70.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.791 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -65.12 -28.22 69.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.998 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 35.7 tp -74.4 -26.96 60.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.109 0.48 . . . . 10.0 110.375 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 20.9 ttp180 -84.82 -27.47 26.76 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.518 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -84.03 29.64 3.79 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.991 -0.623 . . . . 10.0 113.499 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -82.17 -44.33 16.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 117.001 0.401 . . . . 10.0 110.211 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 1.2 m -87.97 172.45 9.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.938 -0.573 . . . . 10.0 110.201 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 69.38 42.3 74.66 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.568 -0.825 . . . . 10.0 112.337 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -82.36 135.88 35.09 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 64.61 18.02 11.18 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.131 0.491 . . . . 10.0 110.018 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 80.84 43.92 8.66 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.696 -0.684 . . . . 10.0 111.825 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -99.29 -163.84 1.07 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.513 -0.18 . . . . 10.0 110.513 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -93.73 173.1 7.85 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.232 0.539 . . . . 10.0 111.791 -179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 159.29 166.69 18.75 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.761 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 p -147.6 138.37 23.37 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.761 0.281 . . . . 10.0 110.326 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 12.6 m -123.06 132.08 53.97 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.605 -0.271 . . . . 10.0 110.681 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -146.21 128.31 15.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.091 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 586' ' ' PHE . . . . . 0.537 ' CD2' ' HA3' ' A' ' 558' ' ' GLY . 18.1 m-85 -114.84 146.96 40.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.039 0.447 . . . . 10.0 110.646 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 587' ' ' TYR . . . . . 0.435 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 65.3 m-85 -126.5 135.38 51.25 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 63.9 mt -133.91 160.0 39.0 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.697 0.284 . . . . 10.0 110.699 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 25.5 p -130.88 164.75 24.56 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.003 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 78.5 mmm -76.22 -2.52 31.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.92 0.391 . . . . 10.0 111.117 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -98.01 1.93 48.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.366 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -88.41 142.69 27.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.78 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -65.26 -13.73 59.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.547 -0.751 . . . . 10.0 112.34 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.562 ' O ' HG12 ' A' ' 597' ' ' ILE . 15.7 tp -65.38 -23.95 67.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.918 0.39 . . . . 10.0 110.858 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 19.5 mmt -77.52 -3.79 42.35 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.916 0.389 . . . . 10.0 111.159 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -92.4 -15.33 27.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.771 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 594' ' ' LEU . 29.1 pt -67.3 -14.29 17.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-O 120.999 0.428 . . . . 10.0 111.241 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -76.53 -10.65 59.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.046 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.83 -55.93 0.65 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.458 0.703 . . . . 10.0 110.781 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 7.3 m -93.91 103.64 15.73 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -16.52 39.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.871 -0.604 . . . . 10.0 112.113 -178.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 4.4 mmt180 -63.0 -32.78 74.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.696 0.284 . . . . 10.0 110.552 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 50.7 t -68.0 -48.89 72.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.281 -0.418 . . . . 10.0 109.938 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.1 -38.47 85.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.32 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -64.6 -26.57 71.0 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.946 -0.57 . . . . 10.0 112.489 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 58.2 tpp -68.93 -18.04 64.04 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.113 0.482 . . . . 10.0 110.572 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 59.7 mtt -76.58 -14.98 59.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.257 -0.428 . . . . 10.0 110.522 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 608' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 608' ' ' ARG . 36.5 mtt-85 -72.07 -12.97 61.46 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.23 0.538 . . . . 10.0 110.358 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 10.6 mmmt -82.93 1.99 36.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.889 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 5.2 mp -75.91 -14.87 60.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.572 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 92.35 -31.73 5.89 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.973 -0.632 . . . . 10.0 111.774 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 612' ' ' MET . . . . . 0.438 ' HG3' ' HA ' ' A' ' 428' ' ' TYR . 0.0 OUTLIER 69.78 -66.8 0.25 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 123.539 0.736 . . . . 10.0 111.69 179.763 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp 57.42 78.32 0.37 Allowed Pre-proline 0 CA--C 1.53 0.198 0 O-C-N 123.524 0.515 . . . . 10.0 111.131 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 614' ' ' PRO . . . . . 0.471 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 52.3 Cg_exo -56.56 119.12 6.13 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.142 2.561 . . . . 10.0 112.506 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 101.74 -9.32 56.88 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.893 -0.67 . . . . 10.0 111.891 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -111.05 120.11 41.26 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.992 0.425 . . . . 10.0 110.347 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -79.28 96.93 6.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.618 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.2 tp -72.24 -23.22 21.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.841 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 46.98 83.65 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.797 0.685 . . . . 10.0 112.524 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -116.79 94.03 42.87 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.273 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -61.44 -29.22 84.87 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.102 2.535 . . . . 10.0 113.447 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 70.1 p-90 -65.36 -25.75 67.71 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.886 -0.326 . . . . 10.0 110.996 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 73.1 t -67.85 -42.36 85.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 1.8 m -62.74 -38.85 92.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.445 -0.798 . . . . 10.0 110.081 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -68.97 -39.18 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.177 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -61.68 -38.4 87.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.231 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.76 -43.64 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.935 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 628' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' A' ' 632' ' ' ARG . . . -60.33 -42.21 95.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.411 179.534 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 629' ' ' ASN . . . . . 0.411 ' O ' ' HG3' ' A' ' 633' ' ' LYS . 61.3 t30 -67.65 -35.86 79.69 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.144 179.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -64.75 -41.87 95.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.975 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 631' ' ' GLN . . . . . 0.402 ' OE1' ' HD3' ' A' ' 565' ' ' ARG . 49.5 mt-30 -62.76 -37.45 86.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.083 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 632' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 628' ' ' ALA . 12.7 mtp180 -61.77 -34.62 76.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.277 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 633' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 629' ' ' ASN . 57.5 mttm -64.91 -38.93 92.61 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 92.1 t -62.22 -49.56 83.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.053 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -62.41 -30.95 71.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.292 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.4 m -69.43 -23.78 63.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.282 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -73.28 -35.68 66.21 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -65.0 -42.29 94.61 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.63 -0.713 . . . . 10.0 109.521 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -55.7 -44.84 77.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.308 -0.86 . . . . 10.0 110.4 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -59.6 -43.37 93.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.821 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 52.3 mt -64.57 -47.6 88.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.224 179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 642' ' ' ARG . . . . . 0.507 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 75.4 mtm-85 -60.28 -43.34 96.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.945 -0.57 . . . . 10.0 110.314 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 18.5 ttpt -55.21 -45.99 75.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.914 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -64.93 -41.5 95.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.944 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 88.9 mt -65.99 -41.39 91.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.926 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 646' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 97.5 mt -59.07 -42.47 90.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.879 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -66.43 -13.59 60.96 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.002 0.371 . . . . 10.0 112.002 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -102.27 -38.72 7.53 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.946 0.403 . . . . 10.0 111.162 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -83.41 -25.5 31.25 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 -178.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -65.27 -31.34 72.44 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.021 0.439 . . . . 10.0 110.319 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 651' ' ' VAL . . . . . 0.427 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 13.2 t -62.98 -47.28 93.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.8 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.12 -26.54 64.95 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.539 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -63.18 -48.23 79.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.598 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.79 -44.61 95.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.555 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 655' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 42.3 mt-30 -61.56 -44.05 97.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.364 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 24.9 ttp-105 -63.02 -42.44 99.8 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.857 -0.61 . . . . 10.0 109.952 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -63.23 -44.91 93.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.956 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.83 -49.64 69.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.769 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.3 tp -65.93 -36.9 78.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 C-N-CA 121.103 -0.239 . . . . 10.0 111.271 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 6.1 m-30 -68.32 -40.08 81.75 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.937 -0.394 . . . . 10.0 109.937 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 5.1 t -60.47 -49.46 77.48 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.066 -0.516 . . . . 10.0 109.698 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -58.88 -47.77 83.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.781 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 667' ' ' LEU . 43.8 ttt-85 -60.91 -39.23 88.57 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.042 -0.527 . . . . 10.0 111.571 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -73.45 -43.35 60.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.562 0.22 . . . . 10.0 111.487 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -58.45 -37.62 75.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.095 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 61.2 mt -88.7 -4.43 58.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.834 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.498 ' HB2' ' O ' ' A' ' 663' ' ' ARG . 20.3 tp -87.15 -46.96 9.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.075 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -68.41 -41.71 80.05 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.066 -0.516 . . . . 10.0 111.623 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 21.7 m -72.67 164.2 3.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.072 0.463 . . . . 10.0 111.423 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 53.9 m -115.96 -38.72 3.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.331 -179.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -80.12 84.63 5.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.136 0.493 . . . . 10.0 110.579 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 672' ' ' VAL . . . . . 0.4 ' O ' HG12 ' A' ' 676' ' ' ILE . 9.5 p -95.01 -5.46 10.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.567 0.699 . . . . 10.0 109.716 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -39.16 69.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.074 -0.966 . . . . 10.0 111.93 -179.308 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -58.54 -50.47 73.67 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.097 0.475 . . . . 10.0 110.551 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 675' ' ' THR . . . . . 0.443 ' O ' HG12 ' A' ' 679' ' ' ILE . 0.6 OUTLIER -64.9 -44.49 89.41 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.811 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 676' ' ' ILE . . . . . 0.4 HG12 ' O ' ' A' ' 672' ' ' VAL . 36.0 mm -56.7 -51.63 64.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.755 -0.657 . . . . 10.0 111.954 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -67.52 -35.75 79.7 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 52.8 m -65.43 -46.6 79.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.618 0.247 . . . . 10.0 111.483 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 679' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 675' ' ' THR . 48.1 pt -74.76 -20.73 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.92 -0.312 . . . . 10.0 110.732 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 48.5 ttm-85 -60.48 -40.84 92.73 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.957 0.408 . . . . 10.0 110.179 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -62.96 -38.26 90.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.662 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -72.78 -46.79 51.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.223 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 683' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 679' ' ' ILE . 94.2 t -58.62 -46.11 90.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-O 120.831 0.348 . . . . 10.0 111.05 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -62.53 -42.24 99.4 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.465 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -64.07 -43.2 96.17 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.651 -0.249 . . . . 10.0 110.438 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.7 87.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.976 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 8.8 m -68.37 -37.32 80.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.563 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.04 -44.32 50.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.797 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -31.11 62.26 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.037 0.535 . . . . 10.0 111.931 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -66.62 -28.17 68.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.852 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -110.17 -22.09 11.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.739 0.304 . . . . 10.0 111.599 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 692' ' ' ILE . . . . . 0.403 HG12 ' HB3' ' A' ' 701' ' ' TRP . 28.1 mt -125.85 100.26 31.08 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.515 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.48 130.28 26.22 Favored 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.507 2.138 . . . . 10.0 110.766 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -48.11 109.04 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 123.056 2.504 . . . . 10.0 113.529 -178.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 60.06 88.91 0.07 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.661 -0.699 . . . . 10.0 111.551 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 11.9 p -154.67 -168.71 2.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.215 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 697' ' ' LEU . 32.3 mt -72.56 136.64 45.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.206 -0.294 . . . . 10.0 110.206 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -59.86 -31.71 70.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.873 -178.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -76.33 -4.56 42.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.974 0.416 . . . . 10.0 111.48 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 13.1 mmt -100.95 8.79 42.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.334 0.588 . . . . 10.0 109.784 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 701' ' ' TRP . . . . . 0.403 ' HB3' HG12 ' A' ' 692' ' ' ILE . 48.4 m0 -102.5 125.09 49.1 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.298 -0.865 . . . . 10.0 110.194 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -82.14 77.49 8.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.431 0.634 . . . . 10.0 109.334 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 703' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 32.8 mm -63.36 -49.45 79.0 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.175 -0.92 . . . . 10.0 111.16 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 704' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 51.7 Cg_exo -56.44 -45.88 34.26 Favored 'Trans proline' 0 C--N 1.359 1.13 0 C-N-CA 121.866 1.711 . . . . 10.0 112.008 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -64.22 -41.76 98.19 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.962 -0.637 . . . . 10.0 111.965 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.468 ' O ' ' HG ' ' A' ' 710' ' ' LEU . 60.0 tp -64.7 -43.44 93.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.487 0.184 . . . . 10.0 110.702 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -61.15 -47.41 86.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.525 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -66.09 -35.04 79.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.393 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.5 -46.85 88.24 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.254 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 710' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 706' ' ' LEU . 63.1 mt -60.58 -36.74 79.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.776 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -73.22 -21.08 60.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.989 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -99.15 -42.28 7.13 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.523 0.564 . . . . 10.0 112.523 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -96.02 -23.36 16.85 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.699 1.0 . . . . 10.0 113.699 -177.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -120.34 1.23 10.72 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.504 0.927 . . . . 10.0 113.504 -177.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 715' ' ' ASP . . . . . 0.415 ' HB2' ' HA ' ' A' ' 828' ' ' LYS . 22.8 t70 57.76 31.31 20.27 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 121.554 0.692 . . . . 10.0 110.22 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 14.8 tp -125.96 128.17 47.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.155 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -104.02 105.19 15.28 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.898 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 82.3 mt -121.04 104.05 41.87 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.938 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.56 73.84 3.94 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 122.536 2.157 . . . . 10.0 111.655 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 57.3 mt -55.73 -43.14 72.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.42 -0.809 . . . . 10.0 111.932 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -64.91 -21.99 66.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.679 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -80.51 -17.21 52.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.977 0.418 . . . . 10.0 110.453 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 20.0 m0 -101.75 -43.87 5.71 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.533 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 16.1 tp -57.17 -27.6 62.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.415 -178.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -86.73 -10.5 53.52 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.841 0.311 . . . . 10.0 111.841 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 42.8 mttp -111.02 -45.9 3.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.663 0.268 . . . . 10.0 111.285 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -116.3 95.15 44.52 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 121.178 0.513 . . . . 10.0 110.336 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -72.97 8.91 1.51 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.456 2.104 . . . . 10.0 112.346 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -79.45 -8.47 59.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.132 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 63.7 mt -65.43 -40.24 93.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.242 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 53.93 -97.57 0.07 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.597 -0.728 . . . . 10.0 110.833 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 732' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 736' ' ' ARG . 0.2 OUTLIER -144.55 -57.63 0.36 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.21 -48.75 76.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.981 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 2.3 m -60.14 -33.1 71.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.154 0.502 . . . . 10.0 110.376 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.99 -43.57 98.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.733 -0.667 . . . . 10.0 109.483 178.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 736' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 732' ' ' GLU . 71.0 mtt-85 -65.07 -47.77 76.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.199 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -57.94 -39.91 79.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.474 -0.784 . . . . 10.0 111.335 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 27.9 mmm-85 -62.11 -40.27 95.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.854 0.359 . . . . 10.0 110.45 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 92.2 mt -67.61 -44.35 86.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.526 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 29.1 tp -66.35 -43.14 86.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.016 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.96 -42.7 94.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.803 0.335 . . . . 10.0 110.928 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -64.88 -40.61 95.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.317 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 2.3 p -66.38 -44.6 82.67 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.865 -0.334 . . . . 10.0 110.632 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.6 -38.87 83.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.05 -54.76 42.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.392 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.421 ' HA ' ' HD3' ' A' ' 749' ' ' ARG . 97.0 t -63.65 -34.12 65.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.987 0.423 . . . . 10.0 110.576 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -60.39 -49.95 75.54 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.36 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -65.16 -31.75 73.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.556 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 749' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 746' ' ' VAL . 65.9 mtp180 -67.2 -41.34 85.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.87 -0.605 . . . . 10.0 109.695 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -66.08 -39.97 90.48 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -59.09 -39.12 81.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.053 -0.976 . . . . 10.0 111.725 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.43 -21.25 65.26 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.457 0.54 . . . . 10.0 112.457 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.0 t -87.63 -27.93 5.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.883 0.373 . . . . 10.0 111.463 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 6.6 t -96.77 -42.12 11.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.033 0.444 . . . . 10.0 111.259 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 125.46 130.81 3.52 Favored Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 111.158 -0.777 . . . . 10.0 111.158 -179.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 756' ' ' ALA . . . . . 0.505 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -55.12 -47.12 75.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 10.0 111.707 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.13 -38.57 91.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.163 0.506 . . . . 10.0 110.663 -179.329 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.5 tpt -69.4 -42.31 75.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.839 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 76.8 mmm -61.12 -39.54 90.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.948 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.505 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.8 mmp_? -60.81 -39.95 90.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.266 0.555 . . . . 10.0 110.011 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 10.9 m-70 -71.11 -33.4 70.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.927 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -67.04 -46.85 73.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.687 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 79.5 mt-10 -59.6 -44.88 93.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.335 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -61.46 -41.08 96.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.173 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -66.81 -43.66 91.1 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.15 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 48.7 t -60.69 -41.45 88.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 120.678 0.275 . . . . 10.0 110.906 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 8.9 mtp -57.64 -49.12 77.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.254 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 60.4 mt -66.65 -40.41 88.67 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.235 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 769' ' ' GLN . . . . . 0.401 ' HA ' ' HE1' ' B' ' 22' ' ' MET . 2.7 tt0 -53.21 -57.12 11.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.751 -0.659 . . . . 10.0 111.312 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 3.7 m -68.72 -35.78 77.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.346 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.26 -54.27 43.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.977 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -62.19 -37.58 85.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.298 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 49.6 m -65.75 -42.45 90.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.816 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 62.9 mt -77.41 -23.83 50.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.611 -0.268 . . . . 10.0 110.908 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -66.14 -51.06 61.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.645 -0.252 . . . . 10.0 110.658 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.441 ' HG3' ' N ' ' A' ' 777' ' ' GLU . 13.5 ptpt -62.45 -34.24 76.41 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.805 0.336 . . . . 10.0 110.324 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 777' ' ' GLU . . . . . 0.441 ' N ' ' HG3' ' A' ' 776' ' ' LYS . 0.9 OUTLIER -70.34 -39.92 74.4 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 178.845 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -60.65 -32.42 71.6 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.929 -0.578 . . . . 10.0 109.986 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 85.0 mt -65.69 -45.81 81.4 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -67.96 -42.4 80.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.125 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.77 -42.93 94.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.936 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 85.1 mmm -64.39 -38.27 90.45 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.024 0.44 . . . . 10.0 109.979 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.58 -40.77 93.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.066 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -64.84 -41.92 95.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.216 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.7 tp -71.59 -35.52 70.56 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.706 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -57.25 -39.36 75.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.145 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -89.77 -32.66 16.87 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.754 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 788' ' ' GLY . . . . . 0.514 ' O ' ' HG ' ' A' ' 791' ' ' LEU . . . -74.04 -25.38 71.47 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 121.096 -0.574 . . . . 10.0 113.687 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 7.7 tp -69.29 -14.55 18.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 122.426 -0.455 . . . . 10.0 111.329 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 26.0 m170 -67.89 -30.52 69.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.833 0.349 . . . . 10.0 110.909 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 788' ' ' GLY . 0.7 OUTLIER -96.4 -2.34 45.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.022 0.439 . . . . 10.0 110.438 179.371 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 74.2 mtt180 -99.14 -9.34 23.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.155 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -81.08 79.79 1.77 Allowed Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.804 -0.635 . . . . 10.0 112.523 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -71.29 158.6 36.09 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.821 0.343 . . . . 10.0 110.637 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 795' ' ' ALA . . . . . 0.504 ' O ' ' HB2' ' A' ' 796' ' ' GLN . . . -54.87 151.26 8.82 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.771 -0.65 . . . . 10.0 112.169 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 796' ' ' GLN . . . . . 0.504 ' HB2' ' O ' ' A' ' 795' ' ' ALA . 16.9 mm100 79.82 -31.68 0.13 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.271 -0.877 . . . . 10.0 111.73 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -94.46 143.41 26.43 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.255 -0.276 . . . . 10.0 110.255 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -83.4 120.63 75.9 Favored Pre-proline 0 C--N 1.325 -0.475 0 N-CA-C 109.738 -0.468 . . . . 10.0 109.738 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.17 -26.44 64.95 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.881 2.387 . . . . 10.0 113.479 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 800' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 804' ' ' LYS . 27.4 mtpt -74.28 -46.82 38.79 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.638 -0.504 . . . . 10.0 109.638 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -65.38 -37.94 88.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.538 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -66.33 -41.28 89.85 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -57.54 -44.16 84.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.491 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 804' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 800' ' ' LYS . 95.6 mttt -62.51 -47.24 84.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.857 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 39.3 ttp85 -61.03 -47.6 85.63 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.427 -0.351 . . . . 10.0 111.238 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.26 -47.25 86.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.467 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 8.3 p -65.77 -39.21 90.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.495 -0.321 . . . . 10.0 111.501 -179.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -65.05 -35.65 81.85 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.873 0.368 . . . . 10.0 110.272 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 19.4 m -68.56 -40.79 80.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.206 0.527 . . . . 10.0 109.754 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 13.4 ttm -62.69 -38.42 90.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.609 -0.723 . . . . 10.0 110.241 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -65.28 -44.11 89.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.666 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.78 -49.05 77.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.612 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -61.65 -34.91 76.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.693 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 32.9 ttp -64.59 -43.61 93.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.216 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 97.3 mt -65.97 -40.59 91.38 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.409 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 816' ' ' GLU . . . . . 0.42 ' HA ' ' HE2' ' A' ' 819' ' ' LYS . 37.9 mm-40 -62.94 -39.43 94.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.591 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 19.9 m -76.58 -27.2 55.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.508 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 36.7 tp -62.76 -57.11 12.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.729 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 819' ' ' LYS . . . . . 0.42 ' HE2' ' HA ' ' A' ' 816' ' ' GLU . 53.9 pttt -61.32 -30.06 70.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.478 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -61.73 -56.53 18.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.817 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.55 -31.3 71.29 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.587 -0.278 . . . . 10.0 111.498 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 822' ' ' VAL . . . . . 0.64 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 36.6 t -60.63 -56.95 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 39.5 mm -63.44 -37.28 79.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 121.073 0.463 . . . . 10.0 110.03 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 824' ' ' SER . . . . . 0.505 ' O ' ' HB2' ' A' ' 828' ' ' LYS . 29.4 t -59.78 -53.83 53.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.37 179.119 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 98.0 m -59.99 -38.69 83.33 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.557 -0.292 . . . . 10.0 111.727 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 826' ' ' LEU . . . . . 0.64 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 94.4 mt -62.03 -29.06 70.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.92 0.39 . . . . 10.0 111.423 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 1.7 m -97.0 -27.92 14.4 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.237 0.541 . . . . 10.0 110.095 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 828' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 824' ' ' SER . 2.0 ttpt -69.8 -19.63 63.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.127 -0.942 . . . . 10.0 111.415 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.416 HG23 ' HB3' ' B' ' 28' ' ' ALA . 14.8 p -53.2 130.09 14.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 CA-C-O 121.213 0.53 . . . . 10.0 111.183 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 36.3 mm-40 -86.0 113.66 22.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.728 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 60.6 t -120.39 136.76 56.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.816 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 832' ' ' ARG . . . . . 0.511 ' O ' ' HD3' ' A' ' 834' ' ' PRO . 17.5 ptt180 -74.08 92.08 2.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.575 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 73.0 mtp -84.92 107.48 11.75 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.733 -0.469 . . . . 10.0 109.733 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.511 ' HD3' ' O ' ' A' ' 832' ' ' ARG . 86.8 Cg_endo -80.5 -154.86 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.989 2.459 . . . . 10.0 113.067 -178.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -65.04 112.46 3.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.463 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.798 -0.62 . . . . 10.0 110.314 -179.878 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.95 0.405 . . . . 10.0 110.485 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 11.7 tpt -92.62 124.07 36.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.015 0.435 . . . . 10.0 110.566 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 33.0 mt -90.22 118.28 35.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.445 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.02 91.2 1.55 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.956 0.408 . . . . 10.0 110.875 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 72.6 mt -83.55 73.98 10.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.302 0.572 . . . . 10.0 110.894 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.03 158.06 44.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.605 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -140.11 -179.48 6.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 10.0 110.54 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.521 ' NE ' ' HA ' ' B' ' 8' ' ' ARG . 1.8 mmp_? -117.7 14.83 14.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.535 -0.302 . . . . 10.0 111.254 -179.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -124.74 105.52 9.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.738 0.304 . . . . 10.0 110.566 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -88.55 149.4 23.62 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.631 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.446 ' O ' HD11 ' A' ' 291' ' ' ILE . 50.5 mt -85.0 121.42 74.2 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.704 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -82.92 34.9 0.56 Allowed 'Trans proline' 0 N--CA 1.463 -0.292 0 C-N-CA 122.716 2.277 . . . . 10.0 112.182 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 45.0 mt -92.98 -64.03 1.15 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.6 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.27 -37.37 82.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.683 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.2 m -71.24 -24.73 24.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.561 -0.29 . . . . 10.0 111.378 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.24 -33.78 73.79 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.174 0.511 . . . . 10.0 109.787 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.669 HG11 ' HB2' ' A' ' 235' ' ' MET . 57.7 t -68.47 -28.95 42.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.539 -0.755 . . . . 10.0 109.99 179.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.7 -13.59 61.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.652 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.27 -34.33 8.83 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.123 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -93.49 58.49 2.27 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.926 -0.654 . . . . 10.0 112.316 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.415 HG22 ' O ' ' B' ' 17' ' ' VAL . 0.2 OUTLIER -107.11 6.7 9.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.051 0.453 . . . . 10.0 110.576 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.401 ' HE1' ' HA ' ' A' ' 769' ' ' GLN . 1.3 ptp -112.96 -168.77 1.37 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.311 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 6.3 m -62.18 127.2 30.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.659 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.94 110.47 0.82 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.43 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -124.05 156.68 36.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.881 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.87 139.42 50.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.917 0.389 . . . . 10.0 111.199 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 22.1 ptp -124.42 177.68 5.78 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.13 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.416 ' HB3' HG23 ' A' ' 829' ' ' VAL . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.741 -0.647 . . . . 10.0 110.832 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 93.2 t . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 120.772 0.32 . . . . 10.0 110.373 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -84.02 146.8 27.77 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.7 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.66 163.65 10.68 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 111.569 -0.612 . . . . 10.0 111.569 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.72 117.64 5.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.789 0.328 . . . . 10.0 110.207 179.558 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -58.21 142.93 46.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.037 -0.528 . . . . 10.0 111.214 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 77.12 -63.16 0.38 Allowed 'General case' 0 N--CA 1.465 0.277 0 O-C-N 124.158 0.911 . . . . 10.0 111.595 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -69.29 -66.51 0.57 Allowed 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.215 0.82 . . . . 10.0 113.215 -177.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -72.57 -26.27 61.66 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -178.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 m -56.81 -45.09 82.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 10.0 111.366 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.3 mt -69.47 -28.81 66.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.398 -0.365 . . . . 10.0 111.731 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -71.71 -49.07 42.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.765 0.317 . . . . 10.0 110.549 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 20' ' ' ARG . 3.0 ttp85 -66.63 -37.04 84.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.406 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.594 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -64.12 -32.99 74.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.251 179.38 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.0 tpp180 -62.1 -36.17 80.92 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.645 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.9 -41.03 97.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.104 -0.498 . . . . 10.0 109.868 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 22.7 t -67.57 -36.79 77.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.999 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 21' ' ' MET . 70.2 t -59.49 -37.3 69.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.08 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -62.95 -43.1 99.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.894 -0.594 . . . . 10.0 109.944 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.4 mt -62.07 -47.12 94.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.268 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 60.5 mt -60.39 -35.9 65.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.804 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -69.38 -34.43 74.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.056 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.482 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -77.61 -26.56 50.74 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.062 0.458 . . . . 10.0 110.744 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 45.8 mtt -79.06 -10.5 59.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.136 -0.483 . . . . 10.0 111.263 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.47 ' CD ' ' HD3' ' A' ' 72' ' ' ARG . 5.8 mt-10 -57.79 -56.89 29.88 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 119.147 -0.454 . . . . 10.0 111.632 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.482 ' HD2' ' O ' ' A' ' 30' ' ' ALA . 50.7 Cg_exo -56.0 -32.31 85.56 Favored 'Trans proline' 0 C--N 1.36 1.141 0 C-N-CA 121.803 1.669 . . . . 10.0 112.022 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -67.05 -46.62 73.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.704 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 24.6 mmt -68.51 -35.6 77.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.823 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -63.13 -29.3 70.68 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.207 0.527 . . . . 10.0 110.253 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -74.34 -31.73 62.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.89 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.4 mp -74.83 136.95 41.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.962 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.6 p -78.55 175.93 9.89 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.894 -0.322 . . . . 10.0 110.497 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -55.64 -51.9 65.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.213 0.449 . . . . 10.0 112.213 -178.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -63.87 -29.6 70.77 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.069 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -67.93 -39.41 83.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.677 0.275 . . . . 10.0 110.308 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -66.04 -40.14 90.75 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -60.75 -38.85 86.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.17 -0.923 . . . . 10.0 109.815 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.01 -26.14 74.11 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.466 -0.788 . . . . 10.0 112.038 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -65.48 -38.78 90.78 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.049 -0.352 . . . . 10.0 110.049 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 17.1 m -62.76 -40.23 96.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.198 0.523 . . . . 10.0 109.75 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.77 -35.76 77.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.06 178.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -62.59 -41.91 99.24 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.077 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -62.96 -39.63 95.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.231 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -59.99 -46.62 88.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.052 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.68 -38.94 80.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.782 -0.644 . . . . 10.0 111.077 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -61.39 -47.61 85.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.97 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.2 mt -62.97 -35.0 78.71 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.146 0.498 . . . . 10.0 110.704 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.61 -42.63 95.41 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.485 -0.78 . . . . 10.0 111.138 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.483 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -83.98 -51.08 7.42 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.005 0.372 . . . . 10.0 112.005 -179.156 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 171.28 88.13 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.254 -0.975 . . . . 10.0 113.006 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -149.07 148.72 30.02 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.8 t -95.79 131.44 42.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.6 tp -58.77 -41.82 87.52 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.098 0.475 . . . . 10.0 110.636 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -69.46 -11.42 60.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.377 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -93.45 -20.04 20.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.282 0.563 . . . . 10.0 110.371 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 67.3 mt -82.2 -10.78 59.02 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.756 -0.657 . . . . 10.0 111.557 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.545 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 67.4 mt -46.9 -53.33 27.17 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.545 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.5 Cg_exo -54.11 -54.06 5.33 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.736 1.624 . . . . 10.0 113.067 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.431 ' O ' HG23 ' A' ' 70' ' ' VAL . 42.5 mt-10 -68.08 -43.67 78.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 10.0 112.108 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.524 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -62.18 -50.28 72.43 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.805 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -63.08 -33.0 74.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.772 -179.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.78 -45.4 86.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.484 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 66' ' ' GLU . 96.5 t -61.93 -46.68 95.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.134 -0.485 . . . . 10.0 110.211 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 67' ' ' ALA . 45.3 t -60.82 -45.77 97.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.208 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.47 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 5.3 ttm180 -59.45 -43.74 93.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.593 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 -62.88 -47.43 83.35 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.116 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.5 -30.33 71.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.849 -0.614 . . . . 10.0 111.124 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.9 m -61.78 -35.62 78.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.756 0.313 . . . . 10.0 111.185 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.494 ' O ' ' HA2' ' A' ' 80' ' ' GLY . 51.2 mtmt -76.41 -28.85 56.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.532 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -88.28 -43.81 11.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.352 -0.386 . . . . 10.0 111.931 -178.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 90.4 t -77.11 -62.81 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.828 0.347 . . . . 10.0 111.694 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -83.05 -41.6 18.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.384 -178.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.494 ' HA2' ' O ' ' A' ' 76' ' ' LYS . . . 100.33 29.58 6.65 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.888 -0.672 . . . . 10.0 111.868 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 47.1 ttm -144.27 127.95 17.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.701 0.286 . . . . 10.0 110.39 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 29.4 ttp85 -71.48 126.23 29.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.202 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.38 117.46 3.84 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.803 -0.443 . . . . 10.0 109.803 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -57.06 147.16 25.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.315 0.578 . . . . 10.0 111.636 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -63.89 -32.52 74.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.198 -0.91 . . . . 10.0 111.79 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.67 -26.64 31.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.033 0.444 . . . . 10.0 110.728 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.52 HE22 HD23 ' A' ' 110' ' ' LEU . 92.9 mt-30 -74.14 -31.05 62.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.265 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.405 HD11 ' CZ ' ' A' ' 72' ' ' ARG . 92.8 mt -63.45 -37.65 88.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.153 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.0 mt -65.04 -49.53 69.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.426 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -64.51 -44.68 94.82 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.733 -0.667 . . . . 10.0 112.554 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.33 -31.23 80.17 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.082 -0.58 . . . . 10.0 112.566 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.594 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 16.3 ttm -70.14 -37.74 75.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.763 0.316 . . . . 10.0 110.69 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 91.8 t -72.87 -29.14 28.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.149 0.5 . . . . 10.0 110.198 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 mt -70.63 -5.57 30.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.715 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -80.41 -25.74 38.86 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.03 -0.729 . . . . 10.0 109.03 178.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -93.96 177.49 5.97 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.319 -0.855 . . . . 10.0 110.179 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.587 ' HG2' ' CD2' ' A' ' 407' ' ' LEU . 13.7 ttt85 -86.57 75.36 9.73 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.097 -0.501 . . . . 10.0 109.708 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 85.6 m -147.94 174.94 11.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.114 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.445 HD12 HG11 ' A' ' 211' ' ' VAL . 40.9 mm -112.72 134.39 55.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.619 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -112.36 119.73 39.28 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.869 0.366 . . . . 10.0 111.375 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -89.89 106.05 18.21 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.422 ' O ' ' HA2' ' A' ' 392' ' ' GLY . 35.4 ttm -103.3 151.47 22.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.095 0.474 . . . . 10.0 110.665 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.505 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 0.2 OUTLIER -85.52 149.68 25.21 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.758 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.78 107.28 5.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.982 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 133.66 -25.66 3.56 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.775 -0.726 . . . . 10.0 112.705 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.609 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 1.2 mm-40 -74.31 -21.17 59.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.818 0.342 . . . . 10.0 110.983 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.33 85.39 1.87 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.638 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.498 ' HD2' ' SD ' ' A' ' 390' ' ' MET . 8.4 mtmt -62.97 -65.88 0.62 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.925 0.393 . . . . 10.0 111.852 -179.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -60.09 -30.03 68.98 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.162 0.43 . . . . 10.0 112.162 -178.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.52 HD23 HE22 ' A' ' 87' ' ' GLN . 35.0 tp -68.01 -25.82 65.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.787 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 60.6 m -89.69 -28.95 19.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.008 0.432 . . . . 10.0 111.07 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.12 -11.46 49.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.976 -0.556 . . . . 10.0 112.492 -179.073 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 14.9 p -74.98 -23.73 58.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.797 0.332 . . . . 10.0 111.622 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 38.1 mt -68.24 -57.87 8.34 Favored Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -65.46 -26.64 54.93 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.888 1.725 . . . . 10.0 112.098 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -67.67 -48.44 66.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.822 -0.627 . . . . 10.0 110.784 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.426 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 55.2 t80 -60.85 -45.4 94.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.644 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 32.0 tp -59.87 -52.34 65.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.02 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -70.49 -20.62 62.84 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 111.971 0.36 . . . . 10.0 111.971 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.546 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -73.52 -27.59 61.45 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.497 -0.32 . . . . 10.0 110.743 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 69.3 mt -57.49 -35.5 70.29 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.985 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -20.84 66.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.71 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.41 25.76 75.19 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.926 -0.654 . . . . 10.0 112.677 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -96.41 -10.88 26.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.736 0.303 . . . . 10.0 110.932 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 94.3 112.66 2.41 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.728 -0.749 . . . . 10.0 113.343 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.5 t -88.21 113.57 25.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.428 -0.582 . . . . 10.0 109.428 178.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -89.52 100.4 13.2 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.971 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 29.8 t -91.59 114.44 28.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.975 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 54.8 t -97.69 118.49 44.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.508 -179.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.43 148.54 34.15 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.629 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.66 -31.55 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 112.191 0.441 . . . . 10.0 112.191 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -149.92 166.09 30.65 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.667 0.27 . . . . 10.0 110.801 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -72.64 -23.47 60.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.696 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -55.8 -54.56 43.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.691 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.3 mt -73.72 -35.87 65.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.564 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.64 -52.3 64.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.077 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -69.28 -39.47 78.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.601 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 138' ' ' ARG . 4.1 ttp85 -53.83 -55.64 24.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.134 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.93 -28.94 61.76 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.741 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.81 85.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.967 0.413 . . . . 10.0 110.783 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -90.54 -32.17 16.43 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.051 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -68.42 -42.62 78.68 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.933 0.397 . . . . 10.0 111.291 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -89.51 2.91 53.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.222 -0.444 . . . . 10.0 111.105 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.457 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 56.3 ttm-85 -63.62 -48.18 81.08 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.79 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' PRO . . . . . 0.457 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 16.3 Cg_exo -68.73 8.73 0.52 Allowed 'Trans proline' 0 C--N 1.361 1.216 0 C-N-CA 122.21 1.94 . . . . 10.0 112.618 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.7 tp -111.59 -57.84 2.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.138 -0.483 . . . . 10.0 109.863 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -71.11 -49.43 44.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.65 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.13 -13.51 62.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.23 0.538 . . . . 10.0 110.601 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -78.62 -39.81 36.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.901 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 92.4 mt -81.86 -37.75 26.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.405 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 139.26 29.15 0.22 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.075 -1.06 . . . . 10.0 113.277 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 88.8 mt -119.94 123.2 42.97 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.62 127.43 32.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.19 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.407 ' HB ' ' NH1' ' A' ' 144' ' ' ARG . 14.7 t -104.68 107.02 21.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.474 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -105.31 143.23 15.64 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.841 -0.695 . . . . 10.0 111.999 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.4 tp -117.02 123.71 72.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.051 0.453 . . . . 10.0 110.544 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -101.69 115.19 29.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.134 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 85.2 mt -103.99 144.86 29.54 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.035 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' PRO . . . . . 0.514 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 23.5 Cg_endo -62.06 112.52 1.55 Allowed 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.623 2.215 . . . . 10.0 111.937 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 96.99 8.7 56.7 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.874 -0.679 . . . . 10.0 112.434 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 43.3 ttm -68.31 135.93 91.18 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.428 -0.212 . . . . 10.0 110.428 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -50.45 144.29 24.97 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.799 2.333 . . . . 10.0 112.573 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' ALA . . . . . 0.441 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.46 -48.24 90.58 Favored Pre-proline 0 CA--C 1.54 0.573 0 N-CA-C 113.359 0.874 . . . . 10.0 113.359 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.441 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.4 Cg_exo -57.1 -33.36 95.65 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 121.789 1.659 . . . . 10.0 112.584 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.44 -38.99 48.29 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -59.61 -42.99 93.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.797 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -58.81 -32.9 69.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.437 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -75.72 -38.33 58.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.893 0.378 . . . . 10.0 110.417 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.27 -38.69 88.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.628 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -79.58 -24.28 42.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.194 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -75.24 -11.82 60.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.139 0.495 . . . . 10.0 110.285 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -72.69 173.33 9.18 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.471 -0.786 . . . . 10.0 110.28 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' ASP . . . . . 0.546 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 5.1 m-20 -77.36 -36.01 54.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.088 0.47 . . . . 10.0 109.826 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 76.1 mt -130.02 128.3 64.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.911 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 9.4 m -119.4 117.54 28.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.915 0.388 . . . . 10.0 111.527 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -94.29 133.06 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.638 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -167.61 164.68 38.12 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.126 -1.035 . . . . 10.0 113.131 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.56 150.11 28.33 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 122.275 0.23 . . . . 10.0 110.972 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -57.98 -41.07 82.2 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -51.81 66.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.506 -0.315 . . . . 10.0 111.261 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.514 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 4.4 tp10 -64.33 -36.96 85.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.954 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.28 -34.84 72.75 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.019 0.438 . . . . 10.0 110.543 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -77.66 -41.16 20.48 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 111.298 -0.721 . . . . 10.0 111.298 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -62.44 -39.47 93.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.339 . . . . 10.0 110.485 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -61.26 -41.78 97.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.579 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -64.16 -35.96 82.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.178 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 62.5 mt -68.95 -42.88 76.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.666 -0.697 . . . . 10.0 110.29 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 62.3 mtm-85 -67.04 -41.36 86.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.559 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.82 -39.92 90.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.758 -0.656 . . . . 10.0 110.731 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -83.86 7.97 16.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.694 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.98 5.27 13.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.909 0.385 . . . . 10.0 110.736 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -78.34 168.32 20.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.629 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -110.45 -24.29 10.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.208 0.528 . . . . 10.0 110.271 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.89 138.36 30.41 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.46 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 195' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 667' ' ' LEU . 16.1 Cg_endo -59.05 -23.31 68.2 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.628 2.218 . . . . 10.0 112.377 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -77.49 -7.07 55.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.246 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -94.36 0.2 55.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.8 0.333 . . . . 10.0 110.476 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 198' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 198' ' ' ARG . 43.6 mtt85 -62.88 158.84 18.04 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.151 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 16.7 m -134.8 -19.21 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.908 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -84.93 175.77 8.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.218 0.532 . . . . 10.0 111.654 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.43 -179.19 5.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.6 -0.727 . . . . 10.0 109.67 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -61.73 129.75 42.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.026 0.441 . . . . 10.0 111.05 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 203' ' ' LEU . . . . . 0.4 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . 22.3 mt -84.11 63.51 7.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.387 0.613 . . . . 10.0 110.154 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -80.3 -53.42 6.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.738 -0.665 . . . . 10.0 112.03 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -130.97 137.58 49.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.981 0.42 . . . . 10.0 111.416 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.588 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -133.13 121.3 22.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.416 -0.811 . . . . 10.0 109.703 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 57.7 tp -122.91 113.48 19.16 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 208' ' ' VAL . . . . . 0.468 HG22 ' H ' ' A' ' 210' ' ' GLU . 9.0 p -97.0 139.34 19.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.594 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.73 -27.61 62.15 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.591 -179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 210' ' ' GLU . . . . . 0.541 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 4.4 tp10 -145.76 134.09 21.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.113 0.482 . . . . 10.0 110.954 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.652 HG22 ' HB ' ' A' ' 391' ' ' THR . 3.4 m -102.37 -17.95 6.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.335 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 212' ' ' ASP . . . . . 0.401 ' OD1' ' HD2' ' A' ' 566' ' ' ARG . 3.8 t70 -60.04 -68.41 0.29 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.52 -0.764 . . . . 10.0 111.574 -179.411 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.433 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 0.8 OUTLIER -84.58 22.57 1.28 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.561 0.578 . . . . 10.0 112.561 -178.22 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 45.4 mt -138.05 -66.22 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 112.545 0.572 . . . . 10.0 112.545 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 27.0 mt -70.28 -46.05 65.12 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.495 0.554 . . . . 10.0 112.495 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 50.8 mm -85.51 -47.36 16.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.882 -0.327 . . . . 10.0 111.759 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 217' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 0.3 OUTLIER -69.98 -59.63 2.79 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -178.947 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -85.38 46.59 1.31 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.005 0.431 . . . . 10.0 111.78 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -76.51 -53.19 8.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.389 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 220' ' ' ARG . . . . . 0.458 ' O ' ' HD3' ' A' ' 220' ' ' ARG . 0.2 OUTLIER -105.85 46.68 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.227 0.537 . . . . 10.0 110.837 -179.08 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 2.9 m -107.55 102.44 44.52 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.583 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -88.83 132.44 2.41 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.802 2.335 . . . . 10.0 113.578 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 223' ' ' LEU . . . . . . . . . . . . . 96.7 mt -82.62 93.12 7.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.147 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 29.2 mt -92.74 125.8 45.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.051 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 225' ' ' ILE . . . . . 0.476 ' HB ' HD23 ' A' ' 372' ' ' LEU . 2.6 mt -127.88 144.19 38.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.416 -0.587 . . . . 10.0 109.416 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 226' ' ' SER . . . . . 0.456 ' HA ' ' O ' ' A' ' 370' ' ' GLN . 1.2 m -87.63 155.07 20.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.522 0.201 . . . . 10.0 110.699 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -86.41 164.08 36.13 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.018 -0.61 . . . . 10.0 113.201 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -84.95 -19.27 4.0 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.784 2.323 . . . . 10.0 113.3 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 229' ' ' ALA . . . . . 0.547 ' O ' ' HA ' ' B' ' 21' ' ' VAL . . . -118.27 47.23 1.64 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 10.0 111.559 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 230' ' ' GLU . . . . . 0.657 ' HA ' HG22 ' B' ' 21' ' ' VAL . 49.4 mm-40 -70.33 171.47 9.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.901 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -71.43 138.55 49.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 110.021 -0.362 . . . . 10.0 110.021 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 7.0 m -128.1 -34.21 2.13 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.974 179.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 233' ' ' SER . . . . . 0.409 ' HA ' HD12 ' A' ' 365' ' ' ILE . 49.2 m -166.12 58.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.024 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -155.68 -58.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.305 -0.558 . . . . 10.0 112.39 179.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -60.23 3.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.543 0.211 . . . . 10.0 111.127 -178.467 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -64.57 -27.66 69.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.917 0.389 . . . . 10.0 110.57 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 12.4 ttmt -66.2 -41.87 89.57 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.481 -0.563 . . . . 10.0 109.481 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 7.8 tpp180 -68.04 -33.05 73.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.746 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 77.2 t -67.83 -46.4 82.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.813 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -77.71 -5.29 50.06 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.228 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 5.4 tptt -70.46 -21.02 62.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.316 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 15.2 tt -89.06 -14.07 9.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.89 0.376 . . . . 10.0 111.203 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 243' ' ' ILE . . . . . 0.518 ' N ' ' HD2' ' A' ' 244' ' ' PRO . 48.2 mm -61.39 -49.59 86.92 Favored Pre-proline 0 CA--C 1.54 0.582 0 N-CA-C 113.247 0.832 . . . . 10.0 113.247 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 244' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 243' ' ' ILE . 19.0 Cg_endo -59.58 -10.91 12.53 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 122.332 2.021 . . . . 10.0 113.337 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -88.16 -24.39 23.35 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.863 0.363 . . . . 10.0 110.218 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 246' ' ' LEU . . . . . 0.484 HD22 ' OD1' ' A' ' 253' ' ' ASP . 13.7 mt -73.18 139.32 46.23 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.673 -0.694 . . . . 10.0 112.567 -177.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 3.8 mt -127.69 105.18 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 108.368 -0.975 . . . . 10.0 108.368 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 248' ' ' ARG . . . . . 0.615 ' HA ' ' O ' ' A' ' 253' ' ' ASP . 7.1 ttt180 -42.36 106.8 0.07 Allowed 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 112.827 0.677 . . . . 10.0 112.827 -178.042 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 29.7 tp60 -179.55 -61.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.222 -0.899 . . . . 10.0 110.152 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -162.71 -166.48 1.34 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.471 ' H ' ' HG ' ' A' ' 281' ' ' LEU . 62.4 mttm 60.55 40.25 17.07 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 123.306 0.378 . . . . 10.0 111.283 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 252' ' ' GLU . . . . . 0.499 ' OE2' ' HB3' ' A' ' 281' ' ' LEU . 6.0 mm-40 78.4 -11.15 1.24 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.034 0.934 . . . . 10.0 111.009 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 253' ' ' ASP . . . . . 0.615 ' O ' ' HA ' ' A' ' 248' ' ' ARG . 15.8 m-20 -78.12 53.54 1.22 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.991 0.424 . . . . 10.0 110.045 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.11 143.95 26.34 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.377 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.68 -22.07 22.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.213 0.53 . . . . 10.0 109.659 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.77 -92.97 0.12 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.04 178.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 46.35 -113.22 0.43 Allowed 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.918 0.761 . . . . 10.0 111.517 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 258' ' ' GLN . . . . . 0.406 ' OE1' ' HB ' ' A' ' 275' ' ' THR . 32.4 mt-30 57.67 31.29 20.17 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 122.817 0.447 . . . . 10.0 111.98 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 111.56 -59.83 0.35 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.824 -0.703 . . . . 10.0 112.551 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.25 -71.63 0.46 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.874 0.369 . . . . 10.0 111.191 -179.558 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 75.82 -127.17 8.82 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.651 -0.785 . . . . 10.0 112.267 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -175.66 143.63 0.62 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.935 -0.765 . . . . 10.0 108.935 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -64.0 145.64 55.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.601 -0.518 . . . . 10.0 109.601 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 1.7 p -53.34 108.93 0.38 Allowed 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.515 0.51 . . . . 10.0 112.208 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 265' ' ' VAL . . . . . 0.403 ' O ' ' HB3' ' A' ' 266' ' ' ASP . 9.8 p -160.76 29.5 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.893 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 266' ' ' ASP . . . . . 0.403 ' HB3' ' O ' ' A' ' 265' ' ' VAL . 37.8 t70 69.58 43.03 1.04 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 122.471 1.129 . . . . 10.0 108.17 -178.143 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 267' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 267' ' ' GLU . 10.9 pm0 -71.36 125.73 27.77 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.337 -1.302 . . . . 10.0 110.768 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 268' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -133.48 146.03 50.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.461 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 3.6 m -76.89 67.6 2.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.007 0.432 . . . . 10.0 110.745 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 270' ' ' ARG . . . . . 0.516 HH21 ' CD ' ' A' ' 338' ' ' GLU . 16.0 tpt180 -67.81 -26.66 66.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.672 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -93.2 3.4 55.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.027 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 58.5 t 67.64 -77.99 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.801 -179.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 4.9 m120 68.22 -64.51 0.29 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.605 0.762 . . . . 10.0 112.402 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 28.3 tp 72.26 -65.87 0.33 Allowed 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.448 0.699 . . . . 10.0 110.325 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 275' ' ' THR . . . . . 0.504 HG22 ' NE ' ' A' ' 277' ' ' ARG . 2.2 m 73.51 -57.24 0.63 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.372 0.669 . . . . 10.0 112.07 179.153 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 63.33 108.69 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.095 0.776 . . . . 10.0 113.095 178.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 277' ' ' ARG . . . . . 0.504 ' NE ' HG22 ' A' ' 275' ' ' THR . 6.1 ptp180 178.06 167.83 0.75 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.066 177.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.401 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . 124.11 -48.99 0.92 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.791 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.497 ' O ' HG22 ' A' ' 282' ' ' ILE . 15.0 mt 69.97 -63.18 0.4 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.446 0.698 . . . . 10.0 112.226 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.67 -26.69 32.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.165 0.507 . . . . 10.0 111.066 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 281' ' ' LEU . . . . . 0.499 ' HB3' ' OE2' ' A' ' 252' ' ' GLU . 5.5 mp -67.72 -52.32 39.09 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.798 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 282' ' ' ILE . . . . . 0.497 HG22 ' O ' ' A' ' 279' ' ' LEU . 13.1 tt -65.94 -18.35 23.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.691 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -63.87 -25.92 68.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.987 0.423 . . . . 10.0 110.68 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -90.19 -24.98 20.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.534 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 19.1 tp -77.35 -36.74 53.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.068 0.461 . . . . 10.0 110.341 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 286' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 298' ' ' LEU . 48.3 mt -71.95 -179.45 2.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.551 -0.749 . . . . 10.0 111.634 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 287' ' ' VAL . . . . . 0.517 HG12 ' H ' ' A' ' 288' ' ' LYS . 2.9 t 64.36 169.32 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-N 115.503 -0.771 . . . . 10.0 111.304 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 288' ' ' LYS . . . . . 0.517 ' H ' HG12 ' A' ' 287' ' ' VAL . 0.0 OUTLIER 77.03 152.16 0.13 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.984 0.914 . . . . 10.0 112.738 178.572 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 69.14 -70.63 0.13 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 114.814 -1.085 . . . . 10.0 113.012 179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . 170.34 161.75 21.43 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.696 -0.764 . . . . 10.0 111.767 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 291' ' ' ILE . . . . . . . . . . . . . 32.1 mt 72.45 -66.19 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 123.04 0.536 . . . . 10.0 110.19 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -73.77 -13.47 60.96 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.489 -0.559 . . . . 10.0 109.489 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 293' ' ' ASP . . . . . 0.512 ' HA ' ' HA ' ' A' ' 287' ' ' VAL . 0.6 OUTLIER -79.19 -9.32 59.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.173 -179.622 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.55 -20.51 62.79 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.131 0.491 . . . . 10.0 110.677 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 91.14 50.77 2.74 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.782 -0.723 . . . . 10.0 111.391 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -127.57 173.39 9.92 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.28 171.38 15.26 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.283 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.627 ' O ' ' HB2' ' A' ' 307' ' ' MET . 18.2 tp -101.93 -35.23 9.06 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.014 0.435 . . . . 10.0 110.198 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -98.46 24.57 7.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.802 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 1.8 p -76.91 160.4 76.57 Favored Pre-proline 0 C--N 1.326 -0.422 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -56.44 -20.2 32.12 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.903 2.402 . . . . 10.0 113.605 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -96.84 -47.53 5.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.759 0.314 . . . . 10.0 111.585 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -86.43 9.11 19.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.022 0.439 . . . . 10.0 111.581 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 8.9 tp -59.42 -26.13 33.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.621 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 13.3 tmm? -63.62 -46.03 87.6 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.08 -41.41 81.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.09 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 307' ' ' MET . . . . . 0.627 ' HB2' ' O ' ' A' ' 298' ' ' LEU . 17.6 tpt -54.3 -49.36 69.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.17 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -69.42 -24.2 63.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.26 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 2.9 m170 -80.69 -38.54 28.74 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.083 -0.247 . . . . 10.0 111.173 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 28.9 m -70.01 -25.1 27.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 109.899 -0.408 . . . . 10.0 109.899 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 32.7 m -62.86 -34.21 76.88 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.273 0.558 . . . . 10.0 109.571 178.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 312' ' ' ALA . . . . . 0.472 ' HA ' ' HG2' ' A' ' 315' ' ' ARG . . . -65.2 -36.77 85.24 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.546 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -70.98 -36.84 72.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.725 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 5.3 mp -67.82 -48.39 66.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.641 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 315' ' ' ARG . . . . . 0.472 ' HG2' ' HA ' ' A' ' 312' ' ' ALA . 4.8 ptp85 -63.43 -28.93 70.31 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.766 0.317 . . . . 10.0 110.547 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -73.82 -3.8 30.89 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.771 0.285 . . . . 10.0 111.771 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 317' ' ' HIS . . . . . 0.51 ' CE1' HG21 ' A' ' 243' ' ' ILE . 51.8 m80 -119.71 -2.19 10.45 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.016 0.376 . . . . 10.0 112.016 -179.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -135.97 -37.7 0.72 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.927 -0.309 . . . . 10.0 111.812 -179.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -88.29 -37.92 15.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.18 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -105.57 106.08 16.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.046 0.45 . . . . 10.0 111.502 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.41 130.01 46.45 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.148 179.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 322' ' ' ARG . . . . . 0.44 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 33.2 ttp180 -71.96 153.23 41.95 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 121.023 -0.271 . . . . 10.0 110.892 -179.473 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 323' ' ' ASP . . . . . 0.44 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 6.3 m-20 75.13 8.37 4.03 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.864 0.727 . . . . 10.0 111.538 178.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 4.8 p -148.85 -47.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.628 -0.26 . . . . 10.0 110.606 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -91.08 -30.12 16.93 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.392 0.615 . . . . 10.0 110.018 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -154.43 150.53 27.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.598 -0.728 . . . . 10.0 109.706 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 18.4 tt -125.2 125.24 68.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-O 121.214 0.53 . . . . 10.0 110.372 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 38.3 t -94.08 101.79 12.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.026 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 329' ' ' LYS . . . . . 0.448 ' O ' ' HG3' ' A' ' 329' ' ' LYS . 3.1 ptmm? -110.04 106.53 16.07 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.843 0.354 . . . . 10.0 110.598 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 39.35 61.96 1.24 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.191 -0.913 . . . . 10.0 113.246 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 331' ' ' GLY . . . . . 0.435 ' HA2' HG12 ' A' ' 363' ' ' VAL . . . 93.28 -39.51 2.95 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.889 -0.672 . . . . 10.0 113.991 178.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -81.72 118.63 23.0 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.137 0.494 . . . . 10.0 111.828 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 42.9 t -96.98 99.12 8.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.716 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 68.5 mt -91.45 135.04 28.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.899 -0.592 . . . . 10.0 110.711 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 5.2 mp -84.85 132.86 30.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 13.8 t -111.71 126.84 69.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.031 0.443 . . . . 10.0 110.96 -179.054 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 337' ' ' ASP . . . . . 0.4 ' HB3' ' H ' ' A' ' 342' ' ' ARG . 3.3 t70 -72.78 119.49 17.08 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.965 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 338' ' ' GLU . . . . . 0.516 ' CD ' HH21 ' A' ' 270' ' ' ARG . 4.8 tt0 -72.98 -9.66 58.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.922 -0.581 . . . . 10.0 112.507 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -81.6 -49.72 10.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.863 -0.523 . . . . 10.0 111.967 -178.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.38 14.5 6.09 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.775 0.657 . . . . 10.0 112.775 -178.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 61.93 53.49 42.58 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.498 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 342' ' ' ARG . . . . . 0.4 ' H ' ' HB3' ' A' ' 337' ' ' ASP . 2.9 tpp180 -100.89 117.46 35.0 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.667 0.27 . . . . 10.0 111.128 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.24 105.19 14.0 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.376 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 62.6 mtm -112.23 104.94 13.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.875 0.369 . . . . 10.0 111.038 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -78.45 -36.92 44.78 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.604 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -87.85 63.75 3.76 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.854 -0.688 . . . . 10.0 112.134 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -137.97 106.28 5.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.802 0.334 . . . . 10.0 110.414 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -100.14 116.49 32.27 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.984 0.421 . . . . 10.0 111.029 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -98.92 131.57 44.9 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.074 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.4 m -79.42 -173.79 3.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.608 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 12.5 t70 58.72 23.06 10.69 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.361 0.664 . . . . 10.0 111.561 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 352' ' ' GLY . . . . . 0.415 ' HA2' ' HB2' ' A' ' 355' ' ' GLN . . . 60.03 31.24 72.05 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.823 -0.626 . . . . 10.0 112.703 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.59 -47.62 66.79 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.127 0.417 . . . . 10.0 112.127 -179.109 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 354' ' ' HIS . . . . . 0.455 ' O ' ' HB ' ' A' ' 357' ' ' VAL . 20.2 p80 -112.12 5.13 18.39 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.436 -0.506 . . . . 10.0 111.572 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 355' ' ' GLN . . . . . 0.415 ' HB2' ' HA2' ' A' ' 352' ' ' GLY . 0.5 OUTLIER -68.05 -38.93 83.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.02 0.438 . . . . 10.0 110.716 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -74.16 -17.75 60.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.22 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 357' ' ' VAL . . . . . 0.455 ' HB ' ' O ' ' A' ' 354' ' ' HIS . 54.2 t -67.49 -39.05 81.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.685 179.097 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.429 ' CB ' ' HA ' ' A' ' 365' ' ' ILE . 1.8 mt-10 -62.59 -32.99 74.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.61 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -83.13 -26.44 30.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.305 0.574 . . . . 10.0 110.653 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 70.0 tttt -71.17 -41.9 69.78 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.261 -0.882 . . . . 10.0 110.474 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -91.87 -170.2 2.49 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.058 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -101.19 64.43 0.52 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.827 -0.701 . . . . 10.0 111.797 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 363' ' ' VAL . . . . . 0.435 HG12 ' HA2' ' A' ' 331' ' ' GLY . 5.9 m -137.73 -166.19 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.698 0.285 . . . . 10.0 110.653 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -108.82 134.03 52.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.689 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 365' ' ' ILE . . . . . 0.429 ' HA ' ' CB ' ' A' ' 358' ' ' GLU . 2.9 mt -69.61 140.38 18.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 179.019 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -65.6 158.77 26.3 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.745 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -76.24 57.78 1.18 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.947 -179.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 368' ' ' GLU . . . . . 0.468 ' HB2' ' HB3' ' A' ' 230' ' ' GLU . 1.4 tm-20 45.64 -152.54 0.05 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.494 0.717 . . . . 10.0 111.472 -179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -157.64 -32.16 0.08 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.633 0.254 . . . . 10.0 111.337 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 370' ' ' GLN . . . . . 0.456 ' O ' ' HA ' ' A' ' 226' ' ' SER . 0.0 OUTLIER -117.92 -110.72 0.35 Allowed 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.678 -0.409 . . . . 10.0 111.738 -179.241 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 371' ' ' THR . . . . . 0.546 HG21 HG21 ' B' ' 21' ' ' VAL . 0.2 OUTLIER 57.04 -147.68 0.52 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 122.981 0.512 . . . . 10.0 112.042 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 372' ' ' LEU . . . . . 0.476 HD23 ' HB ' ' A' ' 225' ' ' ILE . 23.4 tp 55.57 -97.2 0.07 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.983 0.913 . . . . 10.0 112.471 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -164.1 172.32 13.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.705 0.288 . . . . 10.0 110.735 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 374' ' ' SER . . . . . . . . . . . . . 8.8 t -164.22 161.84 22.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.239 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.6 tt -157.73 148.46 9.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.38 . . . . 10.0 110.489 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.14 143.06 29.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.619 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -56.06 -50.64 70.4 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 123.126 0.266 . . . . 10.0 111.356 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -53.45 -47.64 69.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.101 -0.499 . . . . 10.0 111.402 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -67.18 -31.11 71.28 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.202 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -70.27 -41.42 73.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.509 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -72.78 -19.26 61.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.047 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 72.1 mtp180 -77.12 -5.85 50.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.735 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.417 HD21 HH22 ' A' ' 656' ' ' ARG . 47.1 mt -96.79 7.58 46.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.798 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.588 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 21.2 m-85 -99.51 151.36 21.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.733 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -78.95 -76.36 0.2 Allowed 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 76.1 mttt -90.41 90.3 7.97 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.412 ' H ' ' HG3' ' A' ' 97' ' ' ARG . 57.7 tp -95.73 109.55 21.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.768 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -125.66 154.08 42.88 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.692 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -155.24 143.97 10.5 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.539 -0.839 . . . . 10.0 112.192 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 390' ' ' MET . . . . . 0.498 ' SD ' ' HD2' ' A' ' 108' ' ' LYS . 33.4 ttm -114.0 128.93 56.61 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 391' ' ' THR . . . . . 0.652 ' HB ' HG22 ' A' ' 211' ' ' VAL . 5.7 t -122.75 -175.35 3.14 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 121.147 -0.221 . . . . 10.0 110.574 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 392' ' ' GLY . . . . . 0.422 ' HA2' ' O ' ' A' ' 102' ' ' MET . . . -103.4 165.54 15.8 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 110.979 -0.848 . . . . 10.0 110.979 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 393' ' ' THR . . . . . 0.454 ' OG1' ' HA ' ' A' ' 103' ' ' ARG . 1.0 OUTLIER -62.17 103.46 0.38 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.845 0.355 . . . . 10.0 111.074 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -151.61 -27.97 0.18 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.471 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 18.2 t70 54.39 -118.93 1.38 Allowed 'General case' 0 CA--C 1.535 0.377 0 O-C-N 123.374 0.421 . . . . 10.0 110.318 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 4.7 m 64.74 -96.66 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -81.62 36.87 0.45 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.912 0.387 . . . . 10.0 111.452 -178.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -64.5 -20.14 66.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.081 0.467 . . . . 10.0 110.961 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -81.74 -24.73 35.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.128 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -65.44 -38.3 89.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.733 0.302 . . . . 10.0 110.983 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -57.97 -47.26 83.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.171 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 4.9 m -75.83 -9.19 58.4 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.503 0.557 . . . . 10.0 112.503 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.2 m -102.77 -53.24 2.9 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.01 0.374 . . . . 10.0 112.01 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 60.3 mt -82.58 -50.41 15.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 112.809 0.67 . . . . 10.0 112.809 -177.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -94.97 -8.82 35.82 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm 62.09 43.34 8.91 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.834 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 407' ' ' LEU . . . . . 0.587 ' CD2' ' HG2' ' A' ' 97' ' ' ARG . 14.6 mt -117.66 140.92 49.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.36 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -88.98 128.85 35.71 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 110.067 -0.345 . . . . 10.0 110.067 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 2.1 m -87.13 101.2 13.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.984 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 38.2 t -96.57 133.86 36.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.607 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 15.3 t -88.68 122.23 39.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.934 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 48.6 t -87.22 130.15 48.95 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.219 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.83 150.21 86.06 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.719 2.279 . . . . 10.0 112.336 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 17.4 p -79.83 157.73 26.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.881 -0.599 . . . . 10.0 111.426 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -66.75 -40.46 88.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.334 0.588 . . . . 10.0 109.708 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 69.5 mtm180 -125.49 153.47 72.51 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.764 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -63.46 117.93 4.87 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.368 2.045 . . . . 10.0 111.413 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 30.9 mtm -66.33 114.14 5.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.557 -179.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 419' ' ' ILE . . . . . 0.476 ' HB ' ' HA ' ' A' ' 581' ' ' ALA . 0.7 OUTLIER -96.37 41.89 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.317 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -81.37 101.11 9.61 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.441 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -76.98 100.16 5.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.482 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -80.03 131.51 35.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.797 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 40.2 mt -116.04 149.14 42.87 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -62.47 169.21 8.54 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 122.85 2.367 . . . . 10.0 113.712 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -86.54 116.12 24.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.374 -0.83 . . . . 10.0 109.857 179.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 426' ' ' LEU . 25.2 mt -92.28 88.22 6.37 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.181 0.515 . . . . 10.0 110.273 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 15.8 t -83.38 125.18 40.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.474 -0.785 . . . . 10.0 110.11 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 428' ' ' TYR . . . . . 0.53 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 10.2 m-85 -111.99 179.5 3.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.511 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 4.3 mmt -70.53 -75.86 0.11 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.909 0.385 . . . . 10.0 111.923 -178.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 41.1 p -90.58 165.62 13.65 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.71 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 431' ' ' GLU . . . . . 0.431 ' HG3' ' HE2' ' A' ' 434' ' ' LYS . 8.0 tt0 -67.32 -26.88 66.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.547 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -61.1 -44.5 97.26 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.031 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -63.21 -40.83 98.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.572 -0.74 . . . . 10.0 110.21 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 434' ' ' LYS . . . . . 0.484 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 39.7 ttpt -59.72 -50.54 73.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.468 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 435' ' ' ILE . . . . . 0.537 ' O ' HG12 ' A' ' 439' ' ' ILE . 48.5 mm -65.44 -43.7 94.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.859 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -39.69 89.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.746 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.87 -33.92 76.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.026 0.441 . . . . 10.0 110.441 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 438' ' ' ILE . . . . . 0.406 HG23 HG21 ' A' ' 557' ' ' ILE . 89.1 mt -66.23 -45.49 89.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.688 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 439' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 435' ' ' ILE . 33.5 mm -62.38 -36.38 74.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.348 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -64.04 -45.54 88.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.378 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -61.76 -40.77 96.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.469 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.434 HG12 HG11 ' A' ' 452' ' ' VAL . 78.7 mt -72.13 -38.03 61.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.901 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 14.2 tttm -53.01 -38.68 62.55 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.918 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 444' ' ' GLU . . . . . 0.503 ' O ' ' HE2' ' A' ' 448' ' ' LYS . 61.8 mm-40 -78.0 -45.05 24.83 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.918 0.39 . . . . 10.0 111.959 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 43.1 mtt-85 -68.14 -29.89 68.89 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 -177.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 1.6 p -68.69 -35.05 76.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.134 0.492 . . . . 10.0 110.268 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.97 -15.01 49.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.49 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 448' ' ' LYS . . . . . 0.503 ' HE2' ' O ' ' A' ' 444' ' ' GLU . 0.2 OUTLIER -90.46 -31.44 16.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.627 179.804 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 105.57 23.55 7.49 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.766 -0.731 . . . . 10.0 112.964 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 450' ' ' GLN . . . . . 0.44 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 64.3 tt0 -104.64 127.76 28.27 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.896 0.348 . . . . 10.0 110.887 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 451' ' ' PRO . . . . . 0.409 ' HB3' ' O ' ' A' ' 496' ' ' TYR . 38.2 Cg_endo -68.25 140.01 47.64 Favored 'Trans proline' 0 C--O 1.237 0.466 0 C-N-CA 122.625 2.217 . . . . 10.0 111.372 178.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.434 HG11 HG12 ' A' ' 442' ' ' ILE . 77.4 t -125.28 130.78 72.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.086 0.47 . . . . 10.0 111.695 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 55.8 tp -114.66 106.61 14.44 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 40.9 t -92.73 117.82 36.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.508 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -96.89 127.75 9.31 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.597 -0.811 . . . . 10.0 111.738 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 10.1 p -120.61 137.0 54.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.589 0.233 . . . . 10.0 110.556 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 34.5 pt -93.6 -25.61 4.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.053 0.454 . . . . 10.0 110.486 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 4.0 p -115.62 133.54 55.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.102 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 20.5 mt -62.79 -32.84 57.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.256 0.55 . . . . 10.0 110.22 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.456 ' CD ' ' H ' ' A' ' 460' ' ' GLU . 1.9 mp0 -59.57 -35.03 73.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.606 -0.724 . . . . 10.0 110.577 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.91 -32.33 51.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.773 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.4 m -61.25 -42.55 98.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.049 0.452 . . . . 10.0 110.089 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -70.68 -35.45 72.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.179 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.64 -51.6 54.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.79 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 14.2 p -62.51 -35.44 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.71 0.29 . . . . 10.0 110.743 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 60.3 m -65.71 -39.74 91.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.574 -0.284 . . . . 10.0 110.407 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -58.46 -43.26 88.79 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.957 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -71.44 -35.42 70.92 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.64 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 47.5 mt -65.6 -44.22 87.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.553 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 3.1 m -67.8 -30.31 69.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.202 0.525 . . . . 10.0 109.886 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -66.1 -38.78 89.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.395 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -84.96 -3.09 58.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.986 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 72.83 36.24 57.91 Favored Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.88 -0.6 . . . . 10.0 112.483 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 88.5 mt -104.42 123.61 58.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 120.622 0.249 . . . . 10.0 110.67 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -64.21 139.37 58.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.403 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -159.8 145.04 15.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.918 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -117.17 125.47 51.25 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 478' ' ' VAL . . . . . 0.448 HG22 HD12 ' A' ' 502' ' ' ILE . 4.5 t -100.08 140.23 19.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.158 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 90.3 mt -94.02 151.61 19.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.101 -0.5 . . . . 10.0 109.752 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -161.71 130.12 4.29 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -58.18 -19.6 34.52 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -80.46 -6.83 58.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.938 0.399 . . . . 10.0 110.723 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 483' ' ' PHE . . . . . 0.435 ' O ' ' HG3' ' A' ' 487' ' ' GLU . 54.6 m-85 -131.07 45.96 2.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.45 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 9.2 m80 -51.32 -41.1 60.31 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.896 -179.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -63.64 -30.91 71.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.846 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -81.81 -38.12 26.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.918 0.39 . . . . 10.0 110.395 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 487' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 483' ' ' PHE . 53.8 mt-10 -55.6 -37.41 68.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.27 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -54.66 -41.48 70.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.592 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.26 -29.14 42.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.986 0.422 . . . . 10.0 111.092 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.1 mt -73.22 -53.3 18.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.308 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 68.6 t -60.48 -35.49 63.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.949 0.404 . . . . 10.0 111.239 -179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -64.08 -26.33 68.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.363 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -115.8 19.07 15.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.822 0.344 . . . . 10.0 110.888 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.74 -17.32 62.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.056 0.455 . . . . 10.0 111.045 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -93.89 8.65 73.5 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.851 -0.69 . . . . 10.0 112.086 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 496' ' ' TYR . . . . . 0.409 ' O ' ' HB3' ' A' ' 451' ' ' PRO . 61.7 t80 -68.72 138.55 90.76 Favored Pre-proline 0 C--N 1.325 -0.465 0 N-CA-C 110.271 -0.27 . . . . 10.0 110.271 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.84 128.13 29.16 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.642 2.228 . . . . 10.0 112.682 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.61 14.18 8.23 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.561 -0.745 . . . . 10.0 112.808 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.92 133.76 34.59 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.879 0.371 . . . . 10.0 110.351 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 25.9 t -111.62 113.45 44.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.375 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.9 m -111.79 134.17 53.53 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.502 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 502' ' ' ILE . . . . . 0.448 HD12 HG22 ' A' ' 478' ' ' VAL . 80.1 mt -111.63 117.62 55.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.787 0.327 . . . . 10.0 110.133 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -97.9 121.3 39.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.087 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 2.7 m -98.94 109.72 22.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.868 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 55.81 67.33 1.02 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.391 0.615 . . . . 10.0 111.002 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 38.6 tpp -76.3 128.57 35.15 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.699 -0.682 . . . . 10.0 111.136 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -76.68 179.75 5.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.789 -0.642 . . . . 10.0 111.448 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -68.59 160.82 51.44 Favored Glycine 0 CA--C 1.52 0.402 0 CA-C-N 116.029 -0.532 . . . . 10.0 113.357 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.541 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 99.1 mtt180 65.15 -82.72 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.54 0.736 . . . . 10.0 111.895 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 81.07 155.75 13.26 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.961 -0.638 . . . . 10.0 112.717 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.05 154.28 41.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.77 0.319 . . . . 10.0 111.009 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -75.66 109.9 9.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.367 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 45.9 mt -78.47 118.42 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.157 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 2.7 t -86.65 128.65 39.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.805 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 60.7 mt -74.05 133.31 42.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.33 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 83.78 15.72 69.76 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.274 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 95.43 -170.54 28.53 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.629 -0.796 . . . . 10.0 111.475 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 2.8 p -134.1 94.58 3.27 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.944 0.372 . . . . 10.0 110.896 -179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 519' ' ' TRP . . . . . 0.408 ' O ' HG22 ' A' ' 523' ' ' VAL . 21.9 p-90 -56.57 -30.07 62.75 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.826 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 68.8 mt-30 -61.25 -40.66 94.9 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.986 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.37 -24.55 39.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.972 0.415 . . . . 10.0 110.873 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -77.43 -46.87 21.27 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.98 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 523' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 519' ' ' TRP . 33.8 m -69.62 -26.41 30.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.861 0.362 . . . . 10.0 110.94 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -84.79 -5.61 59.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.432 . . . . 10.0 110.78 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -89.65 -9.73 48.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.481 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 11.2 mt -82.16 158.33 23.67 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.311 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.99 -28.87 32.39 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 178.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -146.75 92.35 5.07 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.461 -0.791 . . . . 10.0 109.759 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.5 92.48 1.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.449 2.1 . . . . 10.0 112.688 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -75.09 153.96 38.09 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.205 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -57.11 -35.68 69.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.979 0.419 . . . . 10.0 110.915 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -66.81 -43.95 82.46 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.15 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -69.12 -40.63 78.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.925 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.19 -44.08 94.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.32 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.55 -39.78 94.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.355 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -59.95 -53.37 58.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.736 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 94.0 mt -63.66 -39.1 84.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.74 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -61.97 -41.19 97.73 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.263 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.48 86.01 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.372 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 540' ' ' ASP . . . . . 0.593 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 40.7 m-20 -60.69 -46.21 91.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.777 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 541' ' ' TRP . . . . . 0.416 ' CZ2' ' HD2' ' A' ' 545' ' ' HIS . 70.6 t90 -58.58 -41.03 84.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.318 -0.856 . . . . 10.0 110.558 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -58.37 -43.54 88.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.622 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.84 -45.03 96.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.149 0.499 . . . . 10.0 110.019 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 544' ' ' ARG . . . . . 0.593 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 14.6 mtm180 -63.68 -38.96 93.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.547 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 545' ' ' HIS . . . . . 0.416 ' HD2' ' CZ2' ' A' ' 541' ' ' TRP . 6.3 t-80 -66.25 -39.41 89.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.094 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -66.24 -40.03 89.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.157 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -58.85 -43.44 90.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.876 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 548' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 544' ' ' ARG . 65.1 t -62.57 -35.89 72.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.79 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 549' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 545' ' ' HIS . 99.7 mt -64.33 -43.66 93.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.005 0.431 . . . . 10.0 110.225 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -71.14 -29.49 65.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.673 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 551' ' ' ALA . . . . . 0.44 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -70.02 -35.74 74.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.951 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 129.49 18.08 1.67 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.484 -0.865 . . . . 10.0 113.04 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 75.31 -169.94 54.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.828 -0.701 . . . . 10.0 112.55 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.433 ' HB3' ' OG ' ' A' ' 575' ' ' SER . 54.3 tp -75.5 126.08 30.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.928 0.394 . . . . 10.0 110.115 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -95.36 120.53 35.75 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.936 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 35.1 mm -98.04 128.3 49.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.596 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 557' ' ' ILE . . . . . 0.406 HG21 HG23 ' A' ' 438' ' ' ILE . 17.1 mt -119.34 125.75 74.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.384 . . . . 10.0 110.186 178.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -107.41 117.23 5.17 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.625 -0.798 . . . . 10.0 112.094 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 3.4 p -70.71 -48.12 56.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.539 0.685 . . . . 10.0 109.757 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.55 140.07 35.13 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.608 -1.178 . . . . 10.0 108.676 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 561' ' ' ARG . . . . . 0.512 ' HB2' HD22 ' A' ' 594' ' ' LEU . 77.8 mtt-85 -78.65 164.05 24.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.824 0.345 . . . . 10.0 110.18 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -86.98 153.26 21.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.198 -0.455 . . . . 10.0 109.839 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.89 -44.1 81.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.122 0.487 . . . . 10.0 110.026 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 58.7 m -99.53 142.23 31.28 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.488 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 565' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 565' ' ' ARG . 0.0 OUTLIER -68.84 -27.88 66.23 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.538 -179.555 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 566' ' ' ARG . . . . . 0.401 ' HD2' ' OD1' ' A' ' 212' ' ' ASP . 8.9 ttm180 -59.98 -51.22 70.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.107 0.479 . . . . 10.0 110.391 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 13.2 mt -72.59 -25.36 22.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.269 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -69.51 -50.62 43.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.069 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 17.1 m-20 -62.7 -37.67 87.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.03 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -58.86 -33.02 69.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.918 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.409 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 39.5 tp -78.49 -35.21 46.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.876 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -74.11 -30.43 62.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.898 0.38 . . . . 10.0 111.114 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.61 17.52 14.61 Favored Glycine 0 CA--C 1.521 0.426 0 C-N-CA 121.082 -0.58 . . . . 10.0 114.015 -178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 574' ' ' ARG . . . . . 0.409 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 1.2 mmt180 -72.17 -41.59 66.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 117.595 0.697 . . . . 10.0 110.557 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 575' ' ' SER . . . . . 0.433 ' OG ' ' HB3' ' A' ' 554' ' ' LEU . 19.4 t -87.61 161.27 17.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.475 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 73.43 36.32 55.01 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.147 -0.549 . . . . 10.0 112.794 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -61.61 130.44 45.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.442 0.163 . . . . 10.0 111.027 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 578' ' ' GLN . . . . . 0.609 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 17.5 tt0 64.03 19.7 11.87 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.635 0.584 . . . . 10.0 111.23 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 87.41 51.34 3.33 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.634 -0.793 . . . . 10.0 112.821 179.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -105.76 -168.83 1.5 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.847 -0.208 . . . . 10.0 110.484 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 581' ' ' ALA . . . . . 0.476 ' HA ' ' HB ' ' A' ' 419' ' ' ILE . . . -88.45 155.23 19.79 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.122 0.487 . . . . 10.0 111.72 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 173.72 177.47 42.95 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.734 -0.667 . . . . 10.0 111.612 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.9 p -153.87 134.43 13.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.823 0.312 . . . . 10.0 110.614 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.88 124.05 49.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.596 -0.274 . . . . 10.0 111.078 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 585' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 3.6 tpm_? -131.19 115.92 17.0 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.951 -0.389 . . . . 10.0 109.951 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -114.5 151.14 33.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.015 0.436 . . . . 10.0 111.285 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 587' ' ' TYR . . . . . 0.484 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 86.4 m-85 -132.54 169.25 16.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.378 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 10.8 tp -168.22 162.16 12.65 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.169 0.293 . . . . 10.0 110.24 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 589' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.8 OUTLIER -113.59 157.31 22.25 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.019 -0.363 . . . . 10.0 110.019 178.796 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 590' ' ' MET . . . . . 0.438 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 70.6 mmm -71.87 -14.21 61.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.162 0.506 . . . . 10.0 111.276 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -121.26 24.18 10.13 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.673 -0.694 . . . . 10.0 109.314 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 592' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 589' ' ' SER . 0.9 OUTLIER -74.14 169.04 18.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.194 -0.912 . . . . 10.0 111.373 -179.099 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -69.18 -34.46 74.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.615 ' O ' HG12 ' A' ' 597' ' ' ILE . 10.8 tp -69.87 -21.64 63.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.236 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 3.5 mmt -75.59 -5.86 47.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.097 0.475 . . . . 10.0 110.832 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -93.27 -11.08 33.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.461 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 594' ' ' LEU . 19.0 pt -74.53 -8.79 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 121.138 0.495 . . . . 10.0 110.539 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -79.19 -10.15 59.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.522 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 72.88 -53.86 0.7 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.923 0.764 . . . . 10.0 111.512 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 31.1 t -89.58 134.84 33.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.498 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -85.01 -4.3 59.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.151 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.66 -33.93 75.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.327 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 21.4 t -65.39 -50.81 70.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.216 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 604' ' ' SER . . . . . 0.497 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 0.2 OUTLIER -63.42 -38.96 93.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.848 179.946 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -68.5 -30.37 73.14 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.822 -0.704 . . . . 10.0 112.639 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 41.0 tpp -81.42 -38.35 26.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.712 0.291 . . . . 10.0 111.27 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 46.9 mtt -66.63 -16.85 64.49 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.545 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 608' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 604' ' ' SER . 33.6 mtt180 -68.45 -15.58 63.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.896 0.379 . . . . 10.0 110.936 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -87.04 23.44 1.77 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.277 -0.42 . . . . 10.0 111.2 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 49.0 tp -93.08 -14.58 27.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.076 0.465 . . . . 10.0 110.589 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 611' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 92.13 -48.88 2.71 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.992 -0.623 . . . . 10.0 111.919 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 612' ' ' MET . . . . . 0.438 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.0 OUTLIER 73.55 -55.01 0.68 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.647 0.779 . . . . 10.0 112.01 179.057 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 15.3 mmtp 59.35 80.74 0.26 Allowed Pre-proline 0 N--CA 1.464 0.273 0 O-C-N 123.475 0.484 . . . . 10.0 111.847 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 614' ' ' PRO . . . . . 0.53 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 21.4 Cg_endo -62.9 95.29 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.629 2.22 . . . . 10.0 112.103 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 140.16 -24.2 2.69 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.21 -0.904 . . . . 10.0 111.03 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -114.38 113.56 24.69 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.73 -0.47 . . . . 10.0 109.73 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -66.32 110.4 3.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.827 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 4.5 tp -67.99 -30.4 48.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.734 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 43.55 74.85 0.11 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.615 0.766 . . . . 10.0 112.643 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -120.44 99.53 47.88 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.66 -26.43 72.71 Favored 'Trans proline' 0 N--CA 1.475 0.403 0 C-N-CA 123.494 2.796 . . . . 10.0 114.584 -178.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 43.3 p-90 -63.06 -24.72 68.04 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.837 -0.345 . . . . 10.0 111.523 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 65.9 t -63.2 -45.83 97.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-O 120.996 0.427 . . . . 10.0 110.115 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 51.6 m -62.08 -36.18 80.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.484 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -67.85 -38.27 82.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.289 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -64.68 -45.71 85.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.836 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 98.6 mt -65.46 -37.57 80.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.136 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -57.92 -41.01 81.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.002 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -70.75 -38.94 73.52 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.895 -0.409 . . . . 10.0 109.895 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.41 89.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.343 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -63.12 -42.24 99.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.076 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -61.9 -32.45 72.83 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.159 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 633' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 637' ' ' ARG . 43.1 mttm -63.75 -37.54 87.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.425 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 40.0 t -61.83 -47.81 91.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.417 ' H ' ' HG2' ' A' ' 635' ' ' GLU . 0.8 OUTLIER -61.99 -40.84 97.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.721 179.254 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 28.3 m -61.56 -35.3 77.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.349 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 637' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 633' ' ' LYS . 72.4 mtt180 -67.22 -48.71 67.03 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -60.46 -42.49 96.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.512 -0.767 . . . . 10.0 110.445 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -56.21 -44.32 79.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.745 -0.662 . . . . 10.0 110.762 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.6 -42.67 99.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.298 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 71.3 mt -58.77 -53.41 47.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.231 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 642' ' ' ARG . . . . . 0.471 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 0.0 OUTLIER -69.02 -27.92 66.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.643 0.259 . . . . 10.0 110.711 -179.792 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -66.78 -38.4 86.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.259 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -68.07 -32.01 72.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.033 0.444 . . . . 10.0 110.141 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 95.5 mt -71.53 -26.29 62.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.384 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 646' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 89.2 mt -62.69 -32.85 74.01 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.383 179.473 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -64.48 -13.53 52.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.855 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -107.3 -46.22 3.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.115 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -73.3 -29.28 62.6 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 -177.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -64.87 -34.78 79.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.038 0.447 . . . . 10.0 109.835 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 651' ' ' VAL . . . . . 0.402 HG21 ' HG2' ' A' ' 804' ' ' LYS . 16.7 t -65.02 -43.07 96.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.738 -0.665 . . . . 10.0 109.917 179.095 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -64.06 -39.8 94.88 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.025 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -61.15 -43.57 98.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.174 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -61.32 -51.44 68.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.418 -0.81 . . . . 10.0 110.968 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -61.92 -42.89 99.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.797 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 656' ' ' ARG . . . . . 0.417 HH22 HD21 ' A' ' 383' ' ' LEU . 2.6 ttp-105 -62.5 -36.12 81.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.325 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -63.9 -48.3 77.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.632 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.53 -50.22 68.19 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.851 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 659' ' ' ILE . . . . . 0.418 HG23 ' HD1' ' A' ' 660' ' ' TYR . 9.1 tp -66.48 -35.99 76.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 111.901 0.334 . . . . 10.0 111.901 -178.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 660' ' ' TYR . . . . . 0.418 ' HD1' HG23 ' A' ' 659' ' ' ILE . 2.9 m-30 -70.6 -35.62 73.09 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 9.9 t -62.23 -50.66 70.87 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -57.3 -43.59 83.34 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.431 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 38.7 ttt-85 -63.05 -41.84 99.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.613 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -65.82 -43.11 89.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.606 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 665' ' ' GLU . . . . . 0.403 ' O ' HG22 ' A' ' 669' ' ' VAL . 28.1 mt-10 -58.45 -50.1 74.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.245 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 26.8 mt -70.02 -16.12 63.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.171 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.406 ' O ' ' HD3' ' A' ' 195' ' ' PRO . 12.1 tp -83.8 -46.04 12.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.662 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -68.73 -41.98 78.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.855 -0.611 . . . . 10.0 112.161 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 665' ' ' GLU . 27.0 m -74.86 150.93 6.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.038 0.447 . . . . 10.0 111.191 -179.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 1.5 m -94.29 -42.21 9.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.451 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -84.32 126.26 33.03 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.564 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 672' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 676' ' ' ILE . 5.6 p -127.49 -0.68 3.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.004 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 673' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 677' ' ' ASN . 0.8 OUTLIER -52.65 -45.51 66.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.348 -0.842 . . . . 10.0 112.364 -178.66 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -62.34 -46.25 89.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.591 0.234 . . . . 10.0 111.586 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 675' ' ' THR . . . . . 0.466 ' O ' HG12 ' A' ' 679' ' ' ILE . 3.9 m -63.57 -46.84 84.05 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.767 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 676' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 672' ' ' VAL . 36.4 mm -65.27 -37.96 81.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.99 0.424 . . . . 10.0 110.856 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 677' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 673' ' ' SER . 5.5 t30 -68.53 -40.23 80.83 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.58 -0.282 . . . . 10.0 111.316 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 29.0 m -62.77 -42.27 99.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.748 0.308 . . . . 10.0 111.142 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 679' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 675' ' ' THR . 27.1 pt -77.44 -21.04 14.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.677 -0.409 . . . . 10.0 110.844 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 680' ' ' ARG . . . . . 0.562 ' HG3' HD12 ' A' ' 823' ' ' ILE . 10.7 mtm-85 -59.53 -46.37 89.05 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.04 0.448 . . . . 10.0 110.144 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -65.81 -44.59 85.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.565 -0.743 . . . . 10.0 110.931 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -62.62 -47.4 83.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.245 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 41.2 t -61.18 -44.95 99.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.767 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -62.74 -42.36 99.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.655 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 54.8 tttm -63.25 -48.32 78.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.559 -0.292 . . . . 10.0 110.325 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.85 -40.6 84.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.209 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 30.0 m -64.72 -43.33 93.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.195 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.68 -39.92 84.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.353 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -61.85 -18.17 59.1 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.254 -0.43 . . . . 10.0 112.143 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -79.26 -14.2 59.18 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.852 0.358 . . . . 10.0 111.495 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -127.14 -24.54 3.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.958 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 692' ' ' ILE . . . . . 0.549 HG23 ' CD1' ' A' ' 701' ' ' TRP . 69.4 mt -129.72 101.03 18.81 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.579 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 693' ' ' PRO . . . . . 0.409 ' HA ' ' HD3' ' A' ' 694' ' ' PRO . 23.4 Cg_exo -64.12 140.39 71.45 Favored 'Trans proline' 0 N--CA 1.464 -0.233 0 C-N-CA 122.518 2.145 . . . . 10.0 111.494 179.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 694' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 693' ' ' PRO . 59.3 Cg_exo -52.28 113.8 1.37 Allowed 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.897 2.398 . . . . 10.0 112.823 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 56.71 67.77 0.95 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.391 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 6.0 p -118.9 -172.32 2.27 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.914 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 35.9 mt -83.5 154.89 23.64 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.769 -0.456 . . . . 10.0 109.769 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -57.71 -34.32 69.34 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 120.937 0.399 . . . . 10.0 111.69 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -74.34 -6.3 47.29 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.288 -0.414 . . . . 10.0 111.882 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.22 8.75 40.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.839 0.352 . . . . 10.0 110.234 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 701' ' ' TRP . . . . . 0.549 ' CD1' HG23 ' A' ' 692' ' ' ILE . 48.4 m0 -101.43 108.13 19.64 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.966 -179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -83.72 82.78 8.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.364 0.602 . . . . 10.0 109.414 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 703' ' ' ILE . . . . . 0.511 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 43.0 mm -60.86 -50.22 85.95 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.201 -0.909 . . . . 10.0 111.956 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 704' ' ' PRO . . . . . 0.511 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 47.7 Cg_exo -56.27 -47.45 24.28 Favored 'Trans proline' 0 C--N 1.36 1.138 0 C-N-CA 122.052 1.834 . . . . 10.0 112.561 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -60.67 -40.67 98.3 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.448 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 61.1 tp -70.47 -45.89 64.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.389 0.138 . . . . 10.0 111.006 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -59.19 -51.23 70.87 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.357 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -59.71 -35.72 75.08 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.826 0.346 . . . . 10.0 110.771 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 709' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 709' ' ' ARG . 2.3 tpt180 -65.5 -45.92 81.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.277 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 79.5 mt -64.87 -38.19 90.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.135 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.88 -36.22 72.69 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.695 0.628 . . . . 10.0 112.695 -179.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -92.68 -44.48 8.54 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -177.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 713' ' ' ASP . . . . . 0.675 ' O ' ' HE3' ' A' ' 828' ' ' LYS . 0.8 OUTLIER -89.27 -31.51 17.83 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 -177.547 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -106.15 -4.22 20.55 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.057 -0.657 . . . . 10.0 112.079 -178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 25.6 t70 57.67 28.72 16.19 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.326 0.584 . . . . 10.0 110.526 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 43.8 tp -118.96 129.79 55.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.09 -0.505 . . . . 10.0 111.662 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -97.68 128.13 44.14 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.492 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.435 HD21 ' HG2' ' A' ' 742' ' ' GLN . 11.8 mt -140.0 122.11 9.87 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 120.782 0.325 . . . . 10.0 111.695 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -81.81 60.86 7.72 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.859 2.373 . . . . 10.0 111.675 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 52.8 mt -63.48 -42.63 96.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.383 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -67.04 -31.67 72.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.207 0.527 . . . . 10.0 110.474 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -88.7 6.86 36.55 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.905 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -106.11 -54.1 2.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.857 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 77.8 mt -63.68 -23.45 67.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.756 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 725' ' ' ASP . . . . . 0.477 ' OD1' ' HG3' ' A' ' 726' ' ' LYS . 0.0 OUTLIER -78.59 -11.79 59.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.942 -179.76 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 726' ' ' LYS . . . . . 0.477 ' HG3' ' OD1' ' A' ' 725' ' ' ASP . 50.6 mttp -111.71 -48.63 3.05 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.01 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -120.64 94.71 48.93 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.26 0.553 . . . . 10.0 110.817 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.27 -3.62 14.11 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.456 2.104 . . . . 10.0 111.851 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.44 -12.31 61.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.012 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 730' ' ' LEU . . . . . 0.508 HD21 ' NH1' ' A' ' 738' ' ' ARG . 32.2 mt -66.48 -34.69 78.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.154 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 53.42 -104.09 0.19 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.142 -0.936 . . . . 10.0 111.318 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.16 -56.34 0.86 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.05 -179.104 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -58.0 -54.41 47.25 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.513 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.28 -31.27 71.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.114 0.483 . . . . 10.0 110.539 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 39.9 tp -65.69 -46.76 77.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.802 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 22.8 mtt180 -63.49 -36.33 83.4 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.966 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -60.37 -45.2 94.34 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.404 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 738' ' ' ARG . . . . . 0.508 ' NH1' HD21 ' A' ' 730' ' ' LEU . 16.7 mmm-85 -63.35 -41.71 98.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.513 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 90.7 mt -62.53 -51.84 67.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.694 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 740' ' ' LEU . . . . . 0.42 ' O ' HG13 ' A' ' 744' ' ' ILE . 36.4 tp -62.08 -44.37 96.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.418 -179.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -61.01 -41.23 96.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.745 0.307 . . . . 10.0 111.407 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 742' ' ' GLN . . . . . 0.435 ' HG2' HD21 ' A' ' 718' ' ' LEU . 23.8 tp60 -60.59 -42.98 97.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.187 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -39.82 95.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.965 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 744' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 740' ' ' LEU . 75.3 mt -62.45 -44.01 98.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.765 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -46.5 87.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.24 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 88.3 t -65.53 -40.2 87.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.126 0.488 . . . . 10.0 110.155 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -59.69 -43.39 94.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.78 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 748' ' ' GLN . . . . . 0.494 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 90.1 mt-30 -59.1 -44.2 91.94 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.02 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.45 -39.94 89.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.475 -0.329 . . . . 10.0 110.77 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -68.36 -34.92 76.93 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.975 0.417 . . . . 10.0 109.879 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -72.42 -39.38 67.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.07 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 752' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 45.9 mt-10 -53.39 -39.83 64.56 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.433 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 13.3 t -75.17 -30.93 23.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.315 -0.402 . . . . 10.0 112.003 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 50.5 t -85.42 -46.52 17.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.245 0.545 . . . . 10.0 111.098 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.03 132.11 3.94 Favored Glycine 0 N--CA 1.441 -0.995 0 N-CA-C 110.404 -1.078 . . . . 10.0 110.404 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 756' ' ' ALA . . . . . 0.617 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -56.84 -51.81 67.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 117.001 0.4 . . . . 10.0 111.646 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 757' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' A' ' 757' ' ' GLU . 11.2 mp0 -59.15 -39.27 81.89 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.076 -0.511 . . . . 10.0 111.132 -179.061 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 16.1 tpt -73.56 -38.68 65.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.725 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 7.8 tpt -60.59 -36.49 78.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.794 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.617 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -61.81 -37.54 84.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.33 0.586 . . . . 10.0 109.491 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -71.07 -34.48 71.22 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.527 -0.761 . . . . 10.0 109.414 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -68.1 -51.61 44.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.272 -0.876 . . . . 10.0 110.304 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -56.84 -44.48 82.14 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.933 0.397 . . . . 10.0 110.145 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 43.6 tttp -60.44 -50.41 73.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.343 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.27 -42.23 99.72 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.494 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 766' ' ' VAL . . . . . 0.405 ' HA ' ' HG2' ' A' ' 769' ' ' GLN . 44.7 t -62.49 -49.19 84.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.424 0.154 . . . . 10.0 110.588 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 18.7 ttt -59.56 -43.3 93.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.657 0.265 . . . . 10.0 110.877 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 84.4 mt -64.28 -51.78 61.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.604 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 769' ' ' GLN . . . . . 0.418 ' HG3' ' N ' ' A' ' 770' ' ' THR . 13.9 pt20 -63.43 -37.29 86.71 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.796 0.295 . . . . 10.0 111.796 -178.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 770' ' ' THR . . . . . 0.418 ' N ' ' HG3' ' A' ' 769' ' ' GLN . 12.6 m -68.39 -34.84 76.76 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.665 -0.495 . . . . 10.0 109.665 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.8 tt -62.14 -50.05 73.4 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.84 -34.05 75.27 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.034 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 773' ' ' SER . . . . . 0.821 ' HB3' ' HB1' ' B' ' 19' ' ' ALA . 72.7 m -61.63 -52.87 62.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.467 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 16.9 mt -78.02 -22.74 48.8 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.887 -0.325 . . . . 10.0 111.675 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 31.1 t-105 -63.94 -50.37 68.9 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.952 -0.299 . . . . 10.0 110.821 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.417 ' NZ ' ' HA ' ' A' ' 773' ' ' SER . 10.9 ptpp? -62.25 -35.25 78.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.919 0.39 . . . . 10.0 110.434 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -67.28 -41.66 85.11 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 73.5 t60 -61.74 -38.16 86.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.002 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 63.6 mt -66.0 -49.02 69.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.117 179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -61.52 -45.25 95.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.543 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.32 94.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.997 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 37.9 ttm -64.39 -42.86 95.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.766 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 783' ' ' ASP . . . . . 0.466 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 38.5 t70 -64.88 -41.13 95.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.209 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -62.97 -35.35 79.86 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.681 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 13.7 tp -78.37 -35.45 47.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.809 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -59.07 -38.04 78.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.597 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 787' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 0.9 OUTLIER -78.97 -1.15 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.998 -0.281 . . . . 10.0 111.157 179.849 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -127.14 21.39 5.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.761 -0.733 . . . . 10.0 112.066 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 9.0 tp -64.2 -27.99 43.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 111.739 0.274 . . . . 10.0 111.739 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 22.2 m80 -68.72 -11.18 59.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.716 0.293 . . . . 10.0 111.335 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 3.3 tp -101.78 -1.06 33.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.483 . . . . 10.0 110.156 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -113.99 -47.98 2.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.762 -0.653 . . . . 10.0 109.97 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -90.28 67.04 2.62 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.96 -0.638 . . . . 10.0 111.552 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 794' ' ' TYR . . . . . 0.417 ' HB2' ' H ' ' A' ' 795' ' ' ALA . 0.4 OUTLIER -81.44 -157.09 0.16 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.683 0.278 . . . . 10.0 110.792 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 795' ' ' ALA . . . . . 0.417 ' H ' ' HB2' ' A' ' 794' ' ' TYR . . . -62.0 150.4 38.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.7 0.286 . . . . 10.0 111.219 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 67.81 18.38 9.69 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.688 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 50.6 mttm -142.68 164.31 30.46 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.824 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -111.11 126.75 28.07 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 109.59 -0.522 . . . . 10.0 109.59 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.77 -24.37 71.17 Favored 'Trans proline' 0 CA--C 1.529 0.231 0 C-N-CA 122.902 2.401 . . . . 10.0 113.535 -178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 800' ' ' LYS . . . . . 0.45 ' HB2' ' NZ ' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -91.0 -48.42 6.99 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.89 -0.324 . . . . 10.0 110.65 -179.674 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 -63.55 -38.88 92.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.219 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -65.11 -40.23 94.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.065 0.46 . . . . 10.0 109.922 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -60.56 -42.52 96.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.06 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 804' ' ' LYS . . . . . 0.402 ' HG2' HG21 ' A' ' 651' ' ' VAL . 88.0 mttt -65.98 -39.72 90.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.571 -0.74 . . . . 10.0 110.601 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 805' ' ' ARG . . . . . 0.42 HH11 ' HG2' ' A' ' 805' ' ' ARG . 41.3 ttp85 -61.34 -45.31 94.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.015 0.436 . . . . 10.0 110.431 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -65.66 -46.97 77.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.279 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 3.5 p -64.59 -37.54 87.92 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.608 -0.269 . . . . 10.0 111.652 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -64.74 -45.79 84.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.757 0.313 . . . . 10.0 110.2 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 13.2 m -64.82 -42.29 95.09 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.01 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 38.5 ttm -60.84 -37.29 81.56 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.866 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -70.23 -41.45 73.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.442 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.21 -50.05 74.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.669 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.41 -33.83 75.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.387 179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 11.6 ttt -63.82 -47.83 79.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.515 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 91.2 mt -62.46 -41.45 98.76 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.929 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -63.09 -44.25 96.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.848 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 12.1 m -73.46 -29.82 62.78 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.896 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 55.0 tp -62.56 -56.79 14.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.976 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 819' ' ' LYS . . . . . 0.406 ' O ' HG12 ' A' ' 823' ' ' ILE . 43.5 pttt -62.24 -28.87 70.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.674 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -62.35 -67.05 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.32 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 821' ' ' GLU . . . . . 0.528 ' HA ' ' OG ' ' A' ' 824' ' ' SER . 1.3 mm-40 -61.43 -28.61 69.39 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 -178.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 5.6 t -60.23 -41.05 85.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 178.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 823' ' ' ILE . . . . . 0.562 HD12 ' HG3' ' A' ' 680' ' ' ARG . 22.4 mm -76.56 -46.49 31.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.251 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 824' ' ' SER . . . . . 0.528 ' OG ' ' HA ' ' A' ' 821' ' ' GLU . 0.1 OUTLIER -63.47 -42.25 98.59 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 121.029 -0.268 . . . . 10.0 111.372 -179.42 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 97.5 m -59.42 -39.56 83.9 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.7 0.286 . . . . 10.0 111.194 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 76.3 mt -67.73 -17.97 64.74 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.099 0.476 . . . . 10.0 110.612 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 3.9 m -100.77 -29.52 12.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.157 179.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 828' ' ' LYS . . . . . 0.675 ' HE3' ' O ' ' A' ' 713' ' ' ASP . 77.7 mttt -70.1 -16.22 63.09 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.276 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.2 p -59.75 131.45 24.35 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.334 0.587 . . . . 10.0 111.055 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -97.88 96.9 8.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.823 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 40.4 t -105.31 143.47 16.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.636 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -52.09 120.12 5.08 Favored 'General case' 0 C--N 1.332 -0.177 0 O-C-N 123.677 0.611 . . . . 10.0 110.472 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 33.7 mmt -94.18 126.53 48.24 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.404 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -85.45 -178.94 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.143 2.562 . . . . 10.0 111.563 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -86.52 148.57 25.46 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.781 0.324 . . . . 10.0 110.616 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.911 -0.566 . . . . 10.0 109.727 179.268 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.5 tpt . . . . . 0 N--CA 1.481 1.085 0 CA-C-O 121.076 0.465 . . . . 10.0 110.91 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 16.5 tpt -124.41 136.13 53.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.761 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 19.6 pt -93.2 147.55 5.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.202 -0.453 . . . . 10.0 111.297 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.19 -7.79 57.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.613 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 87.3 mt -83.45 72.03 10.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.082 0.468 . . . . 10.0 110.394 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -130.78 42.63 3.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.766 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -76.53 104.41 7.03 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.888 0.375 . . . . 10.0 110.56 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.505 ' NE ' ' HA ' ' B' ' 8' ' ' ARG . 4.5 mmp_? -127.7 15.28 6.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.951 0.405 . . . . 10.0 111.249 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -109.77 130.66 55.5 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 7.4 mtpp -66.09 140.27 58.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.494 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 31.2 mt -117.71 98.9 52.1 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -88.38 30.08 0.44 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.984 2.456 . . . . 10.0 111.296 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 20.8 tp -59.98 -33.42 71.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.388 -178.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.24 -55.48 27.73 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 19.1 m -75.27 -28.8 20.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.774 0.321 . . . . 10.0 111.13 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.25 87.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.493 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 79.9 t -72.81 -41.11 61.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.693 0.282 . . . . 10.0 110.968 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.73 88.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.32 0.581 . . . . 10.0 110.537 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.821 ' HB1' ' HB3' ' A' ' 773' ' ' SER . . . -79.76 -30.37 40.73 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.08 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -78.06 12.06 19.79 Favored Glycine 0 CA--C 1.52 0.356 0 CA-C-N 115.853 -0.612 . . . . 10.0 113.951 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.657 HG22 ' HA ' ' A' ' 230' ' ' GLU . 10.5 t -59.3 -26.65 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 121.621 0.724 . . . . 10.0 110.808 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 18.4 tpt -153.83 90.15 1.36 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.032 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -147.78 -166.92 2.66 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.384 -0.825 . . . . 10.0 109.076 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -88.61 134.93 33.74 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.957 -0.386 . . . . 10.0 109.957 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -85.49 2.28 45.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.079 0.466 . . . . 10.0 110.645 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.54 104.47 16.85 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.362 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 52.1 tpp -144.18 147.55 33.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.992 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.575 -0.726 . . . . 10.0 110.164 179.631 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.455 HG23 ' OE2' ' A' ' 96' ' ' GLU . 92.8 t . . . . . 0 N--CA 1.479 0.984 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -78.23 132.48 37.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.173 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.99 173.33 12.95 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.886 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.31 129.28 40.47 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.138 -0.319 . . . . 10.0 110.138 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.3 mmt180 -61.85 139.52 58.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.897 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 29.9 m-20 72.35 -19.16 0.3 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.057 0.943 . . . . 10.0 112.046 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -102.9 -64.85 1.04 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.825 0.345 . . . . 10.0 111.586 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -70.07 -27.73 64.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.441 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.7 p -55.67 -62.44 1.69 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.765 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.8 mt -62.69 -36.59 83.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.523 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.0 ttp-105 -63.87 -48.84 75.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.576 -0.283 . . . . 10.0 110.914 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.416 ' O ' HG23 ' A' ' 24' ' ' VAL . 26.2 mtp180 -65.85 -38.12 88.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.922 0.391 . . . . 10.0 110.042 179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.406 ' O ' HG23 ' A' ' 25' ' ' VAL . 41.8 mtt -62.29 -41.64 98.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.431 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HD3' ' O ' ' A' ' 22' ' ' ARG . 15.5 tpp180 -61.75 -36.52 81.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.308 -0.406 . . . . 10.0 109.91 179.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -63.76 -37.64 88.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.205 -0.452 . . . . 10.0 109.899 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 20' ' ' ARG . 44.5 t -72.79 -37.35 54.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.849 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.507 HG13 HD12 ' A' ' 88' ' ' LEU . 36.3 t -57.84 -36.13 54.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.663 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -59.9 -40.27 88.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.182 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.1 mt -66.04 -41.88 90.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.912 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.97 -37.61 78.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.414 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -66.56 -25.21 66.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.018 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -93.17 -17.58 23.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.983 0.421 . . . . 10.0 111.073 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 18.3 mtt -88.02 -25.51 23.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.022 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.491 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 20.2 tt0 -56.78 -49.7 92.27 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 116.166 -0.47 . . . . 10.0 112.01 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 51.2 Cg_exo -55.53 -28.96 67.28 Favored 'Trans proline' 0 C--N 1.363 1.323 0 C-N-CA 122.138 1.892 . . . . 10.0 112.474 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.66 -40.78 66.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.995 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 23.6 mmt -67.59 -29.86 69.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.483 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 23.0 mt-10 -62.89 -32.15 73.35 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.224 0.535 . . . . 10.0 110.251 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -78.13 -24.8 47.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.112 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.9 mp -72.86 142.28 47.95 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.251 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 p -75.56 172.02 13.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.712 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -58.35 -43.71 88.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.101 0.477 . . . . 10.0 110.689 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -67.93 -34.54 76.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.245 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.94 -36.05 82.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.547 -0.297 . . . . 10.0 110.822 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.4 mt -61.55 -46.62 89.15 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.04 -0.726 . . . . 10.0 109.04 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -65.69 -35.7 81.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.289 -0.869 . . . . 10.0 109.643 178.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.76 -36.7 92.32 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.622 -0.717 . . . . 10.0 111.311 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -67.18 -39.29 86.39 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.491 -0.559 . . . . 10.0 109.491 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.7 m -60.73 -45.97 92.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.738 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.48 -35.16 79.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.803 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -62.22 -42.43 99.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.311 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -59.64 -40.21 86.89 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.3 -0.409 . . . . 10.0 109.982 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.7 tpp180 -62.68 -43.31 99.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.767 -0.652 . . . . 10.0 109.955 179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.536 ' O ' ' HG2' ' A' ' 56' ' ' LYS . . . -67.84 -42.09 81.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.633 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 55.8 mtp180 -61.57 -40.0 93.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.74 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 33.2 mt -62.92 -34.17 76.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.168 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.59 -34.87 76.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.158 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 56.0 mmtt -76.9 -43.88 33.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.077 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 145.77 78.3 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.725 -0.75 . . . . 10.0 112.335 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -130.62 144.94 51.77 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.647 -0.501 . . . . 10.0 109.647 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.5 t -85.75 131.52 34.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.441 HD11 ' O ' ' A' ' 118' ' ' LEU . 15.5 tp -56.17 -42.38 76.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.036 0.446 . . . . 10.0 111.038 -179.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -66.75 -16.22 64.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.537 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -88.4 -14.88 36.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.042 0.448 . . . . 10.0 110.536 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.4 mt -87.49 -9.93 53.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.4 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.522 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 76.4 mt -47.3 -53.29 29.75 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 113.399 0.888 . . . . 10.0 113.399 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.522 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 52.1 Cg_exo -54.37 -56.82 2.18 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.905 1.737 . . . . 10.0 113.199 -179.182 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -65.06 -43.41 92.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.89 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.72 80.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.569 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -65.25 -34.0 77.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.851 -179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.04 -44.66 83.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.451 -0.341 . . . . 10.0 110.562 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.7 t -62.54 -48.6 87.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.436 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 71.4 t -61.9 -39.74 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.502 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.477 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 5.4 ttt180 -58.46 -46.13 87.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.454 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -68.9 -42.77 76.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.628 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.34 -36.79 76.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.489 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.9 m -63.19 -34.06 76.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.708 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.405 ' O ' ' HA2' ' A' ' 80' ' ' GLY . 11.2 mtmm -70.47 -30.5 67.33 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.732 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -89.47 -38.8 13.79 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 48.9 t -81.47 -64.54 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.793 0.33 . . . . 10.0 111.632 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -82.07 -33.28 29.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.739 0.304 . . . . 10.0 111.816 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.405 ' HA2' ' O ' ' A' ' 76' ' ' LYS . . . 91.89 13.73 57.45 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.582 -0.818 . . . . 10.0 111.392 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 59.0 ttm -125.02 127.5 47.08 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.697 0.284 . . . . 10.0 110.267 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -78.63 131.73 36.8 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.241 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.91 117.38 4.97 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 179.351 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -58.82 154.89 14.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.194 0.521 . . . . 10.0 112.005 -178.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -43.05 94.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.285 -0.87 . . . . 10.0 111.275 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 m -65.77 -29.02 45.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.143 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -67.22 -34.16 76.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.076 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.507 HD12 HG13 ' A' ' 25' ' ' VAL . 68.2 mt -64.15 -37.13 86.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.705 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 53.2 mt -65.31 -49.99 67.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.732 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.94 -36.71 93.24 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.49 -0.777 . . . . 10.0 112.325 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.64 -33.46 86.72 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.134 -0.555 . . . . 10.0 112.308 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.485 ' HG3' ' O ' ' A' ' 88' ' ' LEU . 56.1 mtt -74.07 -36.72 64.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.967 0.413 . . . . 10.0 110.146 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 95.9 t -64.35 -35.57 74.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.34 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 94.2 mt -77.39 -0.8 27.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.643 -0.708 . . . . 10.0 112.195 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -83.84 -32.27 25.35 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.267 0.556 . . . . 10.0 109.924 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.455 ' OE2' HG23 ' A' ' 9' ' ' VAL . 56.3 mt-10 -98.22 -178.93 4.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.274 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.46 ' HG2' HD23 ' A' ' 407' ' ' LEU . 21.9 ttt85 -80.5 71.73 7.36 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.469 ' SG ' ' HB3' ' A' ' 408' ' ' ASP . 14.6 m -141.32 162.93 34.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.432 -178.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.685 HD12 HG11 ' A' ' 211' ' ' VAL . 36.3 mm -110.36 127.27 67.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.468 -0.787 . . . . 10.0 108.988 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -101.25 105.66 16.78 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.886 0.374 . . . . 10.0 111.5 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.418 ' HB3' HG23 ' A' ' 393' ' ' THR . 11.1 mt-10 -76.99 107.03 9.04 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.413 -0.588 . . . . 10.0 109.413 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 55.6 mtt -104.11 -177.44 3.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.059 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -116.55 141.37 48.28 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.847 0.356 . . . . 10.0 111.088 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.21 106.74 2.11 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.204 179.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 138.93 -41.82 1.31 Allowed Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.803 -0.713 . . . . 10.0 111.963 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.04 -73.04 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.845 0.355 . . . . 10.0 110.554 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 159.52 126.77 0.87 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.593 -0.813 . . . . 10.0 112.445 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -109.04 -60.68 1.72 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.906 0.384 . . . . 10.0 110.177 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -31.85 72.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.847 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.1 mp -72.75 -14.77 61.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.58 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 20.4 m -100.32 -30.59 11.78 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.266 0.555 . . . . 10.0 110.618 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.439 ' HB1' HD21 ' A' ' 207' ' ' LEU . . . -66.03 -9.81 34.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.415 -0.812 . . . . 10.0 112.504 -179.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.412 HG22 ' CZ ' ' A' ' 147' ' ' PHE . 0.6 OUTLIER -71.92 -22.91 61.41 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.722 0.267 . . . . 10.0 111.722 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.414 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 54.9 mt -72.58 -56.79 3.68 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.214 0.45 . . . . 10.0 112.214 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 35.5 Cg_endo -63.12 -31.13 75.64 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 122.15 1.9 . . . . 10.0 112.327 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.72 -45.92 77.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.51 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.427 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 62.9 t80 -63.06 -45.74 90.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.598 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.441 ' O ' HD11 ' A' ' 60' ' ' LEU . 44.7 tp -60.39 -51.79 67.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.944 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -71.38 -14.94 62.33 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.862 0.319 . . . . 10.0 111.862 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -81.77 -22.85 36.97 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.685 0.279 . . . . 10.0 110.411 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.6 mt -61.9 -31.17 71.45 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.866 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.38 -19.36 61.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.239 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 73.33 9.19 76.95 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.193 -0.527 . . . . 10.0 113.117 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -76.33 -18.33 58.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.733 0.301 . . . . 10.0 110.867 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 103.16 127.97 6.24 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.637 -0.792 . . . . 10.0 113.243 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.1 t -105.84 118.74 53.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 178.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 39.5 m170 -101.09 101.74 12.55 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.853 0.359 . . . . 10.0 111.043 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 38.3 t -92.19 116.53 33.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.767 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.507 ' HB ' HG12 ' A' ' 208' ' ' VAL . 84.0 t -105.27 114.78 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.917 -178.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -101.71 164.12 11.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.634 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.7 m -69.52 -26.95 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -148.32 175.18 11.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.718 0.294 . . . . 10.0 110.705 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -78.35 -25.44 46.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.68 -179.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.21 -56.13 26.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.724 0.297 . . . . 10.0 110.717 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.8 mt -65.78 -38.22 88.44 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.917 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.64 -51.62 69.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.798 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -70.47 -31.48 68.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.039 0.447 . . . . 10.0 110.693 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 138' ' ' ARG . 1.7 ttp180 -63.08 -57.51 10.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.806 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.23 -32.65 73.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.888 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.502 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -59.38 -39.4 83.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.903 0.382 . . . . 10.0 111.042 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -90.4 -28.5 18.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.209 -0.45 . . . . 10.0 111.391 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -73.17 -43.95 60.71 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.537 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -89.2 -1.36 58.05 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.865 0.364 . . . . 10.0 111.15 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 58.4 ttm-85 -61.62 -49.23 87.63 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' PRO . . . . . 0.465 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 18.3 Cg_exo -66.93 -1.26 5.77 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 122.163 1.909 . . . . 10.0 112.621 -179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.8 tp -101.93 -52.33 3.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.202 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' PHE . . . . . 0.412 ' CZ ' HG22 ' A' ' 113' ' ' THR . 24.3 m-85 -69.47 -45.49 68.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.165 -0.471 . . . . 10.0 111.586 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -70.1 -15.35 62.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.111 0.481 . . . . 10.0 110.941 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -73.78 -27.39 61.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.344 178.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 66.8 mt -98.93 -11.03 22.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.384 -0.825 . . . . 10.0 110.823 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 115.19 -5.64 21.71 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.293 -0.956 . . . . 10.0 114.149 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 82.7 mt -82.29 131.19 35.23 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.339 0.57 . . . . 10.0 110.639 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 11.0 p -86.3 134.42 33.75 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.217 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' VAL . . . . . 0.404 HG21 ' HA ' ' A' ' 144' ' ' ARG . 40.4 t -106.83 127.34 62.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.409 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -123.22 134.89 9.67 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.764 -0.731 . . . . 10.0 111.969 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 5.4 tp -108.91 130.57 61.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.898 0.38 . . . . 10.0 110.305 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -111.89 102.3 10.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.111 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' A' ' 161' ' ' MET . 97.0 mt -90.9 141.99 27.16 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.451 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 159' ' ' PRO . . . . . 0.423 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 32.2 Cg_exo -59.12 112.0 1.08 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.85 2.366 . . . . 10.0 112.41 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 100.12 18.68 21.32 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.995 -0.621 . . . . 10.0 112.447 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' MET . . . . . 0.52 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 8.2 ttp -82.07 140.13 46.14 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 109.881 -0.415 . . . . 10.0 109.881 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.88 153.17 32.4 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.509 2.139 . . . . 10.0 112.832 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' ALA . . . . . 0.472 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -54.2 -49.0 92.67 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.939 0.718 . . . . 10.0 112.939 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.472 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 50.5 Cg_exo -55.67 -36.35 94.68 Favored 'Trans proline' 0 C--N 1.36 1.158 0 C-N-CA 121.824 1.683 . . . . 10.0 112.155 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -70.63 -43.1 69.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.41 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.52 ' HE2' ' O ' ' A' ' 161' ' ' MET . 62.5 mttm -61.34 -46.26 90.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.568 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -57.87 -39.34 77.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.059 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -68.91 -37.31 78.87 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.839 0.352 . . . . 10.0 111.204 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -74.09 -39.19 63.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.454 -179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -75.8 -25.06 56.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.442 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.84 -5.97 54.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.872 0.368 . . . . 10.0 110.591 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -78.78 175.7 10.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.127 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -74.12 -44.42 53.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.821 0.344 . . . . 10.0 110.537 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 70.4 mt -126.69 123.87 63.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.931 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.2 m -112.92 128.12 56.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.998 0.428 . . . . 10.0 111.448 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -104.24 135.24 46.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.752 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.19 173.34 44.19 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.304 -0.951 . . . . 10.0 112.826 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.1 m -92.35 151.81 20.08 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.151 0.18 . . . . 10.0 110.538 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -56.85 -43.44 81.17 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -59.08 -51.94 67.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.687 0.28 . . . . 10.0 111.532 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.423 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 4.0 tp10 -66.14 -37.4 85.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.986 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -59.67 -39.78 85.61 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.88 0.372 . . . . 10.0 110.913 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -74.97 -41.8 31.7 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.738 -0.744 . . . . 10.0 111.548 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -62.95 -36.76 84.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.033 0.445 . . . . 10.0 110.389 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 185' ' ' ASP . . . . . 0.41 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 11.3 m-20 -60.35 -44.57 95.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.012 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -62.83 -38.14 89.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.339 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 187' ' ' LEU . . . . . 0.403 HD11 HG22 ' A' ' 375' ' ' ILE . 74.8 mt -63.03 -48.16 79.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.776 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 40.9 mtm-85 -67.55 -37.76 83.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.799 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -61.62 -50.36 72.87 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.514 -0.766 . . . . 10.0 111.498 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.01 1.18 28.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.754 -0.657 . . . . 10.0 112.463 -178.195 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 22.5 ttp -108.47 11.01 27.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.113 0.482 . . . . 10.0 110.566 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -79.31 170.67 16.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.869 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -106.34 -30.32 9.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.952 0.406 . . . . 10.0 110.451 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.32 139.65 24.11 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.87 -24.31 78.9 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.831 2.354 . . . . 10.0 113.202 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -76.96 -16.02 59.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.68 0.276 . . . . 10.0 111.125 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -76.88 -9.95 59.04 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.345 -0.389 . . . . 10.0 110.646 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -54.87 155.54 4.31 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.787 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 11.4 m -133.26 -15.4 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.784 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -87.32 -175.2 5.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.305 0.574 . . . . 10.0 111.691 -179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -145.12 -171.23 3.61 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.36 -0.837 . . . . 10.0 108.861 179.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 24.5 tttm -65.44 131.54 46.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.008 0.432 . . . . 10.0 110.637 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 19.9 mt -83.85 60.7 5.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.337 0.589 . . . . 10.0 109.629 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -76.59 -60.22 2.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.512 -0.767 . . . . 10.0 112.868 -178.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -127.83 135.0 49.46 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 111.988 0.366 . . . . 10.0 111.988 -178.181 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.538 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -133.14 126.21 31.21 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.751 178.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 207' ' ' LEU . . . . . 0.439 HD21 ' HB1' ' A' ' 112' ' ' ALA . 59.1 tp -123.07 116.06 22.86 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.117 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 208' ' ' VAL . . . . . 0.507 HG12 ' HB ' ' A' ' 129' ' ' VAL . 15.5 m -99.19 141.54 16.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.204 0.526 . . . . 10.0 111.21 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -64.67 -72.6 0.14 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.127 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 210' ' ' GLU . . . . . 0.47 ' OE1' ' HA ' ' A' ' 391' ' ' THR . 31.1 mm-40 -109.02 109.51 20.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.768 0.318 . . . . 10.0 110.82 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.685 HG11 HD12 ' A' ' 99' ' ' ILE . 34.0 m -69.32 -20.96 24.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.944 0.402 . . . . 10.0 110.653 179.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.98 -46.05 82.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.58 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.33 -39.4 8.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.745 0.646 . . . . 10.0 112.745 -178.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 58.6 mt -74.34 -30.33 26.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 113.225 0.824 . . . . 10.0 113.225 -177.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 215' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 219' ' ' ALA . 42.5 mt -112.7 -45.58 3.21 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.925 0.713 . . . . 10.0 112.925 -178.175 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 37.8 mm -79.02 -65.92 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.736 0.643 . . . . 10.0 112.736 -178.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.72 -61.22 2.75 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.734 0.642 . . . . 10.0 112.734 -177.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -90.78 74.85 6.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.983 0.421 . . . . 10.0 110.724 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 219' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 215' ' ' LEU . . . -109.47 -51.38 2.88 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.251 -0.432 . . . . 10.0 111.575 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.31 3.14 36.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.036 -178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 1.5 m -67.85 112.72 11.35 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.54 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -91.91 126.77 0.93 Allowed 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 122.918 2.412 . . . . 10.0 113.15 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 223' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 374' ' ' SER . 58.1 mt -82.81 88.7 6.76 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.894 -0.593 . . . . 10.0 109.428 178.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 18.3 mt -94.6 113.28 28.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.88 -179.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 225' ' ' ILE . . . . . 0.435 ' HB ' HD23 ' A' ' 372' ' ' LEU . 4.0 mt -79.85 152.87 4.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.426 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 226' ' ' SER . . . . . 0.462 ' HB3' ' OD1' ' A' ' 369' ' ' ASN . 2.2 m -52.59 122.12 8.37 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.331 0.652 . . . . 10.0 112.445 -179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -72.15 144.77 36.75 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.686 -0.688 . . . . 10.0 112.65 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -78.69 -55.77 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.559 0 C-N-CA 122.512 2.141 . . . . 10.0 112.466 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -158.88 96.47 1.35 Allowed 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.76 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 230' ' ' GLU . . . . . 0.556 ' OE2' ' HB3' ' A' ' 370' ' ' GLN . 3.1 mt-10 -87.68 -8.77 55.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.655 0.74 . . . . 10.0 109.143 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 231' ' ' ASP . . . . . 0.476 ' HA ' ' CE ' ' A' ' 235' ' ' MET . 2.0 t0 -154.96 177.49 11.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.451 -1.249 . . . . 10.0 108.384 178.216 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.575 ' HB3' ' OE2' ' A' ' 234' ' ' GLU . 70.2 m -156.95 159.7 38.35 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.891 0.377 . . . . 10.0 110.711 -179.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 233' ' ' SER . . . . . 0.461 ' HA ' ' HB ' ' A' ' 365' ' ' ILE . 1.0 OUTLIER -63.1 -31.19 72.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.361 -179.757 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 234' ' ' GLU . . . . . 0.575 ' OE2' ' HB3' ' A' ' 232' ' ' SER . 1.3 pm0 -93.88 -2.18 53.74 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.936 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 235' ' ' MET . . . . . 0.502 ' SD ' ' HA3' ' B' ' 20' ' ' GLY . 29.7 mtp -90.0 -69.18 0.74 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.363 -179.143 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.62 -29.02 68.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.204 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 237' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 241' ' ' LYS . 29.6 tptt -64.24 -29.36 70.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.721 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -72.97 -42.12 63.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.3 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 18.4 t -68.32 -40.63 82.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.333 0.587 . . . . 10.0 109.956 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -83.41 11.33 7.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.566 -0.743 . . . . 10.0 111.284 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 241' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 237' ' ' LYS . 3.6 tptm -92.91 -27.29 17.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.665 0.269 . . . . 10.0 111.305 -179.443 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 11.2 tp -90.89 -19.59 7.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.0 0.429 . . . . 10.0 111.119 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 243' ' ' ILE . . . . . 0.493 ' N ' ' HD2' ' A' ' 244' ' ' PRO . 68.0 mt -63.14 -47.71 85.08 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 112.701 0.63 . . . . 10.0 112.701 -179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 244' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 243' ' ' ILE . 56.5 Cg_endo -68.98 18.77 0.16 Allowed 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.272 1.981 . . . . 10.0 113.594 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 245' ' ' HIS . . . . . 0.412 ' H ' ' C ' ' A' ' 243' ' ' ILE . 6.1 t-80 -115.27 1.66 13.84 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 246' ' ' LEU . . . . . 0.679 HD13 ' HB2' ' A' ' 252' ' ' GLU . 15.0 mt -105.58 -169.29 1.57 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.079 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 7.9 pt -135.62 149.51 28.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.611 0.243 . . . . 10.0 111.44 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -84.86 73.92 10.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.17 0.509 . . . . 10.0 110.445 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 9.2 tp60 -178.95 -22.47 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.016 -0.993 . . . . 10.0 109.598 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 250' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 251' ' ' LYS . 30.1 tt0 -162.85 134.41 5.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.674 179.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 250' ' ' GLU . 5.8 mtmm 80.04 105.9 0.07 Allowed 'General case' 0 N--CA 1.471 0.602 0 O-C-N 124.161 0.913 . . . . 10.0 112.18 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 252' ' ' GLU . . . . . 0.679 ' HB2' HD13 ' A' ' 246' ' ' LEU . 1.4 mp0 47.93 39.3 10.71 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.005 -0.998 . . . . 10.0 112.237 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -114.7 -34.71 5.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.898 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 254' ' ' SER . . . . . 0.409 ' HA ' ' CD2' ' A' ' 257' ' ' PHE . 20.0 m -78.22 100.35 6.62 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.303 0.853 . . . . 10.0 113.303 -177.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -68.97 -39.75 79.28 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.168 -1.419 . . . . 10.0 107.168 176.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 62.8 m -147.5 -86.09 0.1 Allowed 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 113.655 -1.611 . . . . 10.0 107.664 177.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 257' ' ' PHE . . . . . 0.409 ' CD2' ' HA ' ' A' ' 254' ' ' SER . 77.1 m-85 62.87 -50.56 0.19 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.532 0.938 . . . . 10.0 113.532 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 69.62 18.56 7.62 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.199 0.6 . . . . 10.0 110.368 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 80.82 -49.44 3.93 Favored Glycine 0 C--N 1.33 0.247 0 CA-C-N 115.751 -0.658 . . . . 10.0 112.75 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -71.69 -41.75 68.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.737 0.303 . . . . 10.0 111.578 -179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 83.4 -140.72 19.99 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.625 -0.99 . . . . 10.0 110.625 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -164.93 -87.39 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.973 0.387 . . . . 10.0 110.921 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -119.6 136.07 54.53 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 1.8 m -80.48 41.75 0.56 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.874 0.369 . . . . 10.0 111.151 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 25.1 m -110.77 -9.88 11.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.863 0.363 . . . . 10.0 110.991 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 266' ' ' ASP . . . . . 0.528 ' OD1' ' HG2' ' A' ' 268' ' ' LYS . 4.0 t70 -156.95 174.0 16.17 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -135.51 1.84 2.9 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.67 0.271 . . . . 10.0 111.409 -178.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 268' ' ' LYS . . . . . 0.528 ' HG2' ' OD1' ' A' ' 266' ' ' ASP . 5.7 ptpp? -122.83 141.19 52.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.167 0.508 . . . . 10.0 111.44 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 4.1 m -83.79 95.66 8.51 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.35 -0.982 . . . . 10.0 108.35 177.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -60.56 -10.49 5.19 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.967 -0.56 . . . . 10.0 112.06 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.47 -13.89 55.97 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.154 -0.313 . . . . 10.0 110.154 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 50.7 t 67.94 98.82 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 O-C-N 123.679 0.612 . . . . 10.0 109.422 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -120.01 -66.51 1.06 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.334 0.864 . . . . 10.0 113.334 -177.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 4.2 mm? 57.47 75.19 0.38 Allowed 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.59 -0.893 . . . . 10.0 108.59 -177.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 12.6 p -112.65 -85.43 0.58 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 114.145 1.165 . . . . 10.0 114.145 -176.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 71.6 137.6 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.629 0.771 . . . . 10.0 109.814 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.46 17.64 0.13 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.728 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . -90.8 -29.18 13.73 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 111.146 -0.781 . . . . 10.0 111.146 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.511 ' O ' HG22 ' A' ' 282' ' ' ILE . 4.2 mm? 73.54 -6.88 1.67 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.345 0.658 . . . . 10.0 111.437 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 10.9 m -81.82 -26.77 9.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 120.933 0.397 . . . . 10.0 110.295 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 13.8 tp -74.41 -34.54 63.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.419 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 282' ' ' ILE . . . . . 0.511 HG22 ' O ' ' A' ' 279' ' ' LEU . 9.0 tp -70.26 -22.56 24.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.65 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -71.2 -34.81 71.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.146 0.498 . . . . 10.0 110.047 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -81.89 -27.26 33.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.915 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 285' ' ' LEU . . . . . 0.431 ' HG ' ' CG ' ' A' ' 252' ' ' GLU . 1.0 OUTLIER -68.7 -40.93 79.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.622 -0.717 . . . . 10.0 109.599 179.068 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 66.9 mt -65.73 153.38 41.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.162 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 287' ' ' VAL . . . . . 0.504 HG12 ' N ' ' A' ' 288' ' ' LYS . 23.3 t 71.49 169.6 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 109.174 -0.676 . . . . 10.0 109.174 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 288' ' ' LYS . . . . . 0.504 ' N ' HG12 ' A' ' 287' ' ' VAL . 0.0 OUTLIER 78.29 150.93 0.11 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.089 0.955 . . . . 10.0 110.642 -179.695 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 64.88 -161.06 0.28 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.751 -177.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -123.12 53.87 0.73 Allowed Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.34 -0.933 . . . . 10.0 112.283 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 291' ' ' ILE . . . . . 0.592 ' HB ' ' HB3' ' B' ' 14' ' ' ALA . 7.2 tt -125.83 110.85 25.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.803 0.335 . . . . 10.0 110.433 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 56.7 tpp 55.42 65.51 1.46 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.51 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.95 6.08 8.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.179 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -85.07 174.73 9.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.317 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -79.05 68.4 3.1 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.103 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -133.61 174.95 9.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.789 0.328 . . . . 10.0 110.955 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 86.4 p -116.92 178.32 4.39 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.243 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.79 -12.53 30.97 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.565 0.209 . . . . 10.0 111.565 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 2.7 p90 -101.01 13.94 33.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.173 0.511 . . . . 10.0 110.965 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 3.7 m -73.53 148.4 87.9 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.3 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -55.99 -25.6 54.5 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.971 2.448 . . . . 10.0 112.904 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -76.87 -19.24 57.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.825 0.345 . . . . 10.0 111.145 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 303' ' ' ASN . . . . . 0.584 ' OD1' ' HB2' ' A' ' 306' ' ' LEU . 63.4 t30 -101.79 94.29 5.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.965 0.412 . . . . 10.0 110.37 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 304' ' ' ILE . . . . . 0.534 HG21 ' HB1' ' A' ' 781' ' ' ALA . 2.3 tp -124.73 -55.73 2.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.328 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 305' ' ' MET . . . . . 0.403 ' H ' HG23 ' A' ' 304' ' ' ILE . 0.2 OUTLIER -64.13 -38.41 90.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.049 0.452 . . . . 10.0 110.751 -179.835 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 306' ' ' LEU . . . . . 0.584 ' HB2' ' OD1' ' A' ' 303' ' ' ASN . 85.5 mt -75.54 -31.86 60.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.326 179.201 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 10.3 tpt -63.9 -39.24 93.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.478 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -75.57 -18.3 59.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.104 0.478 . . . . 10.0 110.178 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -74.29 -41.75 60.69 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.737 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 28.8 m -73.78 -34.04 39.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.641 0.258 . . . . 10.0 111.224 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.87 -40.04 79.49 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.12 0.486 . . . . 10.0 110.069 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 312' ' ' ALA . . . . . 0.492 ' O ' ' HG2' ' A' ' 315' ' ' ARG . . . -69.31 -30.39 68.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.087 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -71.08 -29.87 65.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.642 -0.708 . . . . 10.0 110.526 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 1.4 mp -75.16 -44.52 46.27 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.526 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 315' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 312' ' ' ALA . 37.2 ptt180 -65.17 -33.71 76.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.877 0.37 . . . . 10.0 110.08 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 316' ' ' ALA . . . . . 0.4 ' HA ' ' HB2' ' A' ' 320' ' ' PHE . . . -89.86 39.58 0.96 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.374 0.607 . . . . 10.0 110.203 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -147.73 -42.01 0.17 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.477 -0.783 . . . . 10.0 109.929 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -107.03 -47.95 3.59 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.165 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.16 -50.88 51.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.519 -179.188 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 320' ' ' PHE . . . . . 0.4 ' HB2' ' HA ' ' A' ' 316' ' ' ALA . 15.0 m-85 -81.4 108.53 15.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.637 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -99.04 137.21 37.89 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.549 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 322' ' ' ARG . . . . . 0.475 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 2.0 ttp180 -63.13 151.47 40.05 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.219 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 323' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 1.1 m-20 76.85 -46.15 0.5 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.909 0.884 . . . . 10.0 112.63 178.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 8.8 p -90.17 -36.03 8.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -103.02 -40.5 6.46 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.959 -0.296 . . . . 10.0 111.18 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -145.86 147.58 31.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.726 0.298 . . . . 10.0 110.651 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 9.1 tp -125.73 132.7 70.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 13.4 t -96.9 113.17 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 110.06 -0.348 . . . . 10.0 110.06 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -158.68 153.15 24.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.295 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 61.12 23.66 13.83 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.454 0.471 . . . . 10.0 110.847 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 71.06 17.45 75.65 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.841 -0.618 . . . . 10.0 111.833 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -132.41 172.14 12.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.884 0.373 . . . . 10.0 110.769 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 62.0 t -116.9 119.87 63.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.56 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 82.3 mt -108.39 135.94 45.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.116 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 3.1 mp -81.79 127.85 39.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.083 0.468 . . . . 10.0 110.647 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.18 125.49 57.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.961 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -81.88 115.38 21.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.23 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -70.38 -25.26 63.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.325 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -62.18 -50.3 72.37 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -178.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.38 -18.26 10.5 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.825 0.676 . . . . 10.0 112.825 -178.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 86.81 39.56 7.52 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.622 -0.799 . . . . 10.0 111.261 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -107.93 129.25 55.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.623 0.249 . . . . 10.0 110.662 -179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -80.96 98.04 7.74 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 63.2 mtt -86.36 99.05 11.34 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.088 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 345' ' ' GLN . . . . . 0.451 ' CD ' ' H ' ' A' ' 345' ' ' GLN . 0.6 OUTLIER -83.94 -26.2 29.49 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.957 179.532 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -91.86 55.89 2.97 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.093 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 347' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 347' ' ' ARG . 2.1 mmt85 -140.82 93.42 2.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.054 0.454 . . . . 10.0 110.541 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 7.6 ttp85 -91.03 90.87 8.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.047 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -79.9 114.74 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.021 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 2.5 m -75.29 -161.14 0.14 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.421 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 33.0 t70 66.33 12.48 8.65 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.466 0.65 . . . . 10.0 110.933 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 71.88 23.42 78.02 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.853 -0.612 . . . . 10.0 112.508 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 11.6 tp -58.09 -48.93 78.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.706 0.288 . . . . 10.0 111.217 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 354' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -94.65 -5.76 44.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.696 -0.402 . . . . 10.0 111.117 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 355' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -65.68 -45.95 80.92 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.195 0.522 . . . . 10.0 110.061 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -66.29 -28.79 68.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.184 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.9 -43.2 82.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.683 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 358' ' ' GLU . . . . . 0.604 ' OE1' ' HA ' ' A' ' 365' ' ' ILE . 83.4 mt-10 -64.2 -32.45 74.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.17 179.213 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -78.55 -25.89 45.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.796 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -67.71 -55.97 11.13 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.419 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -91.81 -171.48 2.89 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.398 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -84.96 63.96 4.31 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.868 -0.682 . . . . 10.0 112.047 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 2.2 t -122.71 163.22 21.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.611 -0.515 . . . . 10.0 109.611 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -100.15 107.29 19.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.248 -0.279 . . . . 10.0 110.248 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 365' ' ' ILE . . . . . 0.604 ' HA ' ' OE1' ' A' ' 358' ' ' GLU . 2.7 mp -58.47 132.23 23.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.493 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 13.3 mm-40 -71.51 160.12 33.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.898 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -81.46 -3.31 52.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.914 0.388 . . . . 10.0 110.578 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 64.23 -177.37 0.16 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.168 -0.924 . . . . 10.0 112.224 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.462 ' OD1' ' HB3' ' A' ' 226' ' ' SER . 4.6 t30 -170.08 99.68 0.29 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.331 -0.849 . . . . 10.0 109.444 -179.223 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 370' ' ' GLN . . . . . 0.556 ' HB3' ' OE2' ' A' ' 230' ' ' GLU . 5.3 tt0 -147.23 -50.75 0.19 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 371' ' ' THR . . . . . 0.461 ' H ' ' CD ' ' A' ' 230' ' ' GLU . 0.2 OUTLIER -125.34 129.14 49.35 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 114.443 1.275 . . . . 10.0 114.443 -176.818 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 372' ' ' LEU . . . . . 0.552 HD12 ' HE3' ' A' ' 776' ' ' LYS . 8.9 tp -130.81 -43.18 1.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.961 -1.018 . . . . 10.0 108.505 177.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -164.67 151.09 10.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.396 -1.275 . . . . 10.0 107.868 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 374' ' ' SER . . . . . 0.45 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 20.1 m -151.23 148.69 28.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.214 0.53 . . . . 10.0 112.228 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.403 HG22 HD11 ' A' ' 187' ' ' LEU . 16.6 tt -162.03 141.12 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.135 -0.939 . . . . 10.0 109.274 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 5.7 p -96.7 148.39 22.93 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.845 -0.428 . . . . 10.0 109.845 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -58.06 -42.08 84.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 10.0 111.094 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 378' ' ' GLN . . . . . 0.538 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 0.0 OUTLIER -60.95 -29.72 69.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.263 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -95.78 -8.66 33.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.763 0.316 . . . . 10.0 111.011 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -83.52 -50.0 8.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.191 0.519 . . . . 10.0 109.719 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -73.91 -4.92 37.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.636 0.731 . . . . 10.0 110.007 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 15.9 ttt180 -82.96 -4.24 58.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.102 -0.953 . . . . 10.0 109.829 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.469 HD11 HH21 ' A' ' 656' ' ' ARG . 29.5 mt -106.87 4.3 27.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.597 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.538 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 17.3 m-85 -97.58 143.46 28.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.053 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -70.74 -74.36 0.15 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.295 0.569 . . . . 10.0 110.721 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -95.0 102.89 14.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.734 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 46.5 tp -109.96 118.49 36.59 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.99 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -132.15 161.6 32.94 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.324 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -162.75 163.05 35.02 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.41 -0.9 . . . . 10.0 112.371 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 390' ' ' MET . . . . . 0.632 ' O ' ' HB ' ' A' ' 391' ' ' THR . 27.8 mtm -124.48 178.85 5.19 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 110.096 -0.335 . . . . 10.0 110.096 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 391' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' A' ' 390' ' ' MET . 1.4 t 167.52 -177.75 0.02 OUTLIER 'General case' 0 C--O 1.234 0.276 0 O-C-N 123.774 0.671 . . . . 10.0 109.914 178.319 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -92.04 143.5 16.58 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.389 -0.684 . . . . 10.0 111.389 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 393' ' ' THR . . . . . 0.418 HG23 ' HB3' ' A' ' 101' ' ' GLU . 0.2 OUTLIER -55.4 108.28 0.41 Allowed 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.562 0.345 . . . . 10.0 111.671 -179.634 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -145.86 -19.75 0.46 Allowed 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.062 0.393 . . . . 10.0 112.062 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 31.6 t70 59.41 -101.27 0.12 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 396' ' ' THR . . . . . 0.512 HG23 ' HB3' ' A' ' 565' ' ' ARG . 5.2 m 54.52 -104.28 0.21 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.946 0.498 . . . . 10.0 112.29 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -81.51 32.36 0.35 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.969 0.414 . . . . 10.0 111.518 -179.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 398' ' ' ALA . . . . . 0.563 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -67.1 -18.83 65.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.99 0.424 . . . . 10.0 110.781 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -74.11 -15.29 61.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.883 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -84.74 -24.6 28.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.979 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 401' ' ' PHE . . . . . 0.563 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 22.5 m-85 -56.57 -54.49 45.36 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.741 0.305 . . . . 10.0 111.629 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.7 m -76.47 -8.81 57.94 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 40.7 m -95.47 -47.46 6.26 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -178.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 20.0 mt -86.13 -74.13 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.264 0.468 . . . . 10.0 112.264 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 405' ' ' TYR . . . . . 0.538 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 68.7 m-85 -78.95 -8.04 58.55 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.482 0.549 . . . . 10.0 112.482 -177.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm 62.13 58.82 1.75 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.12 0.486 . . . . 10.0 110.763 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 407' ' ' LEU . . . . . 0.48 HD13 HD11 ' A' ' 99' ' ' ILE . 2.4 mt -114.29 156.56 24.15 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.429 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 408' ' ' ASP . . . . . 0.469 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . 20.3 t0 -95.46 147.06 23.94 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.61 -0.885 . . . . 10.0 108.61 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 1.8 m -109.13 104.5 13.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.888 0.375 . . . . 10.0 111.324 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 5.9 t -114.71 129.01 71.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.667 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 61.5 t -90.48 123.59 42.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 110.04 -0.355 . . . . 10.0 110.04 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 50.1 t -90.73 126.65 55.17 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.842 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.17 150.39 88.42 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.556 2.171 . . . . 10.0 111.966 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 16.4 p -77.23 164.24 25.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.015 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -68.63 -35.59 77.5 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.764 -0.828 . . . . 10.0 108.764 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 55.7 mmt-85 -134.69 143.21 45.51 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 114.944 -1.025 . . . . 10.0 108.829 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -60.64 136.63 68.17 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.662 2.241 . . . . 10.0 112.896 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 73.8 mtm -84.92 130.35 34.66 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.324 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.1 mt -111.51 36.13 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.364 0.602 . . . . 10.0 109.962 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 420' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 420' ' ' ARG . 35.4 ttp180 -71.38 123.39 22.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.031 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 14.4 mttm -83.11 99.6 10.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.29 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 422' ' ' ASP . . . . . 0.537 ' OD1' ' HD2' ' A' ' 572' ' ' ARG . 9.0 m-20 -86.46 110.57 19.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.496 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 43.9 mt -94.61 157.28 37.35 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.358 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -71.42 176.29 8.21 Favored 'Trans proline' 0 C--O 1.238 0.489 0 C-N-CA 122.739 2.293 . . . . 10.0 112.894 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -86.63 115.76 24.3 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.445 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 426' ' ' LEU . . . . . 0.502 ' HA ' HD23 ' A' ' 426' ' ' LEU . 9.9 mt -89.7 87.36 6.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.13 0.49 . . . . 10.0 109.792 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 427' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 588' ' ' LEU . 8.9 t -86.3 126.55 40.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.748 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 428' ' ' TYR . . . . . 0.417 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 5.3 m-85 -112.14 177.49 4.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.234 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 84.9 mmm -71.76 -77.04 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.633 0.254 . . . . 10.0 111.396 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 67.0 p -88.12 157.51 18.82 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.96 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -61.27 -30.45 70.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.468 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -60.13 -39.96 88.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.221 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -64.84 -41.2 95.92 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.034 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 434' ' ' LYS . . . . . 0.505 ' O ' HG13 ' A' ' 438' ' ' ILE . 38.8 ttpt -59.19 -51.47 69.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.061 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 435' ' ' ILE . . . . . 0.454 ' O ' HG12 ' A' ' 439' ' ' ILE . 46.5 mm -63.1 -44.25 99.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.593 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 436' ' ' GLN . . . . . 0.483 ' O ' ' HG2' ' A' ' 440' ' ' GLU . 24.7 tp60 -57.65 -45.17 85.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.866 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -63.11 -37.65 88.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.805 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 438' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 434' ' ' LYS . 88.8 mt -59.67 -44.25 93.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.097 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 439' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 435' ' ' ILE . 30.3 mm -62.09 -38.87 81.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.013 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 440' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 436' ' ' GLN . 5.9 mm-40 -65.05 -42.44 94.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.871 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 441' ' ' ASP . . . . . 0.6 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 15.2 t70 -67.71 -42.45 81.96 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 179.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.513 HG12 HG11 ' A' ' 452' ' ' VAL . 56.1 mt -58.07 -41.38 80.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.694 179.4 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -59.97 -40.9 90.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.15 0.5 . . . . 10.0 110.596 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.95 -28.12 69.3 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.564 -0.744 . . . . 10.0 111.074 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 14.3 mmt180 -86.11 -43.11 13.33 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.908 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.54 -42.49 98.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.619 -0.264 . . . . 10.0 111.362 -179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -71.83 -9.93 59.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.471 -0.332 . . . . 10.0 111.232 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 4.1 ttmm -104.69 -4.48 22.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.642 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 79.3 30.15 46.97 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.837 -0.697 . . . . 10.0 112.418 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 450' ' ' GLN . . . . . 0.457 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 63.8 tt0 -108.33 131.28 21.86 Favored Pre-proline 0 C--N 1.327 -0.391 0 O-C-N 122.796 -0.238 . . . . 10.0 111.027 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -69.63 143.71 52.36 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.684 2.256 . . . . 10.0 111.442 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.513 HG11 HG12 ' A' ' 442' ' ' ILE . 49.0 t -120.42 125.46 74.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.874 0.369 . . . . 10.0 111.676 -178.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 32.5 tp -113.1 105.82 13.92 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 39.6 t -93.4 122.66 45.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.452 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -105.24 91.64 0.78 Allowed Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.14 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.32 140.08 29.9 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.363 -0.236 . . . . 10.0 110.363 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 20.9 pt -77.76 -35.94 21.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 112.506 0.558 . . . . 10.0 112.506 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 7.4 p -122.99 159.45 28.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.95 0.405 . . . . 10.0 112.023 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 74.5 mt -64.72 -36.98 78.96 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -56.52 -46.63 80.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.988 -1.005 . . . . 10.0 110.327 178.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.13 -32.89 72.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.439 179.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 17.2 m -64.39 -44.44 91.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.134 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -68.85 -40.44 79.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.322 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.9 -53.83 54.02 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.417 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.63 -31.59 54.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-O 120.92 0.39 . . . . 10.0 110.877 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 35.4 t -68.63 -41.05 80.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.119 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -59.86 -48.85 80.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.592 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -64.24 -39.51 94.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.866 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 19.8 mt -62.92 -34.43 77.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.986 0.422 . . . . 10.0 110.628 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 7.9 m -71.83 -42.73 66.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.734 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -61.75 -39.5 91.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.372 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -72.76 -18.27 61.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.855 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 79.72 47.93 6.95 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.062 -0.589 . . . . 10.0 112.706 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 65.9 mt -118.77 128.43 75.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 110.396 -0.224 . . . . 10.0 110.396 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 21.5 mmtm -62.24 129.75 42.22 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 54.9 p-80 -161.0 149.49 16.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.759 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -127.53 157.72 39.37 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.209 -0.451 . . . . 10.0 109.842 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.6 t -121.6 130.76 74.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.662 0.268 . . . . 10.0 111.027 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 90.3 mt -83.5 90.08 7.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.599 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -85.16 126.65 33.81 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.433 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -61.23 -22.83 65.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.692 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -85.93 -2.45 58.28 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.066 0.46 . . . . 10.0 110.57 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -130.49 59.41 1.65 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.312 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -61.68 -33.82 74.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.056 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.49 74.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.864 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 486' ' ' ASN . . . . . 0.424 ' O ' HG13 ' A' ' 490' ' ' ILE . 0.2 OUTLIER -88.54 -33.48 17.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.891 179.48 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.5 -57.38 9.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.6 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -54.2 -39.78 66.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.585 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -66.13 -35.75 81.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.246 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 490' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 486' ' ' ASN . 47.9 mt -74.66 -41.99 48.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.493 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 95.6 t -60.41 -34.83 59.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.746 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -59.6 -28.4 67.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.634 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -124.39 26.94 7.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.922 0.391 . . . . 10.0 110.57 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -74.55 -21.9 59.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.17 0.51 . . . . 10.0 110.655 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -94.82 16.23 61.7 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.98 -0.629 . . . . 10.0 111.737 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -74.28 138.01 75.16 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 110.115 -0.328 . . . . 10.0 110.115 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.05 125.84 19.6 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.661 2.24 . . . . 10.0 112.952 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.5 22.33 6.43 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.067 0.766 . . . . 10.0 113.067 178.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -100.95 122.73 44.0 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 121.122 -0.231 . . . . 10.0 110.491 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 35.3 t -97.95 115.64 38.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.912 0.387 . . . . 10.0 110.44 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.9 m -115.33 121.88 44.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.572 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 47.7 mt -101.19 124.36 54.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.271 -0.422 . . . . 10.0 109.94 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -114.44 116.54 29.03 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.817 0.342 . . . . 10.0 111.182 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 21.4 m -81.13 113.94 19.63 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.586 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 63.83 81.46 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.326 -0.852 . . . . 10.0 110.883 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 53.4 tpp -60.95 122.46 14.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.248 -0.887 . . . . 10.0 110.957 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -87.69 166.73 14.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.886 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -65.56 157.7 47.4 Favored Glycine 0 N--CA 1.453 -0.187 0 C-N-CA 121.219 -0.515 . . . . 10.0 112.471 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 68.98 -93.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.977 0.511 . . . . 10.0 110.861 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 88.8 132.78 4.42 Favored Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 121.1 -0.572 . . . . 10.0 111.843 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.62 143.28 25.24 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.499 0.32 . . . . 10.0 110.926 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -64.67 98.6 0.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.646 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 70.4 mt -73.6 101.94 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.129 0.49 . . . . 10.0 109.819 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 514' ' ' VAL . . . . . 0.425 ' HB ' ' O ' ' A' ' 517' ' ' GLY . 6.3 t -71.67 132.02 33.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.865 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.468 HD11 ' OD1' ' A' ' 580' ' ' ASP . 34.0 mt -66.37 125.83 26.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.591 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 93.36 -0.81 68.81 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.101 -0.571 . . . . 10.0 111.847 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 517' ' ' GLY . . . . . 0.425 ' O ' ' HB ' ' A' ' 514' ' ' VAL . . . 106.2 -167.91 14.58 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 110.986 -0.846 . . . . 10.0 110.986 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.9 p -127.06 98.18 5.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 117.278 0.539 . . . . 10.0 110.991 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 52.9 p-90 -58.51 -29.47 66.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.877 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -62.25 -30.01 70.81 Favored 'General case' 0 C--N 1.334 -0.077 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.783 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -86.25 -34.42 20.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.467 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -65.89 -43.95 86.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.612 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 523' ' ' VAL . . . . . 0.406 HG12 HD12 ' A' ' 537' ' ' ILE . 34.1 m -70.48 -20.07 22.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.94 0.4 . . . . 10.0 110.593 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -91.87 -0.1 57.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -90.29 -10.79 42.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.573 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 44.2 mt -96.04 154.0 17.47 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.834 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -72.62 -57.11 4.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.85 0.357 . . . . 10.0 110.152 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -119.2 88.6 37.76 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.975 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.05 103.3 1.16 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.996 2.464 . . . . 10.0 111.515 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 18.8 p -81.56 173.39 12.43 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.358 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.75 -43.23 80.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.484 0.183 . . . . 10.0 111.446 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 532' ' ' GLU . 1.6 mp0 -62.28 -41.02 98.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.887 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -68.24 -44.43 75.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.952 0.406 . . . . 10.0 110.408 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 90.3 mt -64.33 -42.48 95.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.254 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -64.89 -42.52 94.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.481 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -58.32 -51.6 69.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.344 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 537' ' ' ILE . . . . . 0.406 HD12 HG12 ' A' ' 523' ' ' VAL . 96.7 mt -64.83 -37.31 79.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.29 -0.413 . . . . 10.0 110.665 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -62.18 -47.68 83.41 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.977 0.418 . . . . 10.0 110.303 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -69.54 -37.82 77.24 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.504 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 540' ' ' ASP . . . . . 0.576 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 13.2 t70 -61.31 -49.13 78.28 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.238 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -60.43 -39.81 88.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.867 -1.061 . . . . 10.0 110.337 179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 -52.05 -48.61 64.52 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.308 0.38 . . . . 10.0 110.914 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 26.0 t -60.09 -47.44 91.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.91 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 544' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 6.2 mtm180 -67.99 -35.73 78.82 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.925 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -64.29 -48.55 75.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.474 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.37 -31.23 71.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.458 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.5 94.76 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.434 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 548' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 544' ' ' ARG . 99.4 t -65.43 -37.64 80.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.464 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.23 -45.82 89.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.048 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -70.18 -18.41 63.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.022 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 551' ' ' ALA . . . . . 0.457 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -82.92 -28.46 29.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.961 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 129.97 6.34 4.06 Favored Glycine 0 CA--C 1.519 0.324 0 C-N-CA 120.445 -0.883 . . . . 10.0 113.302 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 84.12 -167.6 43.78 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.67 -0.776 . . . . 10.0 112.43 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 36.6 tp -71.67 119.56 16.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.908 0.385 . . . . 10.0 110.879 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -91.45 118.94 30.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.748 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 25.3 mm -103.22 134.99 42.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.289 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 40.6 mt -126.48 121.59 59.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.018 0.437 . . . . 10.0 110.691 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.38 115.71 4.99 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.115 -0.794 . . . . 10.0 111.115 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 20.5 p -71.51 -40.3 70.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.021 0.439 . . . . 10.0 111.266 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -137.55 151.27 48.21 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.036 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 561' ' ' ARG . . . . . 0.588 ' HB2' HD22 ' A' ' 594' ' ' LEU . 3.5 mmt85 -90.88 150.7 21.42 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -94.94 146.24 24.37 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.806 -0.358 . . . . 10.0 110.588 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -59.46 -51.95 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 564' ' ' SER . . . . . 0.408 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.1 OUTLIER -75.05 117.27 16.71 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.233 -0.894 . . . . 10.0 110.127 179.039 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 565' ' ' ARG . . . . . 0.532 ' HA ' ' HB3' ' A' ' 568' ' ' ASP . 17.1 tpt180 -66.33 -26.62 67.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.125 -0.488 . . . . 10.0 110.216 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -58.87 -36.84 75.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.526 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 59.9 mt -92.75 -34.78 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.646 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 568' ' ' ASP . . . . . 0.532 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 2.2 t70 -60.89 -44.81 96.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.101 0.477 . . . . 10.0 110.693 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -69.55 -24.82 63.77 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.933 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -66.52 -26.83 67.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.747 0.308 . . . . 10.0 110.49 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.405 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 57.2 tp -73.13 -33.94 65.82 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 572' ' ' ARG . . . . . 0.537 ' HD2' ' OD1' ' A' ' 422' ' ' ASP . 13.5 ttp180 -76.66 -30.68 56.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.078 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.82 27.77 3.34 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 121.011 -0.614 . . . . 10.0 113.525 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 574' ' ' ARG . . . . . 0.405 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 0.3 OUTLIER -77.46 -54.92 5.85 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 179.075 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.78 172.63 10.65 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.994 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 85.11 47.39 5.27 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.692 -0.766 . . . . 10.0 111.573 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 577' ' ' ARG . . . . . 0.584 ' H ' ' HB3' ' A' ' 580' ' ' ASP . 54.4 mtt180 -108.53 121.16 44.39 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.185 -0.302 . . . . 10.0 110.185 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 59.46 28.99 18.5 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.701 0.63 . . . . 10.0 112.701 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 104.75 4.47 42.54 Favored Glycine 0 N--CA 1.454 -0.111 0 C-N-CA 120.292 -0.956 . . . . 10.0 113.866 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 580' ' ' ASP . . . . . 0.584 ' HB3' ' H ' ' A' ' 577' ' ' ARG . 0.9 OUTLIER -67.79 157.8 33.93 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.942 0.371 . . . . 10.0 110.253 179.23 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -92.7 -103.99 0.12 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.572 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 97.75 175.61 33.78 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.696 -0.764 . . . . 10.0 112.3 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -153.8 120.63 5.63 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.328 -0.249 . . . . 10.0 110.328 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.97 119.64 34.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.818 0.342 . . . . 10.0 110.864 -179.423 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -117.51 113.54 22.15 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.136 -0.483 . . . . 10.0 109.959 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -102.87 147.0 27.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.897 0.379 . . . . 10.0 111.035 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 587' ' ' TYR . . . . . 0.489 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 31.4 m-85 -135.33 158.14 45.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.474 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 588' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 427' ' ' VAL . 10.1 tp -165.78 163.26 18.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.239 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 589' ' ' SER . . . . . 0.517 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.6 OUTLIER -124.1 159.48 29.88 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.558 -0.292 . . . . 10.0 110.33 179.275 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 590' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 77.9 mmm -74.7 -17.95 60.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.222 0.534 . . . . 10.0 110.282 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -111.03 24.17 13.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.275 -0.875 . . . . 10.0 109.088 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 592' ' ' ASP . . . . . 0.517 ' HB2' ' O ' ' A' ' 589' ' ' SER . 0.9 OUTLIER -76.32 176.82 7.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.127 -0.942 . . . . 10.0 111.954 -178.71 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -82.32 -28.65 31.54 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.661 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.588 HD22 ' HB2' ' A' ' 561' ' ' ARG . 9.3 tp -70.62 -13.42 62.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.142 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 16.3 mmt -76.06 12.08 1.26 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.969 0.414 . . . . 10.0 111.559 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.516 ' NH1' ' HA ' ' A' ' 596' ' ' ARG . 10.9 mmm180 -110.87 -4.03 15.4 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.572 -0.286 . . . . 10.0 111.059 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 594' ' ' LEU . 28.0 pt -82.82 -10.16 11.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 121.22 0.533 . . . . 10.0 110.459 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -87.8 3.85 46.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.53 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.42 -83.2 0.03 OUTLIER 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.281 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 3.2 m -69.96 125.47 26.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.864 0.364 . . . . 10.0 110.825 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -69.36 -15.95 63.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.984 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 602' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 602' ' ' ARG . 4.5 mmt180 -64.94 -32.48 74.22 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.051 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.5 t -61.95 -55.35 24.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.21 0.528 . . . . 10.0 109.69 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 3.6 m -66.19 -35.52 80.65 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.675 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -65.57 -38.01 94.24 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.453 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 29.9 tpp -73.13 -26.07 61.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.098 0.475 . . . . 10.0 110.757 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 51.9 mtt -72.35 -12.6 61.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.73 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -76.13 -7.19 54.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.019 0.438 . . . . 10.0 110.725 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -83.25 9.37 10.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.085 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 6.3 mp -80.9 -16.01 54.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.014 0.435 . . . . 10.0 110.478 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 89.97 -48.61 3.25 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.0 -0.619 . . . . 10.0 112.562 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 69.3 -66.65 0.25 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.394 0.677 . . . . 10.0 111.387 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt 66.32 94.23 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.249 0 O-C-N 123.527 0.517 . . . . 10.0 110.686 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 614' ' ' PRO . . . . . 0.417 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 65.1 Cg_exo -50.29 107.85 0.19 Allowed 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 123.26 2.64 . . . . 10.0 112.994 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 118.82 -17.47 10.88 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.734 -0.746 . . . . 10.0 112.288 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -93.8 132.68 37.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.953 0.406 . . . . 10.0 110.788 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -102.9 91.6 4.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.475 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 6.4 tp -66.75 -35.69 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.548 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 47.45 66.7 0.95 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.576 -0.738 . . . . 10.0 112.193 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 3.3 m170 -109.04 114.73 57.88 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.606 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.86 -15.88 40.85 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.158 2.572 . . . . 10.0 114.207 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -63.58 -29.02 70.33 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.75 -0.38 . . . . 10.0 110.494 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 23.4 t -69.44 -46.16 76.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 87.9 m -59.21 -44.08 92.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.015 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.47 -31.7 72.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.97 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -70.9 -40.84 71.94 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.944 -0.391 . . . . 10.0 109.944 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 97.2 mt -66.53 -49.11 77.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.434 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -58.66 -35.88 73.27 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.968 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -64.92 -41.05 95.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.935 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -69.53 -40.63 76.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.894 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -60.17 -44.17 95.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.314 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 52.9 ttt85 -65.67 -32.6 74.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.35 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 55.4 mttt -65.27 -35.95 82.6 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.649 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.47 -44.17 98.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 109.253 -0.647 . . . . 10.0 109.253 178.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.408 ' OE2' ' HA ' ' A' ' 564' ' ' SER . 6.8 mm-40 -66.0 -39.12 90.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.383 -0.826 . . . . 10.0 110.096 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 19.7 m -64.62 -33.52 76.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.048 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -66.94 -36.5 82.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.28 0.562 . . . . 10.0 109.532 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -64.7 -36.83 85.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.309 -0.86 . . . . 10.0 110.007 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -59.04 -40.29 84.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.467 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -61.28 -41.35 96.81 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.077 0.465 . . . . 10.0 110.185 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 43.2 mt -66.35 -42.46 90.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.986 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 642' ' ' ARG . . . . . 0.606 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 2.1 mmm180 -62.68 -42.06 99.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.98 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -59.64 -40.7 88.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.336 -0.847 . . . . 10.0 110.687 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -63.17 -39.31 94.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.281 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 78.6 mt -69.5 -38.62 77.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.38 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 646' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 89.9 mt -60.1 -36.33 77.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.881 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -68.13 -20.65 64.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.494 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -96.02 -44.15 7.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.19 0.519 . . . . 10.0 110.361 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -69.18 -27.86 65.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.839 -0.619 . . . . 10.0 112.026 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -65.28 -30.92 71.83 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.146 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 651' ' ' VAL . . . . . 0.557 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 30.1 t -62.7 -46.7 95.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.57 -30.44 68.23 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.152 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 653' ' ' ASN . . . . . 0.472 ' HA ' ' NH1' ' A' ' 656' ' ' ARG . 13.9 t30 -66.67 -48.0 70.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.539 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.81 -47.24 85.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.869 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 655' ' ' GLN . . . . . 0.557 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 41.4 mt-30 -64.51 -38.69 91.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.257 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 656' ' ' ARG . . . . . 0.472 ' NH1' ' HA ' ' A' ' 653' ' ' ASN . 18.9 ttp-105 -63.7 -48.46 77.0 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.506 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -61.83 -43.92 97.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.537 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -62.93 -50.89 69.06 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.869 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 659' ' ' ILE . . . . . 0.455 HG13 HD21 ' A' ' 771' ' ' LEU . 7.5 tp -69.49 -34.97 64.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 111.984 0.364 . . . . 10.0 111.984 -178.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -68.1 -36.35 79.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.567 0.222 . . . . 10.0 110.584 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 51.3 m -62.0 -48.09 81.89 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -63.6 -45.24 91.27 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.675 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 34.6 ttt-85 -60.4 -35.47 75.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.821 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -71.04 -38.02 72.55 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.686 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -61.93 -49.4 76.3 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 666' ' ' LEU . . . . . 0.471 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 49.4 mt -66.78 -18.25 65.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.795 -0.638 . . . . 10.0 110.713 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 39.5 tp -81.28 -41.57 21.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.008 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -78.65 -40.08 35.19 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.563 0.579 . . . . 10.0 112.563 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 27.4 m -59.68 140.0 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 121.403 0.621 . . . . 10.0 111.58 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 4.1 m -92.8 -10.08 38.14 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.823 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -130.28 160.97 32.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.946 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.01 14.41 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.877 0.37 . . . . 10.0 111.017 -178.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 5.7 m -54.21 -58.73 6.26 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.851 0.358 . . . . 10.0 111.827 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 674' ' ' GLU . . . . . 0.415 ' HA ' ' OE2' ' A' ' 674' ' ' GLU . 5.0 mm-40 -63.52 -34.83 78.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 10.0 112.018 -179.045 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -45.92 87.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.794 0.331 . . . . 10.0 110.272 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 676' ' ' ILE . . . . . 0.493 ' O ' ' HB2' ' A' ' 680' ' ' ARG . 36.0 mm -67.43 -37.68 79.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.142 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -63.71 -47.75 79.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.216 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 44.8 m -55.42 -48.29 74.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.745 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 679' ' ' ILE . . . . . 0.435 ' O ' HG23 ' A' ' 683' ' ' VAL . 42.5 pt -75.71 -25.49 17.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.732 -0.387 . . . . 10.0 111.291 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 680' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 676' ' ' ILE . 27.4 ttm-85 -61.66 -45.51 93.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.989 0.423 . . . . 10.0 110.396 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 681' ' ' GLU . . . . . 0.54 ' HG2' HD21 ' A' ' 740' ' ' LEU . 30.0 mt-10 -68.14 -26.89 66.0 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.644 -0.707 . . . . 10.0 111.0 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -80.45 -48.42 12.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.026 -0.533 . . . . 10.0 111.35 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 683' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 679' ' ' ILE . 79.1 t -59.84 -47.93 89.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.44 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -60.86 -39.72 90.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.17 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -61.71 -48.93 78.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.413 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.84 -39.72 82.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.158 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 10.5 m -64.72 -39.47 93.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.374 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -70.47 -48.02 62.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.621 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 689' ' ' ASP . . . . . 0.409 ' HA ' ' O ' ' A' ' 692' ' ' ILE . 4.5 m-20 -58.36 -29.08 65.7 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.873 -179.26 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -65.13 -26.97 68.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.806 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -115.81 -17.23 11.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.824 0.345 . . . . 10.0 111.457 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 692' ' ' ILE . . . . . 0.506 HG23 ' CD1' ' A' ' 701' ' ' TRP . 67.0 mt -128.21 105.53 19.84 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.432 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.16 138.64 52.5 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.46 2.107 . . . . 10.0 111.422 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -51.18 108.69 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 123.056 2.504 . . . . 10.0 113.465 -179.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 59.17 80.78 0.18 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.678 -0.692 . . . . 10.0 111.482 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 3.5 p -137.23 -164.35 1.57 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.434 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 89.9 mt -85.69 146.79 26.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.709 -0.223 . . . . 10.0 110.917 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 698' ' ' GLU . . . . . 0.452 ' HA ' ' CE3' ' A' ' 701' ' ' TRP . 19.5 tt0 -58.07 -39.11 77.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.434 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.17 -16.93 64.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.957 0.408 . . . . 10.0 111.422 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 24.2 ttt -87.0 -14.47 41.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.229 0.538 . . . . 10.0 110.115 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 701' ' ' TRP . . . . . 0.506 ' CD1' HG23 ' A' ' 692' ' ' ILE . 43.8 m0 -84.5 120.22 26.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.617 -0.719 . . . . 10.0 110.28 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -85.9 81.72 8.43 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 703' ' ' ILE . . . . . 0.482 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.9 mm -60.98 -48.82 91.45 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.872 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 704' ' ' PRO . . . . . 0.482 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.9 Cg_exo -54.94 -49.12 17.73 Favored 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 122.091 1.861 . . . . 10.0 112.192 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -63.9 -43.18 97.91 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.89 -0.671 . . . . 10.0 112.223 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.517 ' O ' ' HG ' ' A' ' 710' ' ' LEU . 54.0 tp -63.94 -42.13 97.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.547 0.213 . . . . 10.0 110.847 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 707' ' ' GLN . . . . . 0.48 ' O ' ' HD3' ' A' ' 711' ' ' LYS . 9.3 mt-30 -62.03 -50.73 70.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.759 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.98 -36.17 78.74 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -62.31 -48.23 80.75 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.278 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 710' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 706' ' ' LEU . 88.0 mt -64.33 -34.69 78.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.787 0.327 . . . . 10.0 111.219 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 711' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 707' ' ' GLN . 8.6 mtpp -74.89 -14.91 60.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.261 -0.427 . . . . 10.0 112.125 -179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -110.15 -45.17 3.63 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.743 0.306 . . . . 10.0 111.618 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -73.06 -41.99 63.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.322 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -109.66 -8.51 14.95 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.988 -0.285 . . . . 10.0 111.7 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 715' ' ' ASP . . . . . 0.485 ' HB2' ' HA ' ' A' ' 828' ' ' LYS . 0.2 OUTLIER 61.64 29.74 18.3 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.098 179.741 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 36.7 tp -117.01 127.73 54.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.861 0.362 . . . . 10.0 110.721 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -90.1 106.38 18.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.39 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 41.7 mt -118.26 119.58 33.09 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.918 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.13 71.38 6.71 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.948 2.432 . . . . 10.0 112.254 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 58.0 mt -64.34 -42.37 95.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.843 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -63.38 -27.88 69.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.963 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -73.69 -47.24 41.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.309 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -66.7 -40.44 88.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.18 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 35.5 tp -58.94 -24.24 62.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.506 -0.77 . . . . 10.0 112.88 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.17 -28.95 13.87 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.814 0.302 . . . . 10.0 111.814 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -86.8 -36.82 18.32 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.178 0.436 . . . . 10.0 112.178 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -120.83 90.07 46.15 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-O 120.739 0.304 . . . . 10.0 110.916 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.31 -14.57 34.48 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.506 2.138 . . . . 10.0 111.663 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.17 -6.59 53.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.388 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 50.0 mt -68.79 -37.56 79.36 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.801 0.334 . . . . 10.0 110.458 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 54.57 -101.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.461 -0.791 . . . . 10.0 111.806 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.84 -55.35 0.77 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.322 . . . . 10.0 111.296 -178.497 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -56.4 -54.91 40.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.542 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 1.8 m -63.11 -28.61 70.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.996 0.426 . . . . 10.0 110.982 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 5.5 tp -65.24 -43.23 92.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 179.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -60.57 -46.92 88.41 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.441 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -58.44 -46.0 87.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.535 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 26.4 mmm-85 -56.92 -41.46 78.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.071 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 96.3 mt -66.9 -47.32 82.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.723 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 740' ' ' LEU . . . . . 0.54 HD21 ' HG2' ' A' ' 681' ' ' GLU . 60.1 tp -62.8 -51.4 67.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.815 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -60.49 -44.19 96.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.739 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -59.82 -35.62 75.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.626 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 20.3 m -69.16 -40.57 78.07 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.454 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 744' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 740' ' ' LEU . 76.3 mt -64.46 -38.59 82.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.312 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.18 -53.79 54.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.756 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 48.5 t -61.45 -37.29 77.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.422 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -60.63 -46.01 91.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.624 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -61.52 -39.84 92.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.847 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -62.1 -37.13 83.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.615 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -70.41 -39.56 74.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.096 0.474 . . . . 10.0 110.1 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 51.2 tt0 -59.89 -37.98 80.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.41 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -61.19 -24.61 66.44 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.888 0.329 . . . . 10.0 111.888 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 34.1 t -88.44 -46.08 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.84 0.352 . . . . 10.0 111.374 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.0 -39.17 50.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.91 0.386 . . . . 10.0 111.327 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.64 138.24 5.14 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.169 -0.772 . . . . 10.0 111.169 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 756' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -58.51 -60.63 3.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.86 0.362 . . . . 10.0 111.811 -178.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -66.71 -34.24 77.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.908 0.385 . . . . 10.0 110.74 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 8.4 tpt -63.68 -42.52 98.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.484 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 59.3 mmm -62.75 -41.72 99.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.331 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.3 mmp_? -58.2 -39.03 77.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.084 0.469 . . . . 10.0 110.3 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.89 -37.11 72.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.175 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -66.7 -48.81 68.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.024 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -58.42 -46.3 86.73 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.155 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 764' ' ' LYS . . . . . 0.471 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 79.2 tttt -59.48 -45.17 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.989 -0.551 . . . . 10.0 110.108 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.53 -43.28 99.25 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.758 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.1 -42.96 97.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.615 0.245 . . . . 10.0 110.416 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 31.3 mtp -61.43 -50.79 71.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.363 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 97.2 mt -61.04 -45.15 95.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.897 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 769' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' B' ' 24' ' ' ALA . 41.1 tt0 -59.53 -52.18 66.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.025 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 13.5 m -58.6 -45.94 88.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.758 0.313 . . . . 10.0 111.024 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 771' ' ' LEU . . . . . 0.455 HD21 HG13 ' A' ' 659' ' ' ILE . 7.1 tt -62.11 -46.05 90.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.466 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -62.75 -45.67 91.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.094 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 773' ' ' SER . . . . . 0.568 ' HB3' ' HB3' ' B' ' 22' ' ' MET . 15.7 m -63.44 -44.41 94.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.718 -0.674 . . . . 10.0 111.094 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 22.8 mt -65.73 -40.07 91.79 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.841 0.353 . . . . 10.0 110.838 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -59.9 -39.25 84.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.927 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.552 ' HE3' HD12 ' A' ' 372' ' ' LEU . 25.1 mttp -61.39 -48.67 80.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.289 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 12.6 tm-20 -65.87 -44.23 85.99 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -57.32 -33.5 67.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.471 -0.786 . . . . 10.0 111.426 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.6 mt -61.91 -53.67 52.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.745 0.307 . . . . 10.0 110.593 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -66.91 -40.31 87.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.801 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 781' ' ' ALA . . . . . 0.534 ' HB1' HG21 ' A' ' 304' ' ' ILE . . . -59.04 -43.95 91.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.762 -0.654 . . . . 10.0 111.495 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 63.2 mmm -61.38 -49.25 77.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.427 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 783' ' ' ASP . . . . . 0.539 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 10.4 t70 -66.19 -39.11 89.43 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.924 -0.31 . . . . 10.0 111.099 -179.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -61.05 -34.52 75.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.87 0.367 . . . . 10.0 110.92 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.3 tp -79.52 -33.98 41.58 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 178.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 786' ' ' ARG . . . . . 0.408 ' O ' HG12 ' A' ' 789' ' ' ILE . 48.5 ttt180 -62.68 -40.77 98.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.921 -1.036 . . . . 10.0 110.999 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 787' ' ' GLN . . . . . 0.539 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 10.7 pt20 -88.48 9.05 25.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.148 0.499 . . . . 10.0 110.474 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -114.72 31.11 6.5 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.9 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 789' ' ' ILE . . . . . 0.408 HG12 ' O ' ' A' ' 786' ' ' ARG . 23.7 mm -78.37 65.16 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 121.773 0.797 . . . . 10.0 110.438 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -127.21 -60.62 1.19 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.628 -0.878 . . . . 10.0 108.628 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 99.4 mt -87.28 -3.51 59.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.934 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -105.56 10.4 33.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.582 -0.736 . . . . 10.0 109.551 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -137.12 146.37 18.28 Favored Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 115.56 -0.746 . . . . 10.0 111.664 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -144.21 -174.49 4.3 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 110.461 -0.2 . . . . 10.0 110.461 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -77.16 158.66 30.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.319 -0.401 . . . . 10.0 111.125 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 67.22 15.8 10.07 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.284 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 9.8 tptm -139.47 145.93 39.41 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.076 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -98.23 143.49 26.38 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -52.65 -34.44 63.67 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.435 2.09 . . . . 10.0 112.074 178.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.76 154.56 33.91 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 74.87 -52.58 0.67 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.945 0.498 . . . . 10.0 109.786 -178.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -62.03 -51.37 68.27 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.157 -0.474 . . . . 10.0 109.955 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -62.31 -31.41 72.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.378 0.608 . . . . 10.0 109.972 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -67.4 -32.69 73.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.72 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 38.2 mtm105 -57.3 -47.52 81.28 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.251 0.548 . . . . 10.0 109.734 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.48 -43.69 76.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.389 -0.823 . . . . 10.0 110.756 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 17.2 m -60.29 -44.19 95.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.737 -0.665 . . . . 10.0 112.01 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -69.27 -43.17 74.45 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.159 -0.216 . . . . 10.0 110.89 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 19.4 m -61.73 -39.06 90.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.946 0.403 . . . . 10.0 110.261 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 37.4 ttm -64.01 -40.38 96.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.168 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -68.02 -40.35 82.95 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.387 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.19 91.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.369 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -63.03 -36.12 82.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.368 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 12.8 ttt -62.9 -45.47 92.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.446 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.9 -42.43 97.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.541 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -63.84 -37.39 87.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.432 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 37.4 m -72.3 -30.7 65.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.617 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 24.6 tp -56.97 -57.61 11.76 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.99 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 40.9 pttt -65.26 -32.48 74.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.959 0.409 . . . . 10.0 110.513 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -61.82 -58.4 8.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.934 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -62.9 -36.62 83.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.852 -178.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 39.9 t -61.58 -54.62 32.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 120.643 0.259 . . . . 10.0 110.655 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 41.1 mm -63.42 -38.99 83.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.698 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 40.7 t -60.23 -50.69 72.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.738 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 28.5 m -59.43 -45.76 90.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.703 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 92.8 mt -62.32 -24.86 67.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 10.0 112.047 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 6.6 m -94.59 -37.86 11.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.687 0.279 . . . . 10.0 111.403 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 828' ' ' LYS . . . . . 0.485 ' HA ' ' HB2' ' A' ' 715' ' ' ASP . 29.4 mtpp -69.29 -25.42 64.24 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.536 0.569 . . . . 10.0 112.536 -178.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.08 115.34 9.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.43 0.634 . . . . 10.0 110.404 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -100.97 140.15 35.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.898 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 6.9 m -130.65 174.75 12.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.081 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 13.5 ptt-85 -73.26 100.4 3.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.117 0.484 . . . . 10.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 1.6 ttp -106.32 103.63 46.53 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.137 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -78.82 -175.35 2.7 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.679 2.253 . . . . 10.0 111.613 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -66.78 125.02 24.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.029 0.442 . . . . 10.0 110.585 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.555 -0.736 . . . . 10.0 109.73 179.715 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.1 tmm? . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.799 -0.445 . . . . 10.0 109.799 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -74.81 152.56 38.98 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.639 0.257 . . . . 10.0 110.318 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 19.7 mt -81.15 78.73 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.376 0.608 . . . . 10.0 110.04 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 7.3 m -90.56 103.83 16.48 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.624 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 89.7 mt -74.12 77.52 1.75 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.133 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.15 134.62 43.91 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.145 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -92.06 134.25 35.0 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.041 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 13.6 mtm-85 -86.5 -142.59 0.1 Allowed 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.825 -0.805 . . . . 10.0 108.825 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 -85.25 158.12 20.41 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.785 -0.766 . . . . 10.0 109.97 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 13.9 ptpt -59.48 156.68 12.68 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.385 0.612 . . . . 10.0 112.472 -178.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mp -114.71 100.52 53.43 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.569 -0.741 . . . . 10.0 110.397 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -73.43 71.7 3.75 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.665 2.243 . . . . 10.0 111.783 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 36.4 mt -119.91 -88.4 0.62 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.211 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' ALA . . . . . 0.592 ' HB3' ' HB ' ' A' ' 291' ' ' ILE . . . -76.82 -21.55 54.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.986 0.422 . . . . 10.0 110.802 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -69.57 -21.35 24.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.278 0.561 . . . . 10.0 109.848 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.2 -16.96 60.96 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.747 -0.661 . . . . 10.0 110.263 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 78.5 t -63.66 -32.67 57.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.092 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ALA . . . . . 0.481 ' HB2' HD11 ' A' ' 306' ' ' LEU . . . -64.19 -41.4 97.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.137 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.6 -12.66 60.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.721 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' GLY . . . . . 0.502 ' HA3' ' SD ' ' A' ' 235' ' ' MET . . . -71.71 -33.67 63.25 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 111.563 -0.615 . . . . 10.0 111.563 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 10.9 t -69.36 -22.12 25.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.773 0.797 . . . . 10.0 109.424 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.568 ' HB3' ' HB3' ' A' ' 773' ' ' SER . 27.8 mtt -92.59 56.02 2.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.981 -1.009 . . . . 10.0 110.379 -179.31 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 74.4 m -85.86 95.61 9.5 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.278 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 769' ' ' GLN . . . -156.74 56.86 0.54 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.265 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -83.34 141.83 31.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.824 -179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -76.88 -14.82 59.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.946 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 12.9 tpt -72.46 140.01 48.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.457 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.456 -0.783 . . . . 10.0 110.687 -179.985 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -68.11 130.38 42.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.728 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 142.43 163.26 9.6 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.804 -0.713 . . . . 10.0 112.157 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.94 160.57 9.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.795 0.331 . . . . 10.0 110.692 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.566 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 3.9 mmp_? -77.05 146.52 37.26 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 60.63 -89.88 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.93 -1.032 . . . . 10.0 113.685 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -46.22 -62.9 1.14 Allowed 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.905 1.076 . . . . 10.0 113.905 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 16' ' ' ARG . 4.9 tpt180 -66.17 -31.67 72.66 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -178.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.403 ' O ' ' HG3' ' A' ' 21' ' ' MET . 0.2 OUTLIER -66.46 -48.77 68.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.726 0.298 . . . . 10.0 110.899 -179.835 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.92 -36.18 78.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.364 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -47.01 87.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.86 0.362 . . . . 10.0 110.375 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 20' ' ' ARG . 2.6 ttp85 -67.21 -33.85 76.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.095 0.474 . . . . 10.0 110.354 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.683 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 62.1 mtt -69.86 -37.4 76.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.334 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.7 tpp180 -62.07 -33.73 74.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.111 -0.495 . . . . 10.0 109.996 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -63.21 -41.14 99.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.766 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.6 t -68.2 -36.65 76.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.659 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.434 HG13 HD12 ' A' ' 88' ' ' LEU . 46.2 t -60.24 -37.59 74.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.078 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -62.55 -38.92 91.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.581 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.9 mt -68.12 -42.54 85.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.938 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 79.1 mt -60.78 -39.55 82.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.288 0.565 . . . . 10.0 109.843 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -67.86 -21.97 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.819 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -86.45 -23.1 26.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.58 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.9 mmt -84.77 -23.01 29.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.616 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.61 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 16.3 tt0 -55.84 -52.11 75.0 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 112.423 0.527 . . . . 10.0 112.423 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 75.8 Cg_exo -52.23 -37.41 70.24 Favored 'Trans proline' 0 C--N 1.361 1.195 0 C-N-CA 121.957 1.771 . . . . 10.0 112.399 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -72.32 -39.06 68.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.393 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 22.7 mmt -65.42 -39.29 91.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.593 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.61 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 28.7 mt-10 -63.92 -25.22 68.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.257 0.551 . . . . 10.0 110.06 178.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -82.33 -30.68 30.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.078 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.3 mp -73.25 148.42 43.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.474 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.6 p -75.45 167.42 21.93 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.387 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.9 -37.51 87.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.53 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -68.92 -32.52 72.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.511 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -66.37 -33.72 76.35 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.508 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.32 -46.12 88.15 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.7 ttpt -61.92 -34.13 75.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.08 -0.964 . . . . 10.0 109.481 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.06 -34.37 86.47 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.684 -0.689 . . . . 10.0 111.421 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -66.54 -36.2 82.09 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.024 -0.362 . . . . 10.0 110.024 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.7 m -61.7 -45.68 92.93 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.158 0.504 . . . . 10.0 109.647 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.11 -33.41 75.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.775 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -60.7 -47.7 85.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.292 -0.867 . . . . 10.0 110.284 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -61.42 -41.12 96.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.976 0.417 . . . . 10.0 109.979 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -59.06 -40.27 84.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.529 -0.759 . . . . 10.0 110.402 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -77.59 -36.47 51.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.368 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.42 HH12 ' CD ' ' A' ' 66' ' ' GLU . 63.2 mtp180 -64.68 -31.19 72.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.519 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.1 mt -60.4 -31.99 70.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.844 0.354 . . . . 10.0 110.8 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.5 -28.43 66.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.502 . . . . 10.0 110.479 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -76.23 -14.53 60.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.658 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 110.32 22.36 6.51 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.805 -0.712 . . . . 10.0 112.287 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -73.22 144.43 46.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.785 0.326 . . . . 10.0 110.153 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.0 t -86.86 136.72 22.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.164 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.42 HD11 ' O ' ' A' ' 118' ' ' LEU . 13.9 tp -62.34 -39.64 93.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.108 0.48 . . . . 10.0 110.1 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -69.87 -16.48 63.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.21 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -90.9 -15.3 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.403 0.62 . . . . 10.0 110.259 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.0 mt -86.42 -11.98 50.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.104 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.504 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 85.0 mt -50.38 -51.89 59.72 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 113.459 0.911 . . . . 10.0 113.459 -178.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.504 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 52.2 Cg_exo -53.12 -35.89 74.62 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 122.164 1.91 . . . . 10.0 113.488 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.488 ' O ' HG23 ' A' ' 70' ' ' VAL . 44.5 mt-10 -89.74 -45.45 9.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.724 0.297 . . . . 10.0 111.507 -179.027 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.496 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -60.1 -47.88 84.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.232 -0.44 . . . . 10.0 112.142 -178.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -64.12 -30.67 71.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.721 0.296 . . . . 10.0 110.67 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.13 -43.95 81.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 10.0 109.965 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 66' ' ' GLU . 47.5 t -61.33 -43.58 96.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.827 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 67' ' ' ALA . 45.9 t -62.01 -46.19 97.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.318 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.438 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 11.6 ttm180 -60.64 -41.54 95.14 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.18 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.511 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 18.9 tp10 -63.95 -50.87 66.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.575 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.49 -33.33 71.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.035 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 46.3 m -59.32 -42.82 92.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.282 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.511 ' HE2' ' HA ' ' A' ' 73' ' ' GLU . 40.1 mtmt -73.19 -16.98 61.41 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.299 0.481 . . . . 10.0 112.299 -178.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 -100.13 -37.13 9.08 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.993 -0.283 . . . . 10.0 111.636 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 85.5 t -82.96 -51.45 14.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 120.785 0.326 . . . . 10.0 111.796 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -99.71 -38.31 8.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.928 0.394 . . . . 10.0 111.206 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.39 4.43 49.95 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.94 -0.648 . . . . 10.0 111.517 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 63.9 mtt -111.26 138.13 48.11 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -90.48 135.32 33.77 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.857 0.36 . . . . 10.0 110.673 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.68 112.15 4.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.854 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -59.14 152.83 19.47 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.25 0.547 . . . . 10.0 111.778 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -61.82 -36.55 81.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.286 -0.87 . . . . 10.0 111.644 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.6 m -64.67 -31.62 54.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.06 0.457 . . . . 10.0 110.894 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -73.21 -27.9 61.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.281 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.434 HD12 HG13 ' A' ' 25' ' ' VAL . 97.7 mt -66.28 -33.88 76.73 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.718 -0.475 . . . . 10.0 109.718 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.91 -50.07 67.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.471 178.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -62.56 -32.5 83.48 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.317 -0.856 . . . . 10.0 112.066 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -60.21 -36.4 90.62 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 121.06 -0.591 . . . . 10.0 112.196 179.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.683 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 25.0 ttm -74.9 -36.15 62.23 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.4 t -64.41 -41.74 93.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.152 0.501 . . . . 10.0 109.958 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 91.4 mt -73.95 -4.43 35.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.672 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -91.43 -21.36 21.0 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.242 0.544 . . . . 10.0 109.948 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -105.47 -174.26 2.49 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.827 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -83.56 67.59 9.46 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.135 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 74.2 m -149.2 166.86 27.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.138 0.494 . . . . 10.0 111.731 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.586 HD12 HG11 ' A' ' 211' ' ' VAL . 35.8 mm -113.26 135.5 52.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.173 178.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -110.3 124.8 52.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.923 0.392 . . . . 10.0 111.824 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.31 129.26 36.56 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 108' ' ' LYS . 2.9 ttt -136.12 135.98 39.73 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.895 0.378 . . . . 10.0 111.082 -179.134 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.435 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 13.6 mmm180 -67.96 152.37 45.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.088 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.68 96.33 1.58 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.762 -0.653 . . . . 10.0 111.509 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 138.88 -15.5 3.31 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.382 -0.913 . . . . 10.0 113.537 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -84.23 27.22 0.7 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.978 0.362 . . . . 10.0 111.978 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.71 56.06 16.79 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.561 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.458 ' HA ' ' SD ' ' A' ' 102' ' ' MET . 50.6 tttm -55.38 -50.83 68.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.853 0.358 . . . . 10.0 111.745 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -24.65 63.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.947 0.403 . . . . 10.0 111.829 -179.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 21.2 tp -72.52 -31.64 65.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.867 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 19.0 m -71.41 -28.56 64.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.851 0.358 . . . . 10.0 111.7 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.81 66.13 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.771 1.026 . . . . 10.0 113.771 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 17.0 p -75.46 -22.39 57.32 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.319 0.489 . . . . 10.0 112.319 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 48.4 mt -68.26 -57.68 8.59 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 112.338 0.496 . . . . 10.0 112.338 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -64.63 -28.39 60.85 Favored 'Trans proline' 0 C--N 1.356 0.965 0 C-N-CA 122.055 1.837 . . . . 10.0 112.032 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.34 -49.26 67.54 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.458 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -62.43 -45.88 91.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.896 0.379 . . . . 10.0 110.685 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.42 ' O ' HD11 ' A' ' 60' ' ' LEU . 25.8 tp -59.45 -50.27 74.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.788 -0.642 . . . . 10.0 111.842 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -75.71 -19.13 59.3 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.897 0.332 . . . . 10.0 111.897 -178.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.7 -26.73 65.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.889 0.376 . . . . 10.0 110.942 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 47.6 mt -61.2 -23.02 65.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.561 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.2 p -69.74 -24.22 63.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.869 0.366 . . . . 10.0 110.831 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.35 9.7 81.49 Favored Glycine 0 C--N 1.333 0.389 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.656 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -86.59 -11.78 50.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.702 0.287 . . . . 10.0 111.525 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.08 110.84 2.6 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.5 -0.857 . . . . 10.0 113.834 178.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 62.1 t -84.59 114.56 25.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -93.11 104.07 16.3 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.943 0.402 . . . . 10.0 111.034 -178.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 39.2 t -93.48 123.9 45.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.204 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 96.3 t -105.2 121.92 57.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.993 -179.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 2.7 p -108.83 165.36 11.62 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.459 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 15.5 m -75.9 -29.83 20.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.85 0.357 . . . . 10.0 111.529 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -145.04 168.54 20.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.405 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.08 -23.09 63.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.166 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -58.73 -52.5 65.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.569 -0.741 . . . . 10.0 110.646 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 30.5 mt -69.47 -35.68 75.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.716 0.293 . . . . 10.0 110.461 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.43 -50.89 71.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.05 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.29 -36.41 61.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.018 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.44 HH21 ' CG ' ' A' ' 139' ' ' ASP . 5.9 ttp85 -56.33 -58.88 6.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.523 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ASP . . . . . 0.44 ' CG ' HH21 ' A' ' 138' ' ' ARG . 1.5 m-20 -69.36 -31.97 70.73 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.08 -0.509 . . . . 10.0 112.019 -178.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.493 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -60.87 -37.89 83.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.762 0.315 . . . . 10.0 111.214 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.2 mm-40 -91.59 -28.86 17.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.486 -0.325 . . . . 10.0 111.487 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -74.59 -43.86 53.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.827 0.346 . . . . 10.0 111.383 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 40.3 m-20 -88.41 -0.89 57.68 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.072 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 53.3 ttm-85 -61.69 -49.93 84.26 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.591 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' PRO . . . . . 0.47 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 17.2 Cg_exo -68.86 5.02 1.51 Allowed 'Trans proline' 0 C--N 1.361 1.218 0 C-N-CA 122.353 2.035 . . . . 10.0 112.504 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.6 tp -105.93 -52.45 2.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.726 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -73.86 -46.48 44.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.499 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.428 ' HA ' ' O ' ' A' ' 152' ' ' LEU . 82.3 mt-10 -68.91 -19.65 64.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.883 0.373 . . . . 10.0 111.047 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -73.39 -24.24 60.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.302 0.573 . . . . 10.0 109.556 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 71.4 mt -96.56 -11.18 25.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.938 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 114.99 -6.63 21.83 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.509 -0.853 . . . . 10.0 113.592 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 148' ' ' GLU . 92.4 mt -80.89 144.95 31.58 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.167 0.484 . . . . 10.0 110.733 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.1 p -95.39 133.15 39.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.508 -0.315 . . . . 10.0 111.108 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 35.2 t -108.97 130.73 61.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.441 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -124.98 145.53 15.74 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 111.665 -0.574 . . . . 10.0 111.665 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 4.2 tp -119.08 129.16 75.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.962 0.41 . . . . 10.0 110.511 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -114.26 112.67 23.48 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.162 -0.472 . . . . 10.0 109.999 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 49.3 mt -109.46 148.98 39.19 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.384 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' PRO . . . . . 0.486 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 19.0 Cg_endo -58.3 121.24 9.65 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.753 2.302 . . . . 10.0 112.539 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.2 6.74 62.79 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.928 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' MET . . . . . 0.449 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 44.2 ttm -67.31 139.07 94.56 Favored Pre-proline 0 C--N 1.325 -0.473 0 C-N-CA 122.049 0.14 . . . . 10.0 110.96 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 162' ' ' PRO . . . . . 0.408 ' HD2' ' HG3' ' A' ' 161' ' ' MET . 71.9 Cg_exo -52.69 147.32 31.65 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.885 2.39 . . . . 10.0 112.367 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' ALA . . . . . 0.459 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -54.47 -48.75 94.04 Favored Pre-proline 0 CA--C 1.54 0.563 0 N-CA-C 112.785 0.661 . . . . 10.0 112.785 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.459 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.8 Cg_exo -57.65 -42.33 61.36 Favored 'Trans proline' 0 C--N 1.358 1.062 0 C-N-CA 121.946 1.764 . . . . 10.0 112.346 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -64.96 -41.7 95.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.836 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.449 ' HE2' ' O ' ' A' ' 161' ' ' MET . 60.8 mttm -58.91 -43.5 91.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.137 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -58.13 -40.61 81.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.932 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -68.48 -40.65 80.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.682 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -65.86 -43.01 89.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.351 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' TYR . . . . . 0.431 ' HD2' ' O ' ' A' ' 166' ' ' LYS . 42.1 m-85 -74.34 -22.79 59.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.998 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.19 -14.37 59.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.654 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -71.58 173.14 8.43 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.305 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -74.72 -39.43 61.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.286 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.0 mp -127.61 121.35 56.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.883 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 6.4 m -112.36 111.98 23.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.847 0.356 . . . . 10.0 111.359 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -91.34 133.34 35.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.101 -0.5 . . . . 10.0 109.692 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -167.72 179.55 41.03 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.347 -0.93 . . . . 10.0 112.838 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.09 152.16 21.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.541 0.21 . . . . 10.0 110.549 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -60.47 -41.38 94.07 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.953 0.353 . . . . 10.0 111.953 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -56.46 -50.95 70.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.709 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.486 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 3.8 tp10 -70.71 -38.49 73.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.91 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -56.81 -39.44 74.17 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.861 0.363 . . . . 10.0 111.152 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -70.72 -44.33 57.18 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.821 -0.704 . . . . 10.0 112.242 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -67.17 -35.28 79.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.915 0.388 . . . . 10.0 110.738 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 185' ' ' ASP . . . . . 0.435 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 6.8 m-20 -59.16 -44.62 92.14 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.689 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -62.85 -38.22 89.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.466 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 187' ' ' LEU . . . . . 0.471 HD22 ' HB1' ' A' ' 373' ' ' ALA . 54.2 mt -62.65 -47.19 84.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.514 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 188' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 188' ' ' ARG . 42.4 mtm-85 -67.27 -40.7 86.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 10.0 110.491 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.11 -49.12 78.88 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.395 -0.821 . . . . 10.0 111.608 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.66 -3.6 47.98 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.784 -0.644 . . . . 10.0 112.656 -178.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 23.0 ttp -104.21 4.0 33.44 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.879 0.371 . . . . 10.0 110.966 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -69.72 174.01 5.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.82 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -109.34 -21.59 12.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.053 0.454 . . . . 10.0 110.601 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.05 142.33 45.2 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.871 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 195' ' ' PRO . . . . . 0.409 ' HD3' ' O ' ' A' ' 667' ' ' LEU . 13.2 Cg_endo -57.72 -30.18 88.19 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.811 2.341 . . . . 10.0 112.721 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -69.91 -17.5 63.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.963 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -83.14 -13.03 56.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.302 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -56.09 157.74 4.43 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.382 0.426 . . . . 10.0 111.426 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 8.2 m -128.57 -25.26 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.228 -0.442 . . . . 10.0 112.007 -179.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -92.77 -178.2 4.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.065 0.459 . . . . 10.0 111.361 -179.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -134.03 -178.2 4.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.765 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 17.4 ttmm -57.32 131.8 51.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.274 0.559 . . . . 10.0 111.593 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 12.5 mt -82.65 74.57 9.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.158 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -84.33 -63.45 1.34 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.94 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -128.3 137.28 51.88 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.065 0.459 . . . . 10.0 111.731 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.468 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -129.71 127.59 40.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.364 -0.835 . . . . 10.0 109.984 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 61.8 tp -119.79 108.9 14.96 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.08 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.3 p -98.75 131.26 46.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 CA-C-O 121.048 0.452 . . . . 10.0 110.776 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -59.05 -66.21 0.54 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.614 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 210' ' ' GLU . . . . . 0.521 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 34.3 tt0 -112.3 111.05 21.64 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.833 0.349 . . . . 10.0 110.577 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.586 HG11 HD12 ' A' ' 99' ' ' ILE . 34.3 m -82.34 -18.59 10.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.844 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 212' ' ' ASP . . . . . 0.418 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.0 OUTLIER -51.82 -57.49 9.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.173 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 213' ' ' SER . . . . . 0.408 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 4.9 p -88.61 -59.17 2.3 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.965 -0.561 . . . . 10.0 112.051 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 69.2 mt -52.73 -38.31 27.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 113.913 1.079 . . . . 10.0 113.913 -177.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 215' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 211' ' ' VAL . 8.0 mt -96.47 -53.79 3.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.933 0.716 . . . . 10.0 112.933 -178.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 216' ' ' ILE . . . . . 0.418 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 46.7 mm -75.91 -57.15 6.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 113.064 0.764 . . . . 10.0 113.064 -177.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 217' ' ' ASP . . . . . 0.408 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 67.0 m-20 -64.22 -42.7 96.48 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.035 0.383 . . . . 10.0 112.035 -178.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -90.09 16.65 8.04 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 -178.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.88 -38.69 91.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.883 0.373 . . . . 10.0 111.071 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 220' ' ' ARG . . . . . 0.412 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 3.5 mtp-105 -106.13 31.68 4.95 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.308 -0.406 . . . . 10.0 111.488 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 33.9 m -105.12 102.99 39.56 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 222' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 72.5 Cg_endo -94.95 129.38 0.48 Allowed 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.095 2.53 . . . . 10.0 113.473 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 223' ' ' LEU . . . . . 0.475 ' O ' ' HA ' ' A' ' 374' ' ' SER . 86.9 mt -82.91 110.87 18.27 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 77.0 mt -108.33 125.95 65.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 65.8 mt -96.28 111.92 27.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 108.578 -0.897 . . . . 10.0 108.578 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 20.1 m -86.47 148.56 25.49 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.784 0.326 . . . . 10.0 111.144 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -167.46 92.22 0.1 Allowed Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.828 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 228' ' ' PRO . . . . . 0.429 ' HA ' ' OE1' ' A' ' 370' ' ' GLN . 9.5 Cg_exo -71.7 119.57 6.31 Favored 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 122.862 2.375 . . . . 10.0 112.781 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 229' ' ' ALA . . . . . 0.489 ' O ' ' HA ' ' B' ' 21' ' ' VAL . . . -154.94 80.89 1.08 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.964 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 68.11 176.93 0.26 Allowed 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.738 0.648 . . . . 10.0 110.359 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -168.85 -82.57 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.004 0.431 . . . . 10.0 110.361 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 236' ' ' TYR . 15.1 m -140.63 38.42 1.84 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.462 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 1.4 p -56.12 -75.07 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.899 -179.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -69.11 -23.08 63.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.281 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 22.0 ttm -66.23 -55.04 18.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.588 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 236' ' ' TYR . . . . . 0.521 ' HB3' ' HB2' ' A' ' 359' ' ' ALA . 0.5 OUTLIER -61.25 -36.93 81.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.598 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 237' ' ' LYS . . . . . 0.459 ' O ' ' HD3' ' A' ' 241' ' ' LYS . 64.8 mmtt -65.49 -15.35 62.57 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.021 -0.536 . . . . 10.0 112.326 -179.115 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 34.2 tpt85 -108.7 -33.32 7.03 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.836 -0.346 . . . . 10.0 110.875 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 239' ' ' VAL . . . . . 0.415 ' O ' HG23 ' A' ' 242' ' ' ILE . 89.7 t -75.96 -40.19 37.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.949 0.404 . . . . 10.0 111.083 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.58 22.41 0.35 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.591 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 241' ' ' LYS . . . . . 0.459 ' HD3' ' O ' ' A' ' 237' ' ' LYS . 1.8 mptm? -112.82 15.97 19.66 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.616 0.228 . . . . 10.0 111.616 -179.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 242' ' ' ILE . . . . . 0.457 HD13 ' H ' ' A' ' 242' ' ' ILE . 0.2 OUTLIER -90.3 -11.35 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-O 120.955 0.407 . . . . 10.0 111.005 179.763 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 243' ' ' ILE . . . . . 0.43 ' HB ' ' HD3' ' A' ' 244' ' ' PRO . 44.8 mt -58.38 -47.06 99.48 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.952 0.723 . . . . 10.0 112.952 -179.283 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 244' ' ' PRO . . . . . 0.43 ' HD3' ' HB ' ' A' ' 243' ' ' ILE . 23.9 Cg_exo -66.14 -0.34 4.03 Favored 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 122.165 1.91 . . . . 10.0 113.78 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -105.07 6.47 33.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.038 0.447 . . . . 10.0 110.271 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 18.9 mt -98.53 167.87 10.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.221 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 247' ' ' ILE . . . . . 0.422 ' O ' ' HG3' ' A' ' 248' ' ' ARG . 2.4 mt -121.35 14.5 6.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.652 0.263 . . . . 10.0 111.209 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 248' ' ' ARG . . . . . 0.494 ' HA ' ' CG ' ' A' ' 253' ' ' ASP . 3.4 ptm180 40.67 77.51 0.05 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.951 0.9 . . . . 10.0 112.397 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -171.12 -44.97 0.02 OUTLIER 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.985 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 250' ' ' GLU . . . . . 0.461 ' O ' ' HE2' ' A' ' 251' ' ' LYS . 1.6 tt0 -153.25 128.8 10.0 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.823 0.305 . . . . 10.0 111.823 -179.135 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.461 ' HE2' ' O ' ' A' ' 250' ' ' GLU . 0.1 OUTLIER 72.73 130.11 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.112 0.883 . . . . 10.0 112.953 177.412 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 252' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 68.18 -58.39 0.46 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.661 -1.154 . . . . 10.0 113.34 178.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 253' ' ' ASP . . . . . 0.494 ' CG ' ' HA ' ' A' ' 248' ' ' ARG . 1.3 p30 -70.65 -34.39 72.0 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.663 0.246 . . . . 10.0 111.663 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.91 130.24 35.11 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.148 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 255' ' ' GLU . . . . . 0.468 ' HG2' HG23 ' A' ' 256' ' ' THR . 0.6 OUTLIER -85.06 -32.51 22.82 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.839 0.352 . . . . 10.0 110.37 -179.565 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 256' ' ' THR . . . . . 0.468 HG23 ' HG2' ' A' ' 255' ' ' GLU . 6.2 p -124.8 -90.95 0.55 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.688 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 18.7 t80 58.32 -91.35 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.309 -0.86 . . . . 10.0 111.072 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 53.69 29.38 9.34 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.134 0.492 . . . . 10.0 111.429 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 112.72 -47.8 1.0 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.807 -0.711 . . . . 10.0 112.73 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -118.28 -72.46 0.69 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.958 0.408 . . . . 10.0 110.276 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 83.87 -91.56 1.64 Allowed Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.777 -0.725 . . . . 10.0 113.435 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -145.32 172.77 12.68 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.464 0.173 . . . . 10.0 110.559 -178.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -88.8 -175.43 4.88 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.363 -0.381 . . . . 10.0 110.518 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 9.9 m -73.59 97.03 2.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.159 0.504 . . . . 10.0 112.117 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 265' ' ' VAL . . . . . 0.539 HG23 ' H ' ' A' ' 266' ' ' ASP . 0.0 OUTLIER -150.41 -70.1 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.504 178.432 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 266' ' ' ASP . . . . . 0.539 ' H ' HG23 ' A' ' 265' ' ' VAL . 34.7 t70 -169.88 129.81 0.98 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.678 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -76.62 85.15 3.28 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 268' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 318' ' ' ALA . 2.4 ttmp? -157.71 83.26 0.89 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.781 -179.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 10.6 m -76.64 85.0 3.3 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.258 0.552 . . . . 10.0 109.933 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -60.72 -20.34 60.95 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.41 -0.814 . . . . 10.0 111.306 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -74.95 -9.77 58.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.017 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 272' ' ' VAL . . . . . 0.526 HG12 ' H ' ' A' ' 274' ' ' LEU . 21.8 t 67.72 -81.7 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 C-N-CA 123.122 0.569 . . . . 10.0 110.776 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 1.2 t30 59.66 29.99 19.58 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 122.73 0.412 . . . . 10.0 111.467 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 274' ' ' LEU . . . . . 0.526 ' H ' HG12 ' A' ' 272' ' ' VAL . 9.3 tp 58.58 -142.76 0.65 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.243 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 7.7 t -167.93 166.49 13.32 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 121.324 -0.15 . . . . 10.0 110.793 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 55.46 104.09 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.329 0 O-C-N 124.315 1.009 . . . . 10.0 112.743 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.23 16.06 11.46 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.32 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . -123.57 -24.52 1.92 Allowed Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.446 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 90.4 mt 62.04 57.09 2.15 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.198 0.523 . . . . 10.0 110.826 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 280' ' ' VAL . . . . . 0.427 ' H ' ' H ' ' A' ' 281' ' ' LEU . 9.6 p -159.1 -13.3 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.849 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 281' ' ' LEU . . . . . 0.427 ' H ' ' H ' ' A' ' 280' ' ' VAL . 7.7 mp -79.64 -47.44 15.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.93 0.395 . . . . 10.0 109.995 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 30.5 pt -72.39 1.48 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.589 -0.732 . . . . 10.0 112.159 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.72 -33.79 72.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.891 0.377 . . . . 10.0 110.401 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -77.22 -15.54 59.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.251 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.09 -31.32 62.77 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 178.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 77.2 mt -65.84 161.28 21.37 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.67 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 287' ' ' VAL . . . . . 0.411 ' O ' ' HG2' ' A' ' 288' ' ' LYS . 41.0 t 70.02 154.31 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 115.639 -0.709 . . . . 10.0 110.668 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 288' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 287' ' ' VAL . 0.0 OUTLIER 72.04 176.11 0.28 Allowed 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.845 0.858 . . . . 10.0 111.527 179.368 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 289' ' ' GLU . . . . . 0.446 ' HA ' ' OE1' ' A' ' 289' ' ' GLU . 4.8 mm-40 72.11 -78.44 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.357 0.663 . . . . 10.0 111.728 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 290' ' ' GLY . . . . . 0.465 ' O ' ' HB ' ' A' ' 291' ' ' ILE . . . 153.44 155.1 7.02 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.571 -0.823 . . . . 10.0 112.04 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 291' ' ' ILE . . . . . 0.465 ' HB ' ' O ' ' A' ' 290' ' ' GLY . 26.3 mm 75.53 127.56 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 C-N-CA 123.001 0.52 . . . . 10.0 109.869 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER 67.77 26.82 7.65 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -77.43 58.09 1.64 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.789 -1.096 . . . . 10.0 111.162 -179.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -152.06 -163.9 1.84 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.47 -0.786 . . . . 10.0 109.615 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -81.61 79.54 1.83 Allowed Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.545 -0.836 . . . . 10.0 111.777 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -142.41 -179.43 6.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.596 0.236 . . . . 10.0 110.568 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 8.6 t -117.6 -171.19 2.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.851 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 307' ' ' MET . 26.6 tp -104.33 -14.95 15.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.213 -0.448 . . . . 10.0 111.442 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 50.2 p90 -110.37 16.65 21.5 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.765 -0.374 . . . . 10.0 111.356 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 1.4 m -59.63 131.36 88.44 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.334 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.75 -11.9 33.79 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.843 2.362 . . . . 10.0 112.32 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 302' ' ' ALA . . . . . 0.407 ' HA ' ' HA ' ' A' ' 810' ' ' MET . . . -77.02 -13.04 60.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.287 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 303' ' ' ASN . . . . . 0.511 HD21 ' HB2' ' A' ' 306' ' ' LEU . 18.1 t30 -143.16 92.47 2.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.071 0.462 . . . . 10.0 110.597 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 1.8 tp -98.8 -21.87 5.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.332 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 2.0 tpt -60.43 -53.06 62.12 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.273 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 306' ' ' LEU . . . . . 0.511 ' HB2' HD21 ' A' ' 303' ' ' ASN . 3.0 mm? -76.04 -32.74 59.49 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.929 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 307' ' ' MET . . . . . 0.445 ' HG3' ' O ' ' A' ' 298' ' ' LEU . 0.1 OUTLIER -62.27 -38.06 87.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.922 0.391 . . . . 10.0 111.155 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -80.42 -6.65 58.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.546 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 64.8 m170 -95.97 -36.3 11.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.627 -0.26 . . . . 10.0 110.545 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 26.9 m -69.47 -32.31 52.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.821 0.343 . . . . 10.0 110.473 179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.14 -23.8 57.88 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.397 0.618 . . . . 10.0 110.248 179.078 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 312' ' ' ALA . . . . . 0.481 ' O ' ' HG2' ' A' ' 315' ' ' ARG . . . -68.15 -33.79 75.14 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.311 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -65.78 -29.77 70.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.338 0.59 . . . . 10.0 110.201 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 9.2 mp -74.08 -43.19 58.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.573 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 315' ' ' ARG . . . . . 0.481 ' HG2' ' O ' ' A' ' 312' ' ' ALA . 36.0 ptt180 -71.09 -23.03 62.03 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.922 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -89.41 13.9 12.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.375 0.607 . . . . 10.0 110.1 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -129.67 -39.67 1.43 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.94 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 318' ' ' ALA . . . . . 0.549 ' O ' ' HG3' ' A' ' 268' ' ' LYS . . . -105.25 -35.97 7.38 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.351 0.5 . . . . 10.0 112.351 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 319' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 319' ' ' LEU . 3.3 mm? -84.37 -65.81 0.97 Allowed 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 121.041 -0.264 . . . . 10.0 111.282 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -83.44 115.93 22.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.007 0.432 . . . . 10.0 110.275 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 321' ' ' THR . . . . . 0.613 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 0.3 OUTLIER -101.69 130.37 48.05 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.42 -179.3 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 322' ' ' ARG . . . . . 0.577 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 2.2 tpt180 -65.59 139.7 58.46 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.471 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 323' ' ' ASP . . . . . 0.577 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 25.5 m-20 85.48 -14.59 0.56 Allowed 'General case' 0 N--CA 1.477 0.892 0 O-C-N 124.442 1.089 . . . . 10.0 113.443 178.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 324' ' ' VAL . . . . . 0.613 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 2.2 p -121.45 -47.07 2.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 C-N-CA 120.579 -0.449 . . . . 10.0 111.088 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -88.95 -34.7 16.8 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.407 0.622 . . . . 10.0 110.164 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -148.16 145.6 28.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.753 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 14.4 tt -133.24 110.11 14.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 121.545 0.688 . . . . 10.0 110.036 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 328' ' ' VAL . . . . . 0.541 HG21 ' HG3' ' A' ' 361' ' ' GLU . 41.4 t -95.63 114.13 31.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.857 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -138.07 134.24 34.48 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.804 -0.634 . . . . 10.0 110.323 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 62.53 20.95 12.32 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.372 0.42 . . . . 10.0 111.303 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 87.71 2.74 81.43 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.535 -0.84 . . . . 10.0 112.224 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -99.54 123.91 44.24 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 110.315 -0.254 . . . . 10.0 110.315 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 25.9 t -91.19 97.79 7.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 26.6 mt -99.56 128.43 51.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.684 -179.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 335' ' ' ILE . . . . . 0.434 HD12 ' HB3' ' A' ' 347' ' ' ARG . 52.9 mt -91.49 133.2 33.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.664 -0.495 . . . . 10.0 109.664 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 336' ' ' VAL . . . . . 0.412 ' HB ' ' O ' ' A' ' 324' ' ' VAL . 2.9 t -112.39 112.13 39.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.964 0.411 . . . . 10.0 111.186 -178.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -71.2 123.68 22.76 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.5 -5.51 59.18 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.033 0.383 . . . . 10.0 112.033 -178.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 31.5 m80 -80.2 -50.54 10.12 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.97 -0.292 . . . . 10.0 111.539 -179.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 38.7 p -116.46 -2.82 11.95 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 69.55 55.9 9.28 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.667 -0.777 . . . . 10.0 111.618 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -115.94 123.4 47.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.823 0.344 . . . . 10.0 111.38 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.84 103.64 15.44 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.198 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 59.5 mtt -102.31 110.13 22.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.585 -179.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -88.98 -25.76 21.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.944 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -106.52 65.1 0.27 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.645 -0.788 . . . . 10.0 112.164 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 347' ' ' ARG . . . . . 0.434 ' HB3' HD12 ' A' ' 335' ' ' ILE . 1.2 tmt_? -140.57 125.16 17.93 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.673 -0.491 . . . . 10.0 109.673 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -101.35 163.39 12.3 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.851 -0.425 . . . . 10.0 109.851 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 349' ' ' TRP . . . . . 0.431 ' HB3' ' HB2' ' A' ' 353' ' ' LEU . 12.4 m95 -145.78 120.69 9.98 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.217 -0.29 . . . . 10.0 110.217 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.24 178.88 1.35 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.82 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 9.1 t70 68.66 2.32 3.39 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.255 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 74.2 33.55 56.63 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.836 -0.697 . . . . 10.0 112.265 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 353' ' ' LEU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 349' ' ' TRP . 82.6 mt -59.16 -47.83 83.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.848 0.356 . . . . 10.0 110.847 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 354' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -84.7 -10.69 57.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.344 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 355' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -64.32 -41.22 96.92 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.967 0.413 . . . . 10.0 110.273 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 356' ' ' ALA . . . . . 0.45 ' HB2' ' HB1' ' A' ' 312' ' ' ALA . . . -69.28 -28.88 66.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.591 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 48.7 t -67.38 -52.27 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.597 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -61.67 -25.57 67.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.735 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 359' ' ' ALA . . . . . 0.521 ' HB2' ' HB3' ' A' ' 236' ' ' TYR . . . -75.76 -44.95 39.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.419 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -68.68 -41.9 78.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.793 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 361' ' ' GLU . . . . . 0.541 ' HG3' HG21 ' A' ' 328' ' ' VAL . 23.3 mm-40 -81.5 160.63 23.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.084 -0.507 . . . . 10.0 109.777 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -86.12 59.54 4.68 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.631 -0.795 . . . . 10.0 112.743 -179.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 8.0 m -135.19 177.47 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.587 0.232 . . . . 10.0 111.034 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -83.5 139.06 33.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.485 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 365' ' ' ILE . . . . . . . . . . . . . 47.6 mt -84.18 140.46 16.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.287 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -73.85 153.41 39.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.898 0.38 . . . . 10.0 110.629 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -86.9 -27.27 23.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.792 -179.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 368' ' ' GLU . . . . . 0.473 ' HA ' ' OE1' ' A' ' 368' ' ' GLU . 6.0 mm-40 62.86 -121.26 0.61 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.966 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -149.53 134.2 17.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.541 0.21 . . . . 10.0 110.795 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 370' ' ' GLN . . . . . 0.429 ' OE1' ' HA ' ' A' ' 228' ' ' PRO . 22.2 mp0 -114.01 165.93 12.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.885 0.374 . . . . 10.0 110.744 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 22.7 m -112.14 133.32 54.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.373 -179.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 62.5 mt -99.33 -37.58 9.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.164 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 373' ' ' ALA . . . . . 0.471 ' HB1' HD22 ' A' ' 187' ' ' LEU . . . -162.62 155.41 19.47 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.638 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 374' ' ' SER . . . . . 0.475 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 41.6 m -155.13 135.59 13.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.495 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.415 ' HB ' HD21 ' A' ' 187' ' ' LEU . 18.9 tt -149.73 136.8 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.165 0.507 . . . . 10.0 110.62 178.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.64 143.73 26.45 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.855 -0.612 . . . . 10.0 109.715 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -55.5 -48.42 74.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.835 0.35 . . . . 10.0 110.522 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -57.59 -40.24 78.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.643 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 62.7 m-20 -73.99 -14.94 61.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.981 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -88.63 -42.53 11.96 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.319 -0.622 . . . . 10.0 109.319 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -70.05 -18.41 63.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.769 -0.651 . . . . 10.0 110.7 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -74.3 -11.39 60.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.407 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 43.1 mt -93.49 0.44 56.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.564 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.468 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 26.1 m-85 -94.52 142.33 27.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.591 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -75.1 -61.51 1.87 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.196 0.522 . . . . 10.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -102.34 107.68 18.78 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 44.8 tp -120.72 120.02 34.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.971 -0.558 . . . . 10.0 109.911 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -143.04 166.49 24.49 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.524 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.89 173.92 46.06 Favored Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.083 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 13.6 mtm -110.93 146.88 35.8 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.707 0.289 . . . . 10.0 110.232 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 6.7 t -126.63 160.13 31.59 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -84.7 163.11 38.25 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.489 -0.863 . . . . 10.0 111.985 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 393' ' ' THR . . . . . 0.435 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 3.2 m -71.08 73.1 0.62 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.196 0.522 . . . . 10.0 110.482 179.214 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -135.44 -30.54 1.01 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.778 -0.646 . . . . 10.0 111.8 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 19.9 t70 61.51 -114.55 0.56 Allowed 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 14.0 m 65.52 -86.39 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.898 0.703 . . . . 10.0 112.898 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -84.03 30.51 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 10.0 111.456 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -58.13 -45.6 87.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.456 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -65.61 -23.15 66.76 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.628 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -75.86 -29.3 58.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.633 0.254 . . . . 10.0 110.443 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -60.02 -42.52 94.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.994 0.426 . . . . 10.0 110.524 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.4 m -81.84 -5.76 58.49 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.963 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 17.8 m -106.14 -40.85 5.52 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.855 -0.338 . . . . 10.0 111.795 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 53.9 mt -85.99 -46.31 16.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.554 -0.293 . . . . 10.0 111.593 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -108.51 -6.11 16.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.625 0.25 . . . . 10.0 111.316 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 58.96 44.76 15.98 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.017 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 407' ' ' LEU . . . . . 0.431 HD13 HD11 ' A' ' 99' ' ' ILE . 36.1 mt -112.02 138.13 49.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.776 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 408' ' ' ASP . . . . . 0.566 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 28.7 t0 -82.47 142.62 31.75 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.729 -0.471 . . . . 10.0 109.729 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 1.8 m -100.79 106.31 17.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.931 0.396 . . . . 10.0 111.487 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 83.9 t -107.05 132.81 53.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.205 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 60.2 t -96.76 126.55 49.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.52 -0.309 . . . . 10.0 110.398 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 44.8 t -95.73 131.56 29.06 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.548 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -65.17 154.42 73.56 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.645 2.23 . . . . 10.0 112.757 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.5 p -79.91 168.68 18.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.034 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -78.9 -33.41 45.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.436 0.636 . . . . 10.0 109.407 179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -124.22 151.07 65.39 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.401 -0.818 . . . . 10.0 109.557 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.68 110.4 1.44 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.502 2.135 . . . . 10.0 111.999 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 58.8 ttp -72.92 102.52 3.47 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.112 0.482 . . . . 10.0 110.545 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.8 pt -96.14 60.72 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.238 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 -86.25 128.53 34.92 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -93.81 97.97 10.77 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.832 0.348 . . . . 10.0 111.136 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -90.14 122.19 32.88 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.068 -0.715 . . . . 10.0 109.068 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 22.4 mt -104.65 150.78 38.95 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.734 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.98 141.77 98.65 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.945 2.43 . . . . 10.0 112.56 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -60.26 131.91 52.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.976 -0.557 . . . . 10.0 110.907 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.27 106.4 17.59 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.951 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 72.8 t -103.93 123.19 57.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.834 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 428' ' ' TYR . . . . . 0.434 ' HB3' ' HB2' ' A' ' 433' ' ' GLU . 2.5 m-85 -105.91 -175.18 2.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.625 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.54 -77.42 0.25 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.438 -0.505 . . . . 10.0 110.27 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 76.0 p -83.77 156.39 22.56 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.2 -0.296 . . . . 10.0 110.2 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -62.93 -27.07 69.13 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.024 -0.361 . . . . 10.0 110.024 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.12 -45.15 87.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.796 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 433' ' ' GLU . . . . . 0.434 ' HB2' ' HB3' ' A' ' 428' ' ' TYR . 18.8 mt-10 -65.73 -42.22 91.31 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.492 178.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -57.82 -51.59 68.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.803 -1.09 . . . . 10.0 111.344 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 45.7 mm -67.87 -38.46 80.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.682 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.82 -39.59 92.31 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.813 0.34 . . . . 10.0 110.459 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -61.57 -38.11 86.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.24 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 438' ' ' ILE . . . . . 0.427 HG23 HG21 ' A' ' 557' ' ' ILE . 84.4 mt -63.37 -44.46 99.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.648 178.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.99 -43.77 96.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.262 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -60.48 -43.04 97.37 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.44 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 441' ' ' ASP . . . . . 0.616 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 30.2 t70 -66.47 -42.93 86.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.108 179.252 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 75.3 mt -61.14 -39.36 82.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.451 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -59.07 -39.98 83.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.999 0.428 . . . . 10.0 110.44 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.25 -39.69 82.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.221 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.616 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 10.7 mmt180 -66.91 -46.73 73.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.246 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -36.41 82.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.883 0.373 . . . . 10.0 110.597 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.39 -32.9 74.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.33 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -89.89 -5.51 56.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.179 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 77.98 29.17 54.99 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.821 -0.704 . . . . 10.0 111.719 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 450' ' ' GLN . . . . . 0.557 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 62.4 tt0 -99.38 126.96 35.84 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-O 120.401 0.143 . . . . 10.0 111.015 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.15 142.62 56.42 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 122.592 2.195 . . . . 10.0 111.307 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 52.3 t -119.86 131.45 72.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.569 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 43.3 tp -120.18 104.25 9.93 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.396 -0.594 . . . . 10.0 109.396 178.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 32.2 t -90.23 124.07 42.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.789 -0.642 . . . . 10.0 110.256 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -104.37 81.58 0.34 Allowed Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.799 -0.715 . . . . 10.0 111.977 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.13 104.82 13.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.886 0.374 . . . . 10.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 33.9 pt -72.41 -21.52 20.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.194 0.521 . . . . 10.0 110.166 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 458' ' ' SER . . . . . 0.488 ' HB2' ' HB2' ' A' ' 461' ' ' LYS . 1.1 m -99.27 118.98 37.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.483 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 57.2 mt -59.09 -41.35 83.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.945 0.402 . . . . 10.0 111.865 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 27.6 mp0 -63.93 -24.63 67.8 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.186 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 458' ' ' SER . 0.1 OUTLIER -77.69 -31.42 52.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.426 -0.352 . . . . 10.0 110.607 -179.488 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 49.1 m -60.49 -38.91 85.82 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.126 0.488 . . . . 10.0 109.939 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.46 -42.98 82.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.342 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 55.1 tp -64.13 -52.1 60.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.663 -0.698 . . . . 10.0 111.498 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.0 -30.34 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 120.672 0.272 . . . . 10.0 111.013 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 9.1 t -66.75 -40.97 88.48 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.36 -47.02 83.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.121 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -60.97 -40.49 93.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.141 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 17.0 mt -65.92 -35.81 81.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.951 0.405 . . . . 10.0 110.586 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.0 m -75.04 -33.83 61.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.091 0.472 . . . . 10.0 109.803 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -64.4 -41.17 96.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.111 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -75.86 -31.51 59.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.306 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 94.82 41.38 4.12 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.014 -0.613 . . . . 10.0 112.497 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 35.1 mt -110.53 137.81 41.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 CA-C-O 120.664 0.269 . . . . 10.0 110.999 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -61.57 134.98 57.46 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.477 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -163.68 156.47 18.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.78 0.324 . . . . 10.0 111.177 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -140.33 133.36 29.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 478' ' ' VAL . . . . . 0.559 HG22 HD12 ' A' ' 502' ' ' ILE . 20.1 t -105.0 133.69 48.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.857 0.36 . . . . 10.0 111.426 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.428 ' HB3' ' OE2' ' A' ' 487' ' ' GLU . 80.0 mt -84.93 138.83 32.26 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -144.34 135.94 25.79 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.293 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -59.2 -24.32 63.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 10.0 112.018 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -78.7 -9.27 59.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.605 0.24 . . . . 10.0 110.963 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 483' ' ' PHE . . . . . 0.49 ' O ' ' HG3' ' A' ' 487' ' ' GLU . 59.2 m-85 -131.79 49.95 2.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.992 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 484' ' ' HIS . . . . . 0.447 ' HA ' ' OE1' ' A' ' 487' ' ' GLU . 3.3 m80 -57.46 -33.64 68.16 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.912 0.387 . . . . 10.0 111.26 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.92 -33.57 76.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.103 0.478 . . . . 10.0 110.468 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -77.83 -36.68 49.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.647 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 487' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' A' ' 483' ' ' PHE . 49.4 mt-10 -59.29 -39.01 81.64 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.661 -0.7 . . . . 10.0 110.523 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -59.61 -27.13 66.05 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.297 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -88.51 -38.24 15.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.861 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.87 -48.09 72.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.393 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 81.3 t -60.63 -30.95 47.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.828 0.347 . . . . 10.0 111.062 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -61.83 -28.37 69.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.312 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -120.36 21.58 11.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.824 0.345 . . . . 10.0 110.846 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -67.71 -20.03 65.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.996 0.427 . . . . 10.0 110.911 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -98.01 11.97 64.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.876 -0.678 . . . . 10.0 112.068 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -73.39 140.13 79.03 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 110.088 -0.338 . . . . 10.0 110.088 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -52.3 123.16 12.04 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.701 2.267 . . . . 10.0 113.047 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 73.68 15.99 3.94 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 123.948 0.78 . . . . 10.0 112.921 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -91.56 119.88 31.88 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.567 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 40.2 t -100.15 107.99 22.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.067 0.461 . . . . 10.0 110.374 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 8.0 m -107.39 129.84 54.87 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.528 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 502' ' ' ILE . . . . . 0.559 HD12 HG22 ' A' ' 478' ' ' VAL . 61.1 mt -109.54 114.18 46.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.219 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -97.37 114.93 26.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.817 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 16.0 m -86.48 112.45 21.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.203 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 65.8 t30 58.75 77.18 0.31 Allowed 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.667 0.604 . . . . 10.0 111.204 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.35 141.11 55.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.942 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -91.66 -171.09 2.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.404 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -75.73 153.8 44.5 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.695 -0.764 . . . . 10.0 112.475 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.521 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 59.2 mtt180 66.6 -80.83 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.293 0.637 . . . . 10.0 112.104 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.57 144.76 13.65 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.114 -0.565 . . . . 10.0 111.928 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.03 154.13 41.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.63 0.252 . . . . 10.0 111.206 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -75.71 120.58 21.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.883 0.373 . . . . 10.0 110.961 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 93.4 mt -99.58 108.76 23.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.788 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 6.8 t -78.79 131.07 35.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.92 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 48.9 mt -65.85 127.38 31.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.321 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 95.97 -9.44 68.05 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.084 -0.579 . . . . 10.0 111.672 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 113.72 -176.67 17.39 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.864 -0.894 . . . . 10.0 110.864 -179.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 5.3 p -121.75 93.37 3.98 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.147 0.498 . . . . 10.0 110.642 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 17.9 p-90 -60.35 -27.04 67.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.443 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -62.5 -36.37 82.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.226 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.36 -35.15 35.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.061 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 522' ' ' GLU . . . . . 0.413 ' O ' ' HG ' ' A' ' 526' ' ' LEU . 47.8 mt-10 -62.62 -44.96 94.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.822 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 28.1 m -71.65 -25.95 25.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-O 120.994 0.426 . . . . 10.0 110.809 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -73.7 -25.51 60.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.151 0.5 . . . . 10.0 110.171 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -87.18 -0.83 57.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.491 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 522' ' ' GLU . 88.4 mt -84.24 148.57 26.64 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.886 0.374 . . . . 10.0 111.21 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -69.3 -39.92 77.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.9 -0.591 . . . . 10.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -152.85 88.66 3.85 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.21 104.11 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.057 2.504 . . . . 10.0 112.359 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.17 148.71 29.43 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.722 -0.672 . . . . 10.0 109.875 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -52.41 -50.85 61.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.951 0.405 . . . . 10.0 111.669 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 51.0 mp0 -64.69 -31.87 73.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.629 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -68.99 -44.09 73.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.029 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 79.1 mt -61.59 -42.72 95.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.183 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -61.21 -42.06 97.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.378 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -63.57 -47.33 81.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.552 . . . . 10.0 110.167 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 61.2 mt -63.95 -37.51 79.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.254 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -61.78 -43.29 99.15 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -68.63 -43.43 76.37 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.449 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.67 -47.18 86.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.582 -0.736 . . . . 10.0 109.868 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 61.3 t90 -63.83 -39.5 94.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.335 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -54.04 -48.46 70.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.579 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 39.0 t -61.85 -43.88 98.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.607 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -65.72 -44.11 87.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.95 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -58.94 -50.86 72.47 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.373 -0.83 . . . . 10.0 111.167 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.49 -24.02 63.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.347 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -67.48 -36.82 81.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.273 0.559 . . . . 10.0 109.716 178.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.16 -32.06 55.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.549 -0.75 . . . . 10.0 110.008 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 84.3 mt -64.33 -39.95 94.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.188 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -69.97 -36.26 75.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.918 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 551' ' ' ALA . . . . . 0.557 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -64.94 -49.16 71.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.465 -0.789 . . . . 10.0 110.793 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 141.42 23.43 0.24 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.399 -0.905 . . . . 10.0 113.609 179.179 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 74.47 -166.78 54.81 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.502 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 30.5 tp -75.44 125.84 29.81 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.17 -0.307 . . . . 10.0 110.17 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -98.53 110.61 23.18 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.391 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 27.4 mm -90.24 133.89 30.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.818 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 557' ' ' ILE . . . . . 0.427 HG21 HG23 ' A' ' 438' ' ' ILE . 14.0 mt -124.82 121.34 60.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.264 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -107.42 134.29 12.12 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.834 -0.698 . . . . 10.0 111.496 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 17.3 p -92.57 -57.32 2.71 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.112 0.482 . . . . 10.0 111.362 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -114.31 133.05 55.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.438 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 561' ' ' ARG . . . . . 0.523 ' H ' HD21 ' A' ' 588' ' ' LEU . 16.6 mmt180 -77.36 134.62 38.42 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 178.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -78.26 139.4 38.89 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.201 -0.296 . . . . 10.0 110.201 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -57.14 -48.09 79.52 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 564' ' ' SER . . . . . 0.468 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.3 OUTLIER -77.53 114.94 16.88 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.186 178.121 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -65.8 -24.08 66.84 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.535 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -61.42 -48.86 79.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.961 0.41 . . . . 10.0 110.463 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 69.0 mt -75.83 -34.83 28.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.118 0.485 . . . . 10.0 110.205 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -63.31 -41.1 98.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.35 -0.841 . . . . 10.0 110.621 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -75.59 -35.27 60.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.831 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -62.68 -27.42 69.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.909 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 20.4 tp -71.35 -28.59 64.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.1 0.476 . . . . 10.0 110.218 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -81.25 -30.43 34.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.248 0.547 . . . . 10.0 109.905 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.34 7.41 17.88 Favored Glycine 0 CA--C 1.52 0.382 0 CA-C-N 115.627 -0.715 . . . . 10.0 113.446 -179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -74.16 -30.59 62.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.988 0.394 . . . . 10.0 109.989 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 2.4 t -93.65 162.96 13.73 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.191 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 66.46 51.98 38.64 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.869 -0.681 . . . . 10.0 112.161 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -88.71 146.24 25.17 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.266 -0.272 . . . . 10.0 110.266 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 60.61 20.51 10.4 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 123.544 0.528 . . . . 10.0 110.438 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 75.5 40.4 32.79 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.995 -0.548 . . . . 10.0 112.641 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.33 -163.72 1.01 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.73 0.265 . . . . 10.0 110.963 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -92.33 177.32 6.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.266 0.555 . . . . 10.0 111.981 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 153.42 173.51 22.71 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.583 -0.735 . . . . 10.0 111.664 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 2.6 p -146.96 148.45 31.76 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.005 -0.369 . . . . 10.0 110.005 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.6 137.42 31.89 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.621 0.248 . . . . 10.0 111.137 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -158.91 147.88 18.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.735 178.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -115.19 147.62 40.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.266 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -130.02 111.62 12.68 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 588' ' ' LEU . . . . . 0.523 HD21 ' H ' ' A' ' 561' ' ' ARG . 4.9 mp -122.18 179.39 4.56 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.115 0.483 . . . . 10.0 111.594 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 51.9 p -132.3 179.91 5.83 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.059 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 71.4 mmm -83.46 -8.32 59.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.857 0.361 . . . . 10.0 111.151 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.12 9.74 40.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.196 0.522 . . . . 10.0 110.062 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.67 149.2 38.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.659 -0.7 . . . . 10.0 110.533 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -59.94 -28.17 67.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.164 -0.471 . . . . 10.0 111.603 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.654 ' O ' HG12 ' A' ' 597' ' ' ILE . 7.2 tp -63.8 -26.41 68.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.415 -179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 22.4 mmt -77.44 -2.74 36.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.875 0.369 . . . . 10.0 111.286 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -101.92 -1.51 31.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.231 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.654 HG12 ' O ' ' A' ' 594' ' ' LEU . 16.6 pt -94.36 4.6 8.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.965 0.412 . . . . 10.0 110.807 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -86.17 19.76 2.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.953 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.44 -59.29 0.55 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.733 0.813 . . . . 10.0 111.997 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 1.7 m -122.1 139.28 53.91 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.304 -0.258 . . . . 10.0 110.304 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -64.93 -26.16 68.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.09 0.471 . . . . 10.0 110.336 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.2 -32.56 70.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.461 179.35 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.8 t -67.35 -45.56 85.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.67 -0.492 . . . . 10.0 109.67 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.01 -22.97 63.06 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.404 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -59.92 -25.95 62.42 Favored Glycine 0 C--N 1.332 0.331 0 CA-C-N 115.912 -0.585 . . . . 10.0 112.715 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -65.41 -18.55 65.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.666 0.269 . . . . 10.0 111.047 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -94.99 -14.57 24.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.907 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -69.01 -30.42 68.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.893 0.378 . . . . 10.0 110.747 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm -98.28 30.2 3.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.912 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 38.8 tp -84.99 -8.47 58.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.618 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 91.42 -57.01 3.13 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.711 -0.756 . . . . 10.0 111.808 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 69.88 -69.26 0.17 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.352 0.661 . . . . 10.0 111.795 179.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp 66.57 93.58 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.277 0 O-C-N 123.563 0.539 . . . . 10.0 110.858 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 614' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.29 101.94 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.96 2.44 . . . . 10.0 112.472 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 123.18 -18.81 7.81 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.036 -0.602 . . . . 10.0 111.86 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -98.55 136.96 37.9 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.123 -0.325 . . . . 10.0 110.123 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -80.45 104.9 11.3 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.331 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -61.8 -35.9 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.046 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 40.22 65.91 0.68 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.72 0.808 . . . . 10.0 112.942 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -117.77 108.97 42.02 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.44 -23.2 44.22 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 123.062 2.508 . . . . 10.0 114.447 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 65.6 p-90 -68.13 -18.93 64.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.749 -0.38 . . . . 10.0 111.433 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 87.5 t -64.5 -49.29 81.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.05 -33.68 75.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.616 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -69.14 -44.72 71.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.51 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -63.17 -43.57 97.87 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.591 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 89.8 mt -63.51 -44.78 98.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.559 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -61.32 -37.58 83.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.988 0.423 . . . . 10.0 110.677 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -66.13 -45.56 80.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.042 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -62.89 -45.71 91.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.638 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 631' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 635' ' ' GLU . 44.1 mt-30 -60.64 -48.63 80.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.778 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -60.92 -34.2 74.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.189 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -64.71 -42.57 95.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.998 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 634' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 637' ' ' ARG . 70.1 t -62.81 -42.39 96.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.025 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.602 ' HA ' ' ND2' ' A' ' 638' ' ' ASN . 4.5 mm-40 -68.26 -28.98 67.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.743 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 51.1 m -67.37 -28.47 67.98 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.461 0.648 . . . . 10.0 109.339 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 637' ' ' ARG . . . . . 0.506 ' HB3' ' O ' ' A' ' 634' ' ' VAL . 16.8 ttp180 -67.31 -38.18 84.55 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.137 -0.938 . . . . 10.0 109.64 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 638' ' ' ASN . . . . . 0.602 ' ND2' ' HA ' ' A' ' 635' ' ' GLU . 12.2 m-20 -60.26 -45.42 93.34 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.579 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -57.53 -46.02 84.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.125 -0.943 . . . . 10.0 111.533 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.51 -43.81 98.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.618 0.247 . . . . 10.0 110.801 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 73.9 mt -64.57 -46.81 91.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.372 -0.377 . . . . 10.0 110.275 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 642' ' ' ARG . . . . . 0.444 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 12.2 mtm-85 -61.1 -42.41 98.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.061 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -58.05 -44.13 87.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.602 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.42 -44.88 95.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.621 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 71.7 mt -66.54 -40.76 89.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.005 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 646' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' A' ' 650' ' ' ASP . 82.6 mt -61.68 -27.92 69.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.115 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -69.0 -20.69 64.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.96 0.41 . . . . 10.0 110.682 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -101.52 -39.7 7.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.658 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -67.19 -34.21 77.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.653 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 650' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 4.4 t0 -65.94 -26.93 67.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.91 0.386 . . . . 10.0 111.153 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 24.3 t -63.07 -44.47 99.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.158 0.504 . . . . 10.0 110.1 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -71.7 -29.13 64.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.701 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -66.91 -46.68 74.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.379 -0.828 . . . . 10.0 110.43 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -57.23 -48.71 78.14 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.516 0.51 . . . . 10.0 110.533 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 655' ' ' GLN . . . . . 0.453 HE22 ' HB2' ' A' ' 807' ' ' SER . 74.2 mt-30 -62.23 -42.53 99.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.792 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 9.8 ttp-105 -63.31 -42.58 99.03 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 120.974 0.416 . . . . 10.0 109.984 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 46.1 ttp180 -59.87 -47.09 87.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.769 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -66.37 -46.66 75.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.046 -179.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 659' ' ' ILE . . . . . 0.41 HD12 ' HA ' ' A' ' 659' ' ' ILE . 10.1 tp -69.07 -33.47 58.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 121.126 -0.23 . . . . 10.0 111.61 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -68.11 -31.42 71.0 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.182 -0.303 . . . . 10.0 110.182 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.3 m -67.55 -45.87 74.4 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.769 -0.456 . . . . 10.0 109.769 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -65.58 -44.84 85.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.442 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -61.27 -37.14 82.09 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.35 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -73.98 -35.94 64.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.203 -0.453 . . . . 10.0 111.19 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -63.5 -49.25 74.31 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.688 -0.486 . . . . 10.0 109.688 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 666' ' ' LEU . . . . . 0.451 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 88.1 mt -59.76 -28.98 67.86 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.169 0.509 . . . . 10.0 110.282 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.409 ' O ' ' HD3' ' A' ' 195' ' ' PRO . 0.9 OUTLIER -74.73 -46.56 36.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.507 -0.77 . . . . 10.0 110.594 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.68 -49.34 59.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.757 -0.656 . . . . 10.0 112.051 -178.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 9.8 m -73.28 150.94 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.065 0.459 . . . . 10.0 111.055 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 11.1 m -101.92 -36.8 8.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.238 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -79.96 90.18 5.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.866 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 672' ' ' VAL . . . . . 0.498 ' O ' HG12 ' A' ' 676' ' ' ILE . 9.6 p -92.87 -9.97 9.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.543 0.687 . . . . 10.0 109.477 178.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.63 -42.35 67.67 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 114.829 -1.078 . . . . 10.0 111.838 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -56.22 -51.44 68.07 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.341 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 675' ' ' THR . . . . . 0.487 ' O ' HG12 ' A' ' 679' ' ' ILE . 2.4 m -60.94 -45.81 93.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.084 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 676' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 672' ' ' VAL . 48.1 mm -55.13 -47.32 77.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.474 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -70.65 -39.72 73.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.586 -0.279 . . . . 10.0 111.436 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 50.0 m -60.99 -46.58 90.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.47 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 679' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 675' ' ' THR . 38.0 pt -76.24 -21.22 15.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.234 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 23.5 ttm-85 -60.01 -46.91 87.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.799 0.333 . . . . 10.0 110.77 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -62.28 -45.16 94.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.64 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -62.05 -52.01 65.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.592 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 683' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 679' ' ' ILE . 88.7 t -57.81 -45.36 87.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.236 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -63.79 -46.04 86.99 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.929 -0.308 . . . . 10.0 110.592 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -61.38 -47.68 84.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.667 -0.242 . . . . 10.0 110.704 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.25 -39.24 78.65 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.195 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 26.8 m -69.42 -39.09 78.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.428 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -67.97 -46.96 80.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.545 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 689' ' ' ASP . . . . . 0.498 ' HA ' ' O ' ' A' ' 692' ' ' ILE . 85.4 m-20 -59.81 -20.84 59.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.959 -178.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -69.46 -41.87 75.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.505 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -105.47 -14.62 15.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.947 0.403 . . . . 10.0 111.489 -179.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 692' ' ' ILE . . . . . 0.502 HG23 ' CD1' ' A' ' 701' ' ' TRP . 35.3 mt -132.67 97.66 17.12 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.678 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.12 130.76 37.83 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.333 2.022 . . . . 10.0 111.389 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 694' ' ' PRO . . . . . 0.46 ' HA ' ' NH2' ' A' ' 736' ' ' ARG . 12.1 Cg_endo -56.1 118.44 5.23 Favored 'Trans proline' 0 C--O 1.238 0.499 0 C-N-CA 122.614 2.209 . . . . 10.0 112.508 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 62.12 72.09 0.51 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.438 -0.801 . . . . 10.0 111.257 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 52.0 p -141.84 -167.38 2.43 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.994 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 78.8 mt -83.58 142.79 30.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.473 -0.331 . . . . 10.0 110.578 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 698' ' ' GLU . . . . . 0.505 ' HA ' ' CD2' ' A' ' 701' ' ' TRP . 24.5 tt0 -61.11 -26.32 67.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.212 0.53 . . . . 10.0 111.153 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -71.08 -16.39 62.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.905 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 14.6 mmt -97.35 6.3 48.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.657 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 701' ' ' TRP . . . . . 0.505 ' CD2' ' HA ' ' A' ' 698' ' ' GLU . 49.7 m0 -98.49 114.5 26.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.088 -178.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 702' ' ' ASP . . . . . 0.616 ' OD1' ' HD3' ' B' ' 6' ' ' ARG . 9.5 t70 -86.15 77.74 9.52 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 703' ' ' ILE . . . . . 0.497 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 36.9 mm -53.52 -48.75 91.86 Favored Pre-proline 0 CA--C 1.537 0.459 0 CA-C-N 115.193 -0.912 . . . . 10.0 112.13 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 704' ' ' PRO . . . . . 0.497 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 47.6 Cg_exo -56.44 -37.4 97.26 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 121.805 1.67 . . . . 10.0 112.303 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -69.45 -40.26 79.35 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 121.246 -0.502 . . . . 10.0 112.344 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 37.8 tp -67.15 -44.59 79.43 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -63.65 -37.2 86.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.966 -0.561 . . . . 10.0 109.926 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.93 -48.49 75.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.516 -0.765 . . . . 10.0 110.611 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -74.77 -34.84 62.53 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.869 -0.605 . . . . 10.0 111.664 -178.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 51.3 mt -68.14 -50.77 52.51 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.729 0.27 . . . . 10.0 111.729 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -66.38 -31.84 72.86 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.028 0.381 . . . . 10.0 112.028 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -87.7 -71.19 0.58 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.748 0.647 . . . . 10.0 112.748 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.28 -58.53 6.83 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.214 0.82 . . . . 10.0 113.214 -176.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -79.06 -11.8 60.0 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.478 0.918 . . . . 10.0 113.478 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 2.2 t70 63.13 24.59 14.5 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.537 0.684 . . . . 10.0 110.051 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 716' ' ' LEU . . . . . 0.438 ' HG ' ' HG ' ' A' ' 718' ' ' LEU . 18.9 tp -104.71 98.74 8.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.34 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -82.99 97.16 8.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.124 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.438 ' HG ' ' HG ' ' A' ' 716' ' ' LEU . 80.3 mt -129.12 119.75 19.87 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.074 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 719' ' ' PRO . . . . . 0.425 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 92.2 Cg_endo -82.09 79.06 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.627 2.218 . . . . 10.0 111.399 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 720' ' ' ILE . . . . . 0.404 HG23 HD11 ' A' ' 735' ' ' LEU . 57.9 mt -60.96 -39.29 81.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.51 -179.116 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -66.04 -13.97 60.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.103 0.478 . . . . 10.0 111.162 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 722' ' ' GLU . . . . . 0.498 ' O ' ' HD2' ' A' ' 726' ' ' LYS . 4.4 tp10 -92.96 -10.4 36.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.701 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 45.2 m0 -96.97 -48.62 5.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.745 0.307 . . . . 10.0 111.643 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 63.2 mt -56.78 -22.63 37.4 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.269 0.84 . . . . 10.0 113.269 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.47 -19.75 21.69 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.794 0.294 . . . . 10.0 111.794 -179.259 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 726' ' ' LYS . . . . . 0.498 ' HD2' ' O ' ' A' ' 722' ' ' GLU . 36.3 mttp -99.93 -38.43 8.61 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.702 0.26 . . . . 10.0 111.702 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -128.74 86.41 57.62 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-O 121.162 0.506 . . . . 10.0 110.796 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -65.93 -13.27 39.08 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.925 2.417 . . . . 10.0 111.749 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 40.2 mp0 -66.02 -15.2 62.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.344 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 35.6 mt -71.74 -40.24 69.51 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 110.078 -0.341 . . . . 10.0 110.078 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 53.35 -88.27 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.053 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -144.31 -49.94 0.28 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.901 -0.32 . . . . 10.0 111.817 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -59.25 -58.89 6.66 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.781 0.325 . . . . 10.0 110.688 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.0 -26.35 68.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.554 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 735' ' ' LEU . . . . . 0.404 HD11 HG23 ' A' ' 720' ' ' ILE . 27.7 tp -65.57 -47.45 75.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.58 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 736' ' ' ARG . . . . . 0.46 ' NH2' ' HA ' ' A' ' 694' ' ' PRO . 73.8 mtt-85 -64.87 -44.9 88.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.266 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -57.08 -40.34 76.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.359 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 15.3 mmm-85 -61.25 -40.19 93.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.937 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 79.6 mt -64.99 -43.71 96.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.399 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 52.1 tp -71.02 -37.45 72.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.415 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -66.87 -40.89 87.99 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.984 0.421 . . . . 10.0 110.599 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 742' ' ' GLN . . . . . 0.414 ' O ' HG23 ' A' ' 746' ' ' VAL . 2.2 tp60 -66.67 -36.08 81.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.361 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.44 -41.57 88.96 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 82.1 mt -65.8 -35.87 76.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 178.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.19 -55.28 26.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.98 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 749' ' ' ARG . 88.1 t -58.24 -35.87 55.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.328 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -59.24 -51.01 71.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.304 179.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -64.5 -38.2 90.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.617 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 749' ' ' ARG . . . . . 0.415 ' HD3' ' HA ' ' A' ' 746' ' ' VAL . 77.2 mtp180 -61.07 -36.75 80.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.403 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -80.34 -36.93 33.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.589 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -60.32 -42.84 96.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.597 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -65.22 -12.63 53.36 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 84.3 t -79.58 -43.34 23.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.725 0.298 . . . . 10.0 111.326 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 15.1 m -99.54 -20.21 5.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 112.066 0.395 . . . . 10.0 112.066 -179.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 110.04 144.35 10.23 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.707 -0.759 . . . . 10.0 112.002 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 756' ' ' ALA . . . . . 0.44 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -60.16 -43.75 95.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.732 0.301 . . . . 10.0 110.899 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -58.99 -43.72 91.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.843 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.9 tpt -65.2 -44.25 88.96 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.383 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 50.9 mmm -63.02 -46.95 85.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.621 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -56.48 -39.73 73.72 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.916 0.389 . . . . 10.0 110.8 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -70.94 -40.8 71.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.142 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -63.69 -44.31 94.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.869 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -57.35 -45.47 84.31 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.028 0.442 . . . . 10.0 110.503 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 764' ' ' LYS . . . . . 0.451 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 72.4 tttt -62.17 -45.47 93.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.005 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -61.72 -44.18 98.26 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.833 -0.621 . . . . 10.0 112.309 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 65.3 t -63.47 -44.59 98.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.392 0.139 . . . . 10.0 110.906 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.69 -49.05 77.79 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.838 0.351 . . . . 10.0 110.583 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 73.3 mt -64.85 -39.93 94.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.15 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -58.89 -57.57 12.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.199 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 770' ' ' THR . . . . . 0.489 HG21 ' HB3' ' A' ' 821' ' ' GLU . 17.1 m -60.4 -41.05 93.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.369 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.45 -47.15 85.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.924 0.393 . . . . 10.0 109.991 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 772' ' ' ASP . . . . . 0.461 ' O ' ' HD3' ' A' ' 776' ' ' LYS . 9.9 t70 -64.82 -41.67 95.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.773 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 773' ' ' SER . . . . . 0.422 ' HB3' ' O ' ' B' ' 19' ' ' ALA . 23.2 m -62.04 -45.03 95.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.129 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 35.8 mt -69.53 -32.34 71.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.737 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -63.1 -40.01 96.39 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 772' ' ' ASP . 14.4 mptt -63.2 -42.79 99.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.861 -0.608 . . . . 10.0 110.268 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 14.2 tm-20 -65.58 -49.5 68.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.712 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 778' ' ' HIS . . . . . 0.535 ' O ' ' HG2' ' A' ' 782' ' ' MET . 43.3 t60 -58.48 -34.23 70.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.339 -0.846 . . . . 10.0 111.276 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.5 mt -62.08 -42.12 98.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.882 0.372 . . . . 10.0 110.275 179.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -73.05 -41.45 64.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.447 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.18 -32.01 71.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.695 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 782' ' ' MET . . . . . 0.535 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 84.8 mmm -62.68 -35.2 78.89 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.08 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -63.25 -50.55 69.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.854 0.359 . . . . 10.0 110.086 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -62.13 -27.07 68.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.24 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 785' ' ' LEU . . . . . 0.466 ' O ' HG12 ' A' ' 789' ' ' ILE . 9.5 mt -75.21 -45.86 37.64 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.28 178.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -60.69 -51.96 67.15 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.628 -179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.71 -28.02 63.41 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.778 0.323 . . . . 10.0 110.375 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -68.05 -18.93 71.42 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.746 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 789' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 785' ' ' LEU . 16.2 mm -63.05 -24.38 35.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.736 0.303 . . . . 10.0 110.717 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 34.3 m80 -69.77 -14.75 62.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.779 0.323 . . . . 10.0 110.264 179.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 16.6 mt -112.44 -34.32 5.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.669 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 792' ' ' ARG . . . . . 0.488 ' HD3' ' OE2' ' A' ' 806' ' ' GLU . 30.6 mtt180 -80.39 -21.68 42.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.143 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -78.1 79.19 1.49 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.252 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 6.8 p90 -69.81 167.81 16.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.047 0.451 . . . . 10.0 110.982 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -70.13 170.92 10.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.987 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 30.3 tp60 68.81 12.53 8.68 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.339 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -154.76 150.88 28.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.155 -0.475 . . . . 10.0 109.967 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -89.03 139.51 28.92 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.191 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -59.92 -25.45 79.53 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.799 2.333 . . . . 10.0 112.869 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 800' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 801' ' ' GLN . 34.3 mtmm -79.59 162.58 25.24 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 801' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 800' ' ' LYS . 8.4 mm100 72.62 -53.53 0.7 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.536 0.522 . . . . 10.0 110.803 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -59.92 -47.87 84.03 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -54.91 -35.51 64.23 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.738 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -69.3 -47.01 65.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.373 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -61.16 -41.35 96.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.538 -0.301 . . . . 10.0 111.026 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 806' ' ' GLU . . . . . 0.488 ' OE2' ' HD3' ' A' ' 792' ' ' ARG . 2.2 mm-40 -62.82 -51.05 68.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.266 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 807' ' ' SER . . . . . 0.453 ' HB2' HE22 ' A' ' 655' ' ' GLN . 6.2 p -67.6 -38.71 84.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.395 -0.366 . . . . 10.0 111.742 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -63.34 -34.23 77.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.538 0.209 . . . . 10.0 110.814 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 57.9 m -62.53 -38.41 89.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.138 0.494 . . . . 10.0 110.19 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 810' ' ' MET . . . . . 0.407 ' HA ' ' HA ' ' A' ' 302' ' ' ALA . 46.8 ttm -71.95 -34.14 68.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.112 179.209 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -62.63 -41.28 98.92 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.539 -0.541 . . . . 10.0 109.539 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -66.21 -44.33 84.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.166 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -64.16 -32.09 73.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.5 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 28.7 ttp -63.18 -41.88 99.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.467 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 49.1 mt -68.06 -35.55 78.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.915 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -65.13 -45.3 85.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.059 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 7.3 m -71.75 -27.95 63.32 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.002 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 29.4 tp -54.76 -58.81 6.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.348 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 12.9 pttp -67.99 -26.35 65.87 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.348 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -61.17 -48.25 82.44 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.862 0.363 . . . . 10.0 110.364 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 821' ' ' GLU . . . . . 0.489 ' HB3' HG21 ' A' ' 770' ' ' THR . 0.8 OUTLIER -70.83 -46.69 62.3 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.332 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 54.1 t -51.08 -52.52 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.807 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 823' ' ' ILE . . . . . 0.444 HD11 HG13 ' A' ' 679' ' ' ILE . 27.8 mm -64.65 -43.79 96.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.591 -0.277 . . . . 10.0 111.427 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 30.9 m -62.88 -45.9 90.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.735 0.302 . . . . 10.0 110.859 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 95.1 m -61.61 -41.87 98.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.606 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 57.0 mt -71.96 -37.19 69.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.433 -0.348 . . . . 10.0 111.816 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 15.6 m -75.41 -32.83 60.87 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.81 0.338 . . . . 10.0 110.908 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -86.47 15.47 5.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.401 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.2 p -62.46 128.79 24.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -93.82 96.11 9.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.957 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 23.3 m -109.32 164.07 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.489 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 832' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 832' ' ' ARG . 10.5 mmt-85 -85.79 81.03 8.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.576 -179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 95.2 mtp -65.04 116.64 31.8 Favored Pre-proline 0 C--N 1.328 -0.335 0 N-CA-C 110.047 -0.353 . . . . 10.0 110.047 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -89.0 -152.73 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.991 2.461 . . . . 10.0 112.773 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -71.25 103.22 2.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.389 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.741 -0.647 . . . . 10.0 110.455 -179.927 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mpp? . . . . . 0 N--CA 1.483 1.217 0 CA-C-O 120.672 0.272 . . . . 10.0 110.503 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 11.2 tpt -131.7 111.95 12.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.174 -0.466 . . . . 10.0 109.782 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 7.9 mt -91.51 85.79 2.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.114 0.483 . . . . 10.0 110.48 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.39 96.23 5.29 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.155 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 23.9 mt -97.21 126.15 42.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.43 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.616 ' HD3' ' OD1' ' A' ' 702' ' ' ASP . 7.8 ttm180 -99.94 131.72 45.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.737 0.303 . . . . 10.0 110.306 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.27 143.11 30.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.195 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.88 36.49 2.17 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.499 0.666 . . . . 10.0 109.763 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -149.44 145.0 26.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.374 -0.83 . . . . 10.0 109.331 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 26.4 tttm -139.21 134.8 33.22 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.731 0.3 . . . . 10.0 110.42 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 17.9 mt -130.01 79.96 72.0 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.239 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.91 -15.6 29.52 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.49 2.126 . . . . 10.0 112.589 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.491 ' O ' HG23 ' B' ' 17' ' ' VAL . 0.6 OUTLIER -67.02 -21.55 65.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.264 -179.591 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.38 -52.36 58.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.636 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 17.0 m -80.26 -21.41 11.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.59 -0.277 . . . . 10.0 111.549 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.97 -33.99 75.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.302 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.491 HG23 ' O ' ' B' ' 13' ' ' LEU . 16.2 t -77.38 -36.65 24.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.492 -0.322 . . . . 10.0 110.548 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.36 -49.84 73.97 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 121.075 0.464 . . . . 10.0 110.904 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.422 ' O ' ' HB3' ' A' ' 773' ' ' SER . . . -85.46 4.4 35.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.084 0.469 . . . . 10.0 110.448 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -102.1 20.38 45.55 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.87 -0.605 . . . . 10.0 112.395 -179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 229' ' ' ALA . 18.0 m -85.15 1.73 4.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.4 0.619 . . . . 10.0 110.472 179.378 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 12.9 tmm? -67.15 125.7 26.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.526 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.62 58.47 0.73 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.186 0.517 . . . . 10.0 110.564 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -122.37 21.53 10.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.977 0.418 . . . . 10.0 111.09 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -81.26 53.1 1.96 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.109 0.481 . . . . 10.0 110.722 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.67 75.36 8.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.572 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -125.29 148.87 48.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.582 -179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.158 -0.925 . . . . 10.0 109.797 -179.769 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 91.1 t . . . . . 0 N--CA 1.477 0.89 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -75.28 143.55 42.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.157 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 98.67 -151.2 19.5 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.869 -0.682 . . . . 10.0 111.617 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.96 175.33 10.14 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.585 0.231 . . . . 10.0 110.406 179.464 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.437 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 15.7 mmt85 -116.24 172.49 7.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.731 0.301 . . . . 10.0 111.286 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.6 t30 62.95 -90.1 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.391 -0.822 . . . . 10.0 111.36 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -59.39 -50.4 74.09 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.124 0.487 . . . . 10.0 111.4 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -68.15 -35.31 77.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.537 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.416 ' OG1' ' HA ' ' A' ' 13' ' ' ARG . 18.5 m -62.13 -46.63 88.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.814 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.2 mt -59.72 -40.73 88.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.879 0.371 . . . . 10.0 110.797 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.7 OUTLIER -65.28 -49.61 68.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.006 -179.801 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -63.4 -38.22 90.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.947 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.546 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -66.6 -42.11 87.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.711 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -58.39 -37.11 74.61 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.555 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -62.64 -37.35 86.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.355 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.3 t -75.48 -37.57 37.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.739 179.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.424 ' HA ' HD12 ' A' ' 28' ' ' ILE . 46.8 t -58.49 -36.59 59.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.927 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -59.42 -41.21 89.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.801 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.5 mt -65.2 -43.41 95.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.876 -0.602 . . . . 10.0 109.954 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.424 HD12 ' HA ' ' A' ' 25' ' ' VAL . 64.1 mt -61.94 -41.77 92.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.204 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -63.39 -36.1 82.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.733 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.37 -24.26 50.67 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.33 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 35.6 mtt -86.2 -16.51 37.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.45 -0.341 . . . . 10.0 111.382 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.486 ' OE1' ' HD2' ' A' ' 82' ' ' ARG . 3.9 tt0 -57.88 -53.56 64.52 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-O 119.485 -0.293 . . . . 10.0 111.537 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.455 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 31.2 Cg_exo -60.52 -25.89 81.62 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.647 1.565 . . . . 10.0 111.86 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -71.84 -45.35 61.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.243 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.2 mmt -66.06 -26.01 67.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.663 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -67.95 -15.2 63.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.004 -0.543 . . . . 10.0 110.994 179.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -93.07 -5.0 51.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.322 0.582 . . . . 10.0 110.038 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.7 mp -98.1 145.15 26.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.29 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.5 p -77.66 170.55 16.38 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.171 -0.468 . . . . 10.0 109.862 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.83 -43.5 90.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.149 0.5 . . . . 10.0 110.364 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -65.55 -30.53 71.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.652 -0.704 . . . . 10.0 111.043 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -70.05 -33.91 72.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.622 0.249 . . . . 10.0 110.409 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 73.3 mt -65.45 -42.24 92.58 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -64.81 -31.3 72.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.261 -0.881 . . . . 10.0 109.417 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.6 -34.47 89.11 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.412 -0.813 . . . . 10.0 112.144 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -65.3 -36.16 83.21 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.979 -0.378 . . . . 10.0 109.979 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.9 m -61.74 -43.67 98.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.269 0.557 . . . . 10.0 109.66 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.9 -30.29 68.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.774 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -68.2 -45.89 72.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.592 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -58.53 -42.84 88.68 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.178 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -60.51 -46.63 89.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.914 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.21 -32.72 73.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.352 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 43.4 mtp180 -68.24 -49.35 61.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.857 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 82.6 mt -61.05 -31.96 71.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.006 0.432 . . . . 10.0 110.535 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -62.22 -44.99 95.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.902 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -83.08 -48.99 9.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.07 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 163.53 111.48 0.26 Allowed Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.51 -0.636 . . . . 10.0 111.51 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -166.66 154.68 9.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 43.9 t -99.83 131.67 46.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 118' ' ' LEU . 14.8 tp -60.09 -42.72 95.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.193 0.521 . . . . 10.0 110.269 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.6 mp0 -65.4 -19.68 66.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.014 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -87.21 -18.58 29.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.356 0.598 . . . . 10.0 110.176 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.7 mt -83.06 -13.68 55.3 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.951 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 89.3 mt -48.69 -53.41 36.69 Favored Pre-proline 0 CA--C 1.542 0.652 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -178.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.1 Cg_exo -53.38 -47.34 27.93 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.021 1.814 . . . . 10.0 113.098 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.49 ' O ' HG23 ' A' ' 70' ' ' VAL . 42.0 mt-10 -74.9 -46.45 35.9 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.813 -178.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.47 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -58.83 -49.97 75.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.977 -178.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -62.18 -34.73 76.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.85 -179.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.8 -44.38 85.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.192 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 66' ' ' GLU . 95.7 t -62.44 -45.69 98.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.237 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 67' ' ' ALA . 59.1 t -61.8 -44.94 99.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.127 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.7 ttm180 -60.26 -42.87 96.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.116 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.411 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 30.1 tp10 -61.36 -48.67 80.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.379 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.97 73.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.911 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.7 m -62.08 -35.11 77.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.952 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 73' ' ' GLU . 24.5 mtmt -78.36 -18.2 55.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.527 -179.264 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -98.42 -45.9 5.97 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 111.782 0.29 . . . . 10.0 111.782 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 76.5 t -76.05 -54.92 12.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.687 0.28 . . . . 10.0 111.639 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -90.11 -43.05 10.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.714 0.292 . . . . 10.0 111.205 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.2 16.62 24.75 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.806 -0.711 . . . . 10.0 111.591 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.6 mtm -131.04 124.18 30.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.754 0.311 . . . . 10.0 110.191 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.486 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 9.5 ttp180 -71.07 133.35 46.21 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.875 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.95 117.5 7.09 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.422 ' HB2' ' HG3' ' A' ' 87' ' ' GLN . 33.1 m-85 -56.66 149.56 17.52 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.451 0.469 . . . . 10.0 111.278 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -61.71 -34.08 75.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.037 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.55 ' HA ' HD12 ' A' ' 89' ' ' LEU . 20.6 m -68.1 -29.96 46.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 10.0 110.79 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.458 HE22 HD23 ' A' ' 110' ' ' LEU . 96.3 mt-30 -70.64 -31.09 67.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.07 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 74.6 mt -64.29 -34.19 77.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.793 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.55 HD12 ' HA ' ' A' ' 86' ' ' VAL . 14.5 mt -66.85 -49.75 64.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.684 178.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -63.58 -46.25 92.72 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.629 -0.714 . . . . 10.0 112.501 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.29 -31.93 78.92 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.996 -0.621 . . . . 10.0 112.213 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' MET . . . . . 0.546 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 14.9 ttm -72.6 -35.44 67.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.993 0.425 . . . . 10.0 110.44 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 89' ' ' LEU . 58.7 t -70.31 -36.33 66.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.127 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 93.8 mt -72.92 3.08 5.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.713 -0.676 . . . . 10.0 112.091 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -80.04 -30.08 39.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.336 0.589 . . . . 10.0 109.485 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -104.75 -167.22 1.32 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.409 -0.814 . . . . 10.0 111.051 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 -86.38 57.58 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.065 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 408' ' ' ASP . 31.4 m -127.9 147.79 50.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.957 -0.565 . . . . 10.0 112.05 -178.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.565 HD11 HD13 ' A' ' 407' ' ' LEU . 43.5 mm -100.16 123.85 53.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 108.745 -0.835 . . . . 10.0 108.745 177.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.69 134.45 51.96 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.05 0.452 . . . . 10.0 112.056 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 102' ' ' MET . 0.0 OUTLIER -97.21 158.72 15.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.61 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.449 ' SD ' ' HB2' ' A' ' 106' ' ' GLU . 49.2 ttm -171.69 134.97 0.84 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.836 -0.801 . . . . 10.0 108.836 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -62.06 151.6 34.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.239 0.542 . . . . 10.0 111.476 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.0 m -71.51 92.74 1.14 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.929 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 152.7 -28.85 0.84 Allowed Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.783 -0.722 . . . . 10.0 112.205 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.449 ' HB2' ' SD ' ' A' ' 102' ' ' MET . 5.5 mm-40 -66.96 -17.26 64.83 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.769 0.319 . . . . 10.0 111.135 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.28 67.21 0.64 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.744 -0.741 . . . . 10.0 112.429 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -61.07 -58.84 6.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.84 0.352 . . . . 10.0 111.049 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.1 -36.29 81.26 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.969 -179.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.458 HD23 HE22 ' A' ' 87' ' ' GLN . 31.6 tp -67.81 -27.2 66.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.271 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 95.7 m -80.19 -30.4 38.72 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.013 0.435 . . . . 10.0 111.252 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.554 ' HB1' HD21 ' A' ' 207' ' ' LEU . . . -67.29 -12.3 59.76 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.072 0.767 . . . . 10.0 113.072 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 31.8 p -75.63 -24.41 56.45 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.02 0.378 . . . . 10.0 112.02 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.406 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 52.4 mt -65.95 -56.23 18.29 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.098 0.407 . . . . 10.0 112.098 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 38.3 Cg_endo -65.06 -26.16 58.25 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.891 1.727 . . . . 10.0 111.881 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.28 -52.71 44.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.526 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.412 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 68.8 t80 -60.41 -43.9 96.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.082 0.467 . . . . 10.0 110.688 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.43 ' O ' HD11 ' A' ' 60' ' ' LEU . 34.7 tp -60.55 -51.07 71.0 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.638 -0.71 . . . . 10.0 112.009 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -73.31 -24.11 60.36 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.839 0.311 . . . . 10.0 111.839 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.457 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -67.12 -24.07 65.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.711 0.291 . . . . 10.0 110.975 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 71.6 mt -59.9 -26.46 65.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.609 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.0 p -66.48 -29.39 69.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.895 0.378 . . . . 10.0 111.171 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.96 14.14 67.78 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.782 -0.723 . . . . 10.0 112.602 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -93.06 -12.5 30.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.838 0.351 . . . . 10.0 111.165 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 88.85 119.49 1.67 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.783 -0.723 . . . . 10.0 113.012 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.1 t -80.41 115.54 23.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -86.16 92.0 8.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.004 0.43 . . . . 10.0 110.339 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 28.3 t -84.65 122.97 38.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.153 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 208' ' ' VAL . 87.1 t -109.7 122.47 64.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.363 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.22 148.16 39.45 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.831 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.599 ' HA ' HD11 ' A' ' 214' ' ' ILE . 4.1 m -54.17 -37.84 36.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 O-C-N 123.486 0.492 . . . . 10.0 112.029 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -141.44 168.53 19.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.561 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -75.17 -26.74 59.3 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.145 -0.48 . . . . 10.0 111.532 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -56.66 -52.88 63.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.892 0.377 . . . . 10.0 110.544 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 98.3 mt -70.76 -34.64 72.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.582 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.61 -52.6 64.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.687 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -67.81 -35.54 78.8 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.999 0.428 . . . . 10.0 110.339 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 138' ' ' ARG . 4.5 ttp180 -58.0 -59.03 5.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.061 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ASP . . . . . 0.405 ' CG ' HH21 ' A' ' 138' ' ' ARG . 2.2 m-20 -70.86 -27.98 64.23 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.597 0.592 . . . . 10.0 112.597 -178.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -59.81 -44.28 94.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.861 0.362 . . . . 10.0 110.906 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -88.89 -25.44 22.13 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.429 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -71.86 -46.92 56.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.916 0.388 . . . . 10.0 111.241 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -89.36 0.34 56.89 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.438 -0.347 . . . . 10.0 111.046 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 58.3 ttm-85 -60.69 -49.67 88.66 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' PRO . . . . . 0.485 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 28.0 Cg_exo -62.96 -10.57 20.88 Favored 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 122.178 1.919 . . . . 10.0 112.888 -179.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.0 tp -92.66 -50.17 5.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.052 0.453 . . . . 10.0 110.288 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -71.79 -45.87 60.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.007 -0.542 . . . . 10.0 112.004 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.94 -24.75 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.982 0.42 . . . . 10.0 110.792 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -70.37 -33.15 71.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.764 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 60.1 mt -84.29 -14.91 48.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.811 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 109.94 16.97 10.01 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.798 -0.715 . . . . 10.0 112.951 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 37.2 mt -102.58 134.08 46.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.795 0.331 . . . . 10.0 110.435 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.03 126.69 34.34 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.567 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 46.9 t -106.06 128.63 60.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.908 0.385 . . . . 10.0 110.828 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -124.13 146.99 16.49 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.075 -0.583 . . . . 10.0 111.773 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.6 tp -118.56 125.8 74.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.062 0.458 . . . . 10.0 110.44 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -101.68 113.38 26.49 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.054 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 36.0 mt -100.37 141.71 23.23 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.742 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' PRO . . . . . 0.462 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 24.0 Cg_endo -61.07 107.21 0.44 Allowed 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.962 2.441 . . . . 10.0 112.854 -179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.69 16.3 46.17 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.021 -0.609 . . . . 10.0 113.372 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 12.4 ptm -77.64 159.58 76.54 Favored Pre-proline 0 CA--C 1.535 0.393 0 CA-C-N 117.26 0.53 . . . . 10.0 109.9 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -52.06 143.52 40.74 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.062 2.508 . . . . 10.0 113.291 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' ALA . . . . . 0.483 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -57.89 -49.11 95.53 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.794 -0.639 . . . . 10.0 112.422 -179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 41.9 Cg_exo -58.69 -36.31 97.36 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.599 1.533 . . . . 10.0 112.046 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.02 -39.25 90.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.513 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.411 ' HZ2' ' CG ' ' A' ' 185' ' ' ASP . 57.5 mttm -60.95 -43.58 98.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.155 179.011 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -59.8 -39.37 84.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.667 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -68.16 -39.32 82.63 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.988 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -73.08 -38.87 66.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.011 -0.541 . . . . 10.0 111.501 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -75.54 -26.29 57.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.686 0.279 . . . . 10.0 111.564 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 171' ' ' ALA . . . . . 0.403 ' HA ' ' NE ' ' A' ' 201' ' ' ARG . . . -80.34 1.48 28.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.048 0.452 . . . . 10.0 110.756 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -81.61 176.32 9.75 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.802 -0.636 . . . . 10.0 109.722 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' ASP . . . . . 0.457 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 16.0 m-20 -78.24 -33.42 49.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.881 0.372 . . . . 10.0 110.522 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 88.0 mt -136.79 122.16 26.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.121 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.1 m -115.51 122.73 46.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.833 0.349 . . . . 10.0 111.194 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -97.95 136.2 38.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.898 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.81 170.32 43.08 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.441 -0.885 . . . . 10.0 112.817 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.5 m -88.48 151.12 22.75 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 122.43 0.292 . . . . 10.0 110.679 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -57.62 -42.31 83.09 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 -179.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -58.21 -54.26 48.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.615 -0.266 . . . . 10.0 111.421 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 181' ' ' GLU . . . . . 0.462 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.4 tp10 -65.27 -37.67 87.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.091 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.81 -39.24 80.56 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.897 0.379 . . . . 10.0 110.701 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -76.13 -42.64 23.57 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.85 -0.69 . . . . 10.0 111.596 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -37.97 86.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.89 0.376 . . . . 10.0 110.429 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 185' ' ' ASP . . . . . 0.411 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 8.3 m-20 -59.5 -44.06 93.21 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.429 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.64 -38.78 91.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.47 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 187' ' ' LEU . . . . . 0.462 HD11 HG22 ' A' ' 375' ' ' ILE . 47.5 mt -64.58 -46.62 81.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.819 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 28.3 mtm180 -69.68 -35.86 75.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.124 0.488 . . . . 10.0 110.545 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.03 -50.65 71.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.483 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.3 -0.9 30.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.732 -0.667 . . . . 10.0 112.438 -178.178 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 25.7 ttp -105.39 10.77 33.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.193 0.521 . . . . 10.0 110.403 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 192' ' ' ALA . . . . . 0.441 ' HB1' ' HB2' ' A' ' 197' ' ' GLU . . . -78.05 166.07 23.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.254 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -103.83 -26.24 12.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.078 0.466 . . . . 10.0 110.227 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -118.05 138.52 25.56 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.49 -23.94 76.59 Favored 'Trans proline' 0 CA--C 1.53 0.284 0 C-N-CA 122.614 2.209 . . . . 10.0 112.534 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 37.8 mp0 -78.44 -13.01 60.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.464 -0.334 . . . . 10.0 111.079 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 197' ' ' GLU . . . . . 0.441 ' HB2' ' HB1' ' A' ' 192' ' ' ALA . 67.6 mt-10 -82.39 -4.99 58.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.549 -0.296 . . . . 10.0 110.902 -179.676 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 198' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' A' ' 198' ' ' ARG . 45.6 mtt85 -62.68 157.78 20.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.284 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 12.2 m -133.29 -14.63 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.057 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -91.79 163.79 13.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.179 0.514 . . . . 10.0 111.558 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 201' ' ' ARG . . . . . 0.403 ' NE ' ' HA ' ' A' ' 171' ' ' ALA . 4.6 mtm180 -122.76 174.86 6.86 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.679 -0.86 . . . . 10.0 108.679 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -55.23 124.67 17.74 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.122 0.487 . . . . 10.0 111.182 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 10.4 mt -79.82 72.32 6.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.307 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 9.7 t-160 -88.49 -53.57 4.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.733 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -128.78 138.68 52.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.916 0.388 . . . . 10.0 111.789 -178.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 206' ' ' ALA . . . . . 0.575 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -129.97 135.84 48.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.552 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 207' ' ' LEU . . . . . 0.554 HD21 ' HB1' ' A' ' 112' ' ' ALA . 35.7 tp -131.69 109.92 10.52 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.354 -179.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 208' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 2.9 p -104.97 140.55 22.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.67 0.272 . . . . 10.0 110.98 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.34 -40.59 70.6 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 210' ' ' GLU . . . . . 0.425 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 7.5 tt0 -135.27 113.72 11.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.036 0.446 . . . . 10.0 111.029 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 211' ' ' VAL . . . . . 0.495 HG11 HD12 ' A' ' 99' ' ' ILE . 34.2 m -84.54 -14.88 11.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.111 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 212' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 0.9 OUTLIER -55.53 -71.13 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.729 -179.18 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.1 m -76.13 -38.09 57.23 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.473 0.546 . . . . 10.0 112.473 -178.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 214' ' ' ILE . . . . . 0.599 HD11 ' HA ' ' A' ' 131' ' ' VAL . 45.5 mt -71.55 -43.54 71.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 113.993 1.108 . . . . 10.0 113.993 -177.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 215' ' ' LEU . . . . . 0.407 HD22 ' CE2' ' A' ' 405' ' ' TYR . 17.0 mt -93.74 -50.68 5.26 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.929 0.714 . . . . 10.0 112.929 -177.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 216' ' ' ILE . . . . . 0.421 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 48.6 mm -73.14 -56.68 8.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -70.97 -39.49 72.48 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 218' ' ' GLU . . . . . 0.51 ' HB2' ' O ' ' A' ' 214' ' ' ILE . 6.0 mm-40 -91.61 19.27 6.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.89 -51.4 69.44 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 220' ' ' ARG . . . . . 0.433 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -96.85 32.36 2.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.96 0.409 . . . . 10.0 111.392 -178.571 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 17.4 m -101.86 105.02 39.24 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-O 120.92 0.39 . . . . 10.0 110.197 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 222' ' ' PRO . . . . . 0.433 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 73.1 Cg_endo -91.33 132.25 1.44 Allowed 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.939 2.426 . . . . 10.0 112.778 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 223' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 374' ' ' SER . 69.2 mt -78.22 105.65 9.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.156 -0.474 . . . . 10.0 109.768 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 59.0 mt -86.49 122.88 39.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.775 -0.648 . . . . 10.0 112.18 -178.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 59.8 mt -105.45 134.29 47.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.273 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 22.3 m -116.41 166.88 11.56 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.477 -0.194 . . . . 10.0 110.477 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -128.91 158.77 22.05 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.514 -0.85 . . . . 10.0 112.797 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -76.93 -22.43 11.56 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.655 2.237 . . . . 10.0 112.362 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -130.27 71.91 1.47 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -81.86 -108.82 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.905 -0.589 . . . . 10.0 112.033 -178.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.59 175.12 3.03 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.272 0.558 . . . . 10.0 111.801 -178.01 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 232' ' ' SER . . . . . 0.516 ' HB2' HG13 ' B' ' 17' ' ' VAL . 15.5 m -142.18 145.37 34.09 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.492 0.663 . . . . 10.0 111.677 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 233' ' ' SER . . . . . 0.421 ' HB3' ' HB ' ' A' ' 365' ' ' ILE . 0.1 OUTLIER -57.01 -35.81 69.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.911 -1.041 . . . . 10.0 111.521 179.565 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -50.22 -42.01 50.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.092 -0.958 . . . . 10.0 112.876 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 235' ' ' MET . . . . . 0.502 ' HB2' HG11 ' B' ' 17' ' ' VAL . 0.4 OUTLIER -72.06 -58.94 3.02 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.815 -0.354 . . . . 10.0 111.695 -178.956 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 236' ' ' TYR . . . . . 0.449 ' HB3' ' HB2' ' A' ' 359' ' ' ALA . 43.8 m-85 -55.9 -41.43 74.49 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.249 0.462 . . . . 10.0 112.249 -178.495 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -67.5 -40.33 85.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.574 0.226 . . . . 10.0 111.1 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -40.6 88.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.978 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 98.9 t -68.48 -43.18 84.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.123 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -78.18 7.44 6.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.712 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 3.8 tptm -89.1 -25.94 21.62 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.672 -0.24 . . . . 10.0 111.512 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 10.8 tp -88.35 -18.27 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.885 0.374 . . . . 10.0 111.555 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 243' ' ' ILE . . . . . 0.459 ' HB ' ' HD3' ' A' ' 244' ' ' PRO . 57.1 mt -63.55 -48.69 80.52 Favored Pre-proline 0 CA--C 1.541 0.603 0 N-CA-C 112.765 0.654 . . . . 10.0 112.765 -179.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 244' ' ' PRO . . . . . 0.459 ' HD3' ' HB ' ' A' ' 243' ' ' ILE . 24.6 Cg_exo -65.17 -6.71 13.65 Favored 'Trans proline' 0 C--N 1.358 1.06 0 C-N-CA 122.144 1.896 . . . . 10.0 112.996 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -81.63 -16.84 50.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.966 0.413 . . . . 10.0 110.651 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 11.8 mt -90.74 162.42 14.89 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.551 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 29.7 pt -114.6 148.19 17.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.336 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 248' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 248' ' ' ARG . 6.3 ptm85 -77.25 107.32 9.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.204 0.526 . . . . 10.0 111.657 -179.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 249' ' ' GLN . . . . . 0.417 ' HG3' ' N ' ' A' ' 250' ' ' GLU . 6.2 pt20 169.38 -30.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.64 -1.164 . . . . 10.0 108.847 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 250' ' ' GLU . . . . . 0.492 ' HG2' ' N ' ' A' ' 251' ' ' LYS . 16.9 tt0 -179.59 163.29 1.17 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.263 -0.88 . . . . 10.0 109.233 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.492 ' N ' ' HG2' ' A' ' 250' ' ' GLU . 48.7 mttm 75.91 80.8 0.1 Allowed 'General case' 0 N--CA 1.468 0.467 0 O-C-N 123.992 0.808 . . . . 10.0 112.479 178.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 252' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 45.48 36.02 2.26 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.749 -1.114 . . . . 10.0 113.263 177.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -95.17 -33.28 12.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.08 0.467 . . . . 10.0 110.833 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -113.58 172.98 6.64 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.954 -179.076 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.7 -21.61 32.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.305 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 36.2 m -155.03 -69.1 0.13 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.165 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 24.4 t80 62.55 -84.76 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.61 0.569 . . . . 10.0 110.971 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 60.63 -163.34 0.25 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.874 0.47 . . . . 10.0 111.308 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -78.39 -5.48 87.73 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.863 -0.684 . . . . 10.0 111.984 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -83.9 -68.46 0.71 Allowed 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 110.004 -0.369 . . . . 10.0 110.004 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 68.07 -146.75 46.78 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.964 -0.636 . . . . 10.0 112.901 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -161.97 152.13 16.93 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.833 -0.803 . . . . 10.0 108.833 -179.515 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -73.62 -167.62 0.47 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 120.525 -0.47 . . . . 10.0 110.862 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.72 69.85 0.12 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.412 0.893 . . . . 10.0 113.412 -178.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 1.4 m -153.97 35.45 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 109.027 -0.731 . . . . 10.0 109.027 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 266' ' ' ASP . . . . . 0.566 ' OD1' ' HG2' ' A' ' 268' ' ' LYS . 2.1 t0 73.54 167.02 0.3 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.143 -0.935 . . . . 10.0 110.008 -178.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -126.8 11.98 7.27 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 121.029 -0.269 . . . . 10.0 111.538 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 268' ' ' LYS . . . . . 0.566 ' HG2' ' OD1' ' A' ' 266' ' ' ASP . 0.6 OUTLIER -68.95 113.71 6.6 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.712 0.291 . . . . 10.0 110.37 179.73 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 20.6 m -87.08 78.86 8.83 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.092 0.473 . . . . 10.0 110.942 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 7.2 mmt85 -69.6 -0.86 7.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.216 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -73.83 -15.08 61.18 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.691 179.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 23.3 t 64.12 94.04 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 O-C-N 123.563 0.539 . . . . 10.0 111.111 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -112.57 -80.48 0.59 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.132 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 47.7 mt 59.09 83.0 0.13 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.157 0.504 . . . . 10.0 111.088 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 275' ' ' THR . . . . . 0.404 HG23 ' HG2' ' A' ' 277' ' ' ARG . 4.8 t -132.32 154.33 49.83 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.631 -179.22 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -74.6 73.8 1.98 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.383 -0.372 . . . . 10.0 111.588 -179.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 277' ' ' ARG . . . . . 0.404 ' HG2' HG23 ' A' ' 275' ' ' THR . 2.2 mmp_? -115.53 176.11 5.22 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.18 -0.304 . . . . 10.0 110.18 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 278' ' ' GLY . . . . . 0.409 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . 80.89 -59.11 4.76 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.131 -0.557 . . . . 10.0 111.935 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.498 ' O ' HG22 ' A' ' 282' ' ' ILE . 4.1 mm? 72.2 -47.66 0.67 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.52 0.728 . . . . 10.0 111.666 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.36 -17.88 22.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.068 0.461 . . . . 10.0 111.136 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 80.5 mt -68.32 -41.24 81.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.453 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 282' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 279' ' ' LEU . 7.3 tp -62.57 -20.93 26.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 120.837 0.351 . . . . 10.0 111.079 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -73.04 -24.67 60.74 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.184 0.516 . . . . 10.0 109.951 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -88.43 -36.14 16.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.755 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.61 -43.72 96.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.401 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 48.1 mt -70.23 173.13 7.07 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.284 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 287' ' ' VAL . . . . . 0.539 ' O ' ' HG2' ' A' ' 288' ' ' LYS . 21.6 t 69.88 161.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.004 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 288' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' A' ' 287' ' ' VAL . 0.0 OUTLIER 67.78 179.05 0.23 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.602 0.761 . . . . 10.0 111.291 -179.914 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 72.33 170.65 0.32 Allowed 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.308 0.643 . . . . 10.0 112.102 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -88.55 -14.86 60.93 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 115.581 -0.736 . . . . 10.0 113.241 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 291' ' ' ILE . . . . . . . . . . . . . 13.1 tt -83.45 136.57 22.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 O-C-N 122.51 -0.406 . . . . 10.0 110.779 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 43.0 ttm 64.5 106.43 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 O-C-N 123.71 0.631 . . . . 10.0 111.962 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -87.98 -21.03 25.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.021 0.439 . . . . 10.0 110.585 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -89.8 -179.85 5.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.765 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -104.77 68.57 0.26 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 121.046 -0.597 . . . . 10.0 111.991 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -95.61 157.14 16.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.922 0.391 . . . . 10.0 110.746 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 48.5 m -90.36 124.54 35.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.52 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.8 tp -75.58 -13.26 60.34 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -178.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 299' ' ' TYR . . . . . 0.413 ' HA ' ' SD ' ' A' ' 307' ' ' MET . 46.2 p90 -93.01 5.83 50.08 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.596 -0.442 . . . . 10.0 111.382 -179.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 49.0 m -75.74 155.64 85.02 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.241 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 301' ' ' PRO . . . . . 0.403 ' HB3' ' HB3' ' A' ' 806' ' ' GLU . 15.7 Cg_endo -55.4 -30.01 71.1 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 123.221 2.614 . . . . 10.0 113.39 -179.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -81.71 -6.96 59.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.019 0.438 . . . . 10.0 111.381 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -118.72 7.11 11.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.905 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 10.6 tp -60.81 -25.08 34.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.334 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -63.49 -50.2 70.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.149 0.5 . . . . 10.0 109.928 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.16 -41.76 73.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.608 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 307' ' ' MET . . . . . 0.413 ' SD ' ' HA ' ' A' ' 299' ' ' TYR . 27.1 ttt -57.36 -43.72 83.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.983 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -66.32 -33.81 76.57 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.327 -0.233 . . . . 10.0 110.857 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -74.84 -39.95 61.32 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.177 -0.209 . . . . 10.0 111.348 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 23.8 m -70.59 -35.28 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 C-N-CA 120.679 -0.408 . . . . 10.0 110.599 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 60.4 m -65.56 -35.59 81.28 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.384 0.611 . . . . 10.0 109.758 178.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 312' ' ' ALA . . . . . . . . . . . . . . . -67.08 -32.87 74.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.855 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 313' ' ' ALA . . . . . 0.455 ' HA ' ' CB ' ' A' ' 356' ' ' ALA . . . -73.29 -33.75 65.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.488 -0.778 . . . . 10.0 110.554 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 1.8 mp -70.27 -46.63 63.97 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.773 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 315' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 319' ' ' LEU . 30.5 ptt180 -64.38 -26.29 68.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.851 0.358 . . . . 10.0 110.706 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -77.48 2.33 16.54 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.235 0.54 . . . . 10.0 110.814 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -115.56 2.6 13.84 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.883 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -140.39 -51.93 0.49 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.335 -0.393 . . . . 10.0 111.073 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 319' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 315' ' ' ARG . 3.6 mm? -67.56 -43.06 81.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.034 0.445 . . . . 10.0 110.489 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -98.7 97.59 8.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.076 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 321' ' ' THR . . . . . 0.447 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 3.0 m -88.48 135.73 33.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.076 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 322' ' ' ARG . . . . . 0.464 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 0.2 OUTLIER -60.49 145.93 46.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.715 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 323' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 0.2 OUTLIER 81.42 -50.07 0.26 Allowed 'General case' 0 N--CA 1.468 0.446 0 O-C-N 124.306 1.003 . . . . 10.0 112.83 178.393 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 324' ' ' VAL . . . . . 0.447 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 13.6 p -86.28 -35.19 8.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 112.671 0.619 . . . . 10.0 112.671 -178.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -97.64 -35.17 10.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.103 0.478 . . . . 10.0 110.957 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -151.28 146.31 25.95 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.364 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 9.9 tp -122.98 132.14 71.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.195 -0.668 . . . . 10.0 109.195 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 328' ' ' VAL . . . . . 0.451 HG12 HG22 ' A' ' 333' ' ' VAL . 2.7 m -102.59 130.89 51.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.165 0.507 . . . . 10.0 111.053 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 329' ' ' LYS . . . . . 0.559 ' O ' ' HD3' ' A' ' 329' ' ' LYS . 0.0 OUTLIER -145.61 127.61 15.53 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.122 179.48 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 3.7 p30 49.16 30.14 2.88 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.964 0.906 . . . . 10.0 112.941 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 331' ' ' GLY . . . . . 0.441 ' HA2' HG12 ' A' ' 363' ' ' VAL . . . 91.37 -2.42 78.06 Favored Glycine 0 C--N 1.328 0.138 0 C-N-CA 120.74 -0.743 . . . . 10.0 113.195 178.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -100.32 136.86 39.56 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.811 0.339 . . . . 10.0 110.306 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 333' ' ' VAL . . . . . 0.451 HG22 HG12 ' A' ' 328' ' ' VAL . 27.1 t -104.06 115.31 45.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.573 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 59.3 mt -107.13 130.59 58.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.39 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 4.3 mp -77.52 126.74 38.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 46.8 t -101.99 122.03 53.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.243 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.53 119.82 23.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.91 -0.587 . . . . 10.0 109.727 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -83.2 -12.61 56.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.989 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -76.94 -51.98 10.22 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.07 -0.252 . . . . 10.0 111.638 -178.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.49 -10.41 11.94 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.211 0.448 . . . . 10.0 112.211 -179.087 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 84.98 30.51 25.76 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.809 -0.71 . . . . 10.0 111.852 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -87.33 161.72 17.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.91 0.386 . . . . 10.0 110.81 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.31 115.71 27.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.278 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 59.4 mtt -113.14 101.15 9.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.869 0.366 . . . . 10.0 110.684 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -95.65 -26.05 15.89 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.982 0.42 . . . . 10.0 110.968 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -96.8 48.53 1.63 Allowed Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.767 -0.73 . . . . 10.0 112.894 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -135.99 106.4 6.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.016 0.436 . . . . 10.0 110.441 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 348' ' ' ARG . . . . . 0.408 ' NH2' ' HB2' ' A' ' 366' ' ' GLN . 5.0 tpt180 -101.0 95.81 6.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.272 -179.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -73.48 144.13 46.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 10.0 109.948 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 6.1 m -91.53 -168.8 2.12 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 29.7 t70 71.63 -57.66 0.6 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.418 1.087 . . . . 10.0 112.144 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 145.01 58.34 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.433 -0.889 . . . . 10.0 112.614 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 9.0 mp -97.3 -25.87 15.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.08 0.467 . . . . 10.0 110.872 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 354' ' ' HIS . . . . . 0.408 ' O ' ' HB ' ' A' ' 357' ' ' VAL . 29.9 p80 -129.41 -12.32 4.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.436 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 355' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -59.73 -34.39 72.88 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.639 -0.709 . . . . 10.0 110.71 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 356' ' ' ALA . . . . . 0.455 ' CB ' ' HA ' ' A' ' 313' ' ' ALA . . . -83.42 -23.37 32.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.878 -0.601 . . . . 10.0 109.67 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 357' ' ' VAL . . . . . 0.432 ' O ' ' HG2' ' A' ' 360' ' ' LYS . 40.9 t -66.68 -43.89 89.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.458 -0.792 . . . . 10.0 109.479 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -64.38 -18.18 64.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.232 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 359' ' ' ALA . . . . . 0.449 ' HB2' ' HB3' ' A' ' 236' ' ' TYR . . . -91.87 -35.58 13.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.818 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 360' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 357' ' ' VAL . 12.5 ptmm? -74.89 -36.94 62.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.716 0.294 . . . . 10.0 110.537 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -84.31 163.64 19.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.215 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -84.01 50.71 4.45 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.108 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 363' ' ' VAL . . . . . 0.441 HG12 ' HA2' ' A' ' 331' ' ' GLY . 18.9 m -115.34 177.32 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.479 0.181 . . . . 10.0 110.567 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.56 109.07 21.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.814 0.34 . . . . 10.0 110.685 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 365' ' ' ILE . . . . . 0.447 ' H ' HG13 ' A' ' 365' ' ' ILE . 12.4 mt -61.92 127.97 22.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.974 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 366' ' ' GLN . . . . . 0.408 ' HB2' ' NH2' ' A' ' 348' ' ' ARG . 36.6 mm-40 -70.44 166.93 19.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.497 -0.319 . . . . 10.0 110.787 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -72.5 -18.96 61.62 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.973 0.416 . . . . 10.0 110.619 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 70.13 -178.13 0.22 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.397 -0.819 . . . . 10.0 112.315 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -154.31 99.11 2.18 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.118 -0.946 . . . . 10.0 109.32 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -110.55 -101.97 0.39 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.842 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 89.2 m -163.46 137.36 5.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.535 0.207 . . . . 10.0 111.286 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 21.6 mt -96.65 -62.24 1.3 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -138.51 154.14 48.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.469 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 374' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 58.1 m -156.01 146.13 21.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.009 0.433 . . . . 10.0 111.478 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 375' ' ' ILE . . . . . 0.462 HG22 HD11 ' A' ' 187' ' ' LEU . 16.5 tt -145.96 141.0 21.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.752 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.63 145.43 25.68 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.318 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -56.8 -41.14 77.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.774 0.321 . . . . 10.0 110.314 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 378' ' ' GLN . . . . . 0.518 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.4 tm0? -55.96 -41.9 75.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.902 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -78.06 -30.66 49.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.054 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -68.1 -49.05 63.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.989 0.423 . . . . 10.0 110.304 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -72.78 -17.31 61.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.758 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.63 -25.27 63.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.348 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 73.9 mt -78.92 -12.87 60.05 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.806 -0.633 . . . . 10.0 111.753 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 384' ' ' TYR . . . . . 0.575 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 30.1 m-85 -80.81 138.75 36.25 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.799 0.333 . . . . 10.0 110.875 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -72.95 -73.48 0.2 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.186 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -91.41 90.55 7.73 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.47 HD23 HD21 ' A' ' 407' ' ' LEU . 66.2 tp -99.46 106.34 18.37 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.58 -0.737 . . . . 10.0 109.705 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -122.74 161.44 23.92 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.801 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -179.3 172.64 44.66 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.136 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 65.2 mtm -112.71 152.46 29.04 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.951 0.405 . . . . 10.0 110.576 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 9.6 t -122.04 -176.69 3.4 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.076 -0.713 . . . . 10.0 109.076 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -106.43 165.18 13.53 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.623 -0.799 . . . . 10.0 111.584 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 4.7 m -71.08 74.52 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.399 0.618 . . . . 10.0 109.99 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 394' ' ' ALA . . . . . 0.468 ' HB1' ' HA ' ' A' ' 566' ' ' ARG . . . -131.39 -48.72 0.99 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.992 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 395' ' ' ASP . . . . . 0.461 ' CG ' ' H ' ' A' ' 396' ' ' THR . 21.0 t70 66.38 -140.54 0.16 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 -178.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 396' ' ' THR . . . . . 0.461 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 4.8 m 70.0 -77.72 0.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 122.777 0.431 . . . . 10.0 111.652 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -81.72 15.15 2.28 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.2 0.524 . . . . 10.0 111.191 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 398' ' ' ALA . . . . . 0.448 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -66.99 -23.43 65.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.714 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -75.74 -10.92 59.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.906 0.384 . . . . 10.0 111.091 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 400' ' ' GLU . . . . . 0.445 ' HG2' ' CD1' ' A' ' 639' ' ' PHE . 43.0 mt-10 -89.27 -14.27 36.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.506 -0.316 . . . . 10.0 111.085 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 401' ' ' PHE . . . . . 0.448 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 18.7 m-85 -60.9 -51.7 68.17 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.961 0.41 . . . . 10.0 110.553 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 402' ' ' SER . . . . . 0.411 ' O ' ' HA ' ' A' ' 406' ' ' LYS . 0.7 OUTLIER -75.62 -21.0 58.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.418 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 29.1 m -81.84 -47.17 13.16 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.5 mt -88.68 -60.2 2.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 112.709 0.633 . . . . 10.0 112.709 -177.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 405' ' ' TYR . . . . . 0.518 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 68.8 m-85 -90.98 -4.78 56.18 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.635 0.606 . . . . 10.0 112.635 -177.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 406' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 402' ' ' SER . 67.4 mmtt 59.82 53.6 4.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.072 0.463 . . . . 10.0 110.205 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 407' ' ' LEU . . . . . 0.565 HD13 HD11 ' A' ' 99' ' ' ILE . 34.9 mt -111.47 144.17 41.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.257 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 408' ' ' ASP . . . . . 0.571 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . 36.8 t0 -78.87 167.95 20.42 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.884 -0.784 . . . . 10.0 108.884 178.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 19.6 m -138.72 121.82 16.84 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 121.963 -0.46 . . . . 10.0 112.123 -178.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 85.7 t -132.39 131.31 60.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.934 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.2 t -94.11 119.62 42.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.222 -0.288 . . . . 10.0 110.222 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 41.1 t -93.56 132.66 29.61 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 116.405 -0.362 . . . . 10.0 110.587 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -67.96 159.25 53.78 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.763 2.309 . . . . 10.0 112.548 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 15.2 p -82.84 166.5 18.92 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.914 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -63.11 -37.23 86.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.421 0.629 . . . . 10.0 109.685 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 416' ' ' ARG . . . . . 0.404 ' HB2' ' HA3' ' A' ' 579' ' ' GLY . 26.4 mtm180 -136.86 147.88 60.93 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.913 178.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.52 135.6 50.27 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 122.297 1.998 . . . . 10.0 111.942 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 56.8 mtm -71.86 138.65 48.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.869 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.3 mt -104.17 10.74 8.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.61 0.719 . . . . 10.0 109.431 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 15.7 ttp-105 -66.62 124.99 24.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.095 -0.957 . . . . 10.0 110.928 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.543 ' O ' ' HA ' ' A' ' 583' ' ' SER . 89.4 mttt -105.89 136.25 45.87 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -104.82 148.98 26.05 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.864 0.364 . . . . 10.0 111.014 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 423' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 424' ' ' PRO . 72.5 mt -125.25 148.04 59.44 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.941 179.495 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 424' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 423' ' ' LEU . 39.4 Cg_exo -61.47 164.31 15.75 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.914 2.409 . . . . 10.0 113.986 -178.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -84.24 116.96 23.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.018 -0.992 . . . . 10.0 109.608 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 59.0 mt -96.22 102.72 14.55 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.3 0.571 . . . . 10.0 110.256 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 427' ' ' VAL . . . . . 0.483 HG22 ' HB2' ' A' ' 588' ' ' LEU . 42.9 t -93.19 129.44 43.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.199 -0.909 . . . . 10.0 110.772 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 428' ' ' TYR . . . . . 0.469 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 79.3 m-85 -112.39 -178.6 3.45 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.078 179.025 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 429' ' ' MET . . . . . 0.572 ' HB2' ' OE2' ' A' ' 433' ' ' GLU . 20.1 mmt -74.21 -76.7 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.879 0.371 . . . . 10.0 111.112 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 59.4 p -89.72 160.45 16.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.162 -0.472 . . . . 10.0 111.052 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 431' ' ' GLU . . . . . 0.451 ' OE1' ' HD3' ' A' ' 434' ' ' LYS . 9.5 tp10 -60.85 -27.26 67.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.717 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -59.47 -48.47 81.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.895 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 433' ' ' GLU . . . . . 0.572 ' OE2' ' HB2' ' A' ' 429' ' ' MET . 14.3 mt-10 -62.68 -39.17 93.12 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.079 0.466 . . . . 10.0 110.29 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 434' ' ' LYS . . . . . 0.513 ' O ' HG13 ' A' ' 438' ' ' ILE . 63.9 tttt -60.67 -51.45 69.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.311 -0.859 . . . . 10.0 110.798 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 435' ' ' ILE . . . . . 0.497 ' O ' HG12 ' A' ' 439' ' ' ILE . 49.4 mm -66.4 -42.79 91.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.982 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -60.3 -37.39 80.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.78 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.99 -37.4 85.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.444 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 438' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 434' ' ' LYS . 76.8 mt -62.95 -42.95 98.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.922 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 439' ' ' ILE . . . . . 0.497 HG12 ' O ' ' A' ' 435' ' ' ILE . 41.6 mm -56.89 -42.36 78.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.674 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -64.54 -47.28 79.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.165 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -59.89 -39.09 84.16 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.079 0.466 . . . . 10.0 110.411 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.504 HG12 HG11 ' A' ' 452' ' ' VAL . 78.7 mt -71.38 -45.74 67.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.547 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -50.03 -49.68 50.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.836 -0.62 . . . . 10.0 111.468 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -58.93 -44.04 91.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.672 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.44 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 38.3 mtt-85 -75.17 -22.0 58.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.316 -178.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 29.7 m -68.34 -36.62 79.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.128 0.49 . . . . 10.0 110.163 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.9 -25.55 30.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.999 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 34.8 mttp -79.14 -31.36 44.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.209 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 101.57 35.64 4.03 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.429 -0.891 . . . . 10.0 112.698 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 450' ' ' GLN . . . . . 0.646 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 59.7 tt0 -112.8 125.6 29.63 Favored Pre-proline 0 C--N 1.323 -0.561 0 O-C-N 122.673 -0.31 . . . . 10.0 110.825 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -65.36 136.88 48.93 Favored 'Trans proline' 0 C--O 1.237 0.447 0 C-N-CA 122.497 2.131 . . . . 10.0 111.153 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.504 HG11 HG12 ' A' ' 442' ' ' ILE . 60.9 t -123.04 122.96 66.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.505 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 45.7 tp -109.7 112.22 24.15 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 41.5 t -96.06 121.31 46.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.13 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -103.93 105.01 2.55 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.713 -0.756 . . . . 10.0 112.175 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 17.2 p -103.02 139.51 38.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.754 0.312 . . . . 10.0 110.529 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 457' ' ' ILE . . . . . 0.444 HG12 ' HB2' ' A' ' 560' ' ' GLU . 7.5 pt -100.88 3.89 10.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.378 0.609 . . . . 10.0 110.051 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 3.5 p -133.82 128.8 35.48 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.978 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 28.8 mt -62.12 -36.7 75.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.025 0.44 . . . . 10.0 110.587 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.417 ' H ' ' CD ' ' A' ' 460' ' ' GLU . 1.6 mp0 -57.95 -41.59 83.17 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.582 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -36.74 77.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.844 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 3.8 m -58.98 -46.07 89.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.951 0.405 . . . . 10.0 110.402 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -71.86 -32.32 67.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.66 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 61.4 tp -68.43 -54.88 14.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.616 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.9 p -63.48 -30.16 49.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.904 0.383 . . . . 10.0 110.336 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 10.5 t -64.5 -43.91 92.6 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -65.45 -42.43 92.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.33 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -63.28 -43.51 97.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.619 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 47.0 mt -62.88 -42.03 99.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.246 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 35.3 m -64.41 -34.89 79.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.045 0.45 . . . . 10.0 110.017 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -63.29 -39.8 95.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.049 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.09 -4.88 56.75 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.295 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 75.88 26.78 63.92 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.025 -0.607 . . . . 10.0 112.378 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 71.3 mt -94.35 116.13 34.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.916 0.388 . . . . 10.0 110.803 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -64.2 131.67 48.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.202 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -155.93 157.89 37.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.992 -178.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -121.41 134.54 55.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.933 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 11.0 t -110.6 132.63 58.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.681 0.277 . . . . 10.0 110.809 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.09 164.66 22.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.529 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -157.1 117.9 3.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.144 -0.48 . . . . 10.0 109.834 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -59.57 -21.31 60.13 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.911 -0.586 . . . . 10.0 112.27 -179.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -76.38 -19.78 57.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.684 0.278 . . . . 10.0 111.113 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -127.18 64.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.473 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -59.59 -30.4 68.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.232 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.55 -28.89 69.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.583 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -84.56 -33.9 23.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.02 0.438 . . . . 10.0 109.898 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -58.37 -36.91 74.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.723 -0.672 . . . . 10.0 110.966 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -53.62 -35.6 61.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 10.0 111.974 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -83.01 -35.16 26.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.917 0.389 . . . . 10.0 110.675 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 75.8 mt -66.86 -54.0 29.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.297 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 49.4 t -61.54 -30.67 48.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.16 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -60.69 -29.96 69.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.607 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 71.4 mm-40 -114.27 21.38 14.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.773 0.321 . . . . 10.0 110.942 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.68 -17.63 62.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.028 0.442 . . . . 10.0 111.069 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -101.27 15.27 57.82 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.046 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -79.33 142.09 58.18 Favored Pre-proline 0 C--N 1.324 -0.542 0 N-CA-C 110.075 -0.342 . . . . 10.0 110.075 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.93 123.3 12.14 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.539 2.16 . . . . 10.0 112.789 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 71.5 16.68 5.88 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.615 -0.721 . . . . 10.0 112.751 178.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.74 110.23 21.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.984 0.421 . . . . 10.0 110.605 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 20.4 t -92.74 114.44 29.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.983 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 2.0 m -115.95 134.3 55.12 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.02 -179.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 62.7 mt -110.61 120.75 62.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 120.85 0.357 . . . . 10.0 110.069 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -111.29 124.25 51.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.605 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 14.5 m -103.56 119.65 39.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.54 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 14.1 m120 54.98 48.14 20.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.619 -0.718 . . . . 10.0 111.956 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 49.2 ttm -74.72 121.2 21.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.099 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -69.66 -174.16 0.69 Allowed 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.608 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -73.89 -178.13 37.2 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.065 -0.588 . . . . 10.0 112.587 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.425 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 52.6 mtt180 63.98 -95.52 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.83 0.452 . . . . 10.0 110.504 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 81.21 167.04 37.4 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.929 -0.653 . . . . 10.0 113.096 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.59 167.81 21.2 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.618 0.247 . . . . 10.0 111.087 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -85.53 106.76 17.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.747 0.308 . . . . 10.0 110.339 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 65.9 mt -80.62 108.95 14.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.257 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 19.6 t -88.12 127.78 40.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.638 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 50.3 mt -71.6 132.3 44.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.162 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 90.72 11.52 61.9 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.743 -0.741 . . . . 10.0 111.751 -179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 94.68 179.45 37.7 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.891 -0.671 . . . . 10.0 111.774 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 2.6 p -117.45 96.0 5.21 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.805 0.336 . . . . 10.0 110.976 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 18.0 p-90 -59.84 -25.81 65.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.795 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -66.72 -34.26 77.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.656 -0.702 . . . . 10.0 110.48 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.34 -31.15 38.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.262 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.14 -46.08 75.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.686 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.0 m -69.02 -27.2 34.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.846 0.355 . . . . 10.0 110.754 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -78.84 -9.11 59.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.982 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -93.56 -7.54 43.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.144 0.497 . . . . 10.0 110.483 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 60.3 mt -99.01 134.65 41.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.936 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -65.63 -49.7 67.74 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.191 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -126.63 88.55 54.14 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.703 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -83.29 112.99 2.01 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.972 2.448 . . . . 10.0 111.591 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 530' ' ' THR . . . . . 0.547 ' H ' ' NE2' ' A' ' 533' ' ' GLN . 16.7 p -87.82 176.52 7.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.581 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -58.96 -44.93 91.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.947 0.403 . . . . 10.0 111.054 -179.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.485 ' OE1' ' HB ' ' A' ' 530' ' ' THR . 1.2 mp0 -63.61 -36.23 83.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.651 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 533' ' ' GLN . . . . . 0.547 ' NE2' ' H ' ' A' ' 530' ' ' THR . 31.9 mt-30 -65.97 -49.87 66.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.953 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 74.2 mt -60.33 -45.32 96.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.605 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -64.54 -44.13 91.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.795 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -60.43 -50.02 75.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.691 -0.231 . . . . 10.0 110.811 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 85.0 mt -62.64 -45.07 99.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.607 -0.27 . . . . 10.0 110.67 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 5.5 ttmt -60.75 -45.16 95.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.887 0.375 . . . . 10.0 110.782 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.18 95.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.259 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 540' ' ' ASP . . . . . 0.59 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 0.1 OUTLIER -67.64 -40.43 84.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.389 -0.368 . . . . 10.0 110.057 179.617 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 44.3 t90 -59.8 -42.15 92.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.142 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -53.37 -44.0 68.23 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.79 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 59.6 t -65.47 -47.61 86.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.739 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 544' ' ' ARG . . . . . 0.59 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 13.4 mtm180 -63.72 -33.27 75.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.346 0.593 . . . . 10.0 110.272 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -65.52 -50.59 64.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.186 -0.915 . . . . 10.0 111.063 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.79 -26.81 64.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.298 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.2 -39.45 92.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.189 0.519 . . . . 10.0 109.88 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 86.2 t -65.85 -37.34 79.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.994 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 98.5 mt -66.09 -32.74 74.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.202 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -69.97 -38.98 76.22 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.275 179.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 551' ' ' ALA . . . . . 0.646 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -69.0 -44.24 73.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.125 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 145.26 18.56 0.17 Allowed Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.075 -1.06 . . . . 10.0 113.684 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 77.54 -169.75 54.85 Favored Glycine 0 C--N 1.328 0.13 0 C-N-CA 120.668 -0.777 . . . . 10.0 112.352 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 63.8 tp -72.2 125.53 27.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.0 0.428 . . . . 10.0 110.409 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -94.31 123.62 37.83 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.786 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 40.8 mm -105.43 128.19 59.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.343 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 557' ' ' ILE . . . . . 0.408 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.2 mt -120.77 123.2 69.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 120.989 0.423 . . . . 10.0 110.49 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.53 122.08 7.05 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 111.321 -0.712 . . . . 10.0 111.321 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 18.3 p -82.51 -56.27 3.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.143 0.497 . . . . 10.0 111.113 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 560' ' ' GLU . . . . . 0.444 ' HB2' HG12 ' A' ' 457' ' ' ILE . 14.4 mp0 -110.73 141.46 44.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.617 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 561' ' ' ARG . . . . . 0.484 ' HG2' HD21 ' A' ' 588' ' ' LEU . 15.1 mmt180 -87.13 123.49 32.24 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.149 -0.685 . . . . 10.0 109.149 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -67.19 143.72 56.4 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.704 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -57.15 -66.12 0.51 Allowed 'General case' 0 N--CA 1.462 0.154 0 O-C-N 123.431 0.457 . . . . 10.0 109.99 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.58 121.62 20.01 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 565' ' ' ARG . . . . . 0.442 ' HB2' ' HB3' ' A' ' 631' ' ' GLN . 16.9 tpt180 -60.5 -21.2 62.16 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 123.457 0.473 . . . . 10.0 111.659 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 566' ' ' ARG . . . . . 0.468 ' HA ' ' HB1' ' A' ' 394' ' ' ALA . 11.2 ttm180 -55.43 -61.4 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.962 0.41 . . . . 10.0 110.749 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 30.0 mt -71.31 -24.51 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.032 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 568' ' ' ASP . . . . . 0.426 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 4.8 t70 -63.08 -49.34 74.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.485 0.659 . . . . 10.0 109.523 178.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 569' ' ' ASN . . . . . 0.439 ' HB3' ' HA ' ' A' ' 394' ' ' ALA . 50.2 t30 -67.58 -38.55 84.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.954 -1.021 . . . . 10.0 110.676 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 570' ' ' GLN . . . . . 0.452 ' HG3' ' HB2' ' A' ' 394' ' ' ALA . 94.3 mt-30 -67.12 -30.95 71.1 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.799 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.532 HD12 HH21 ' A' ' 574' ' ' ARG . 44.4 tp -66.82 -32.78 74.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.988 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -85.64 -33.77 21.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.485 -0.78 . . . . 10.0 110.995 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.63 54.81 2.49 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 121.235 -0.507 . . . . 10.0 113.902 -179.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 574' ' ' ARG . . . . . 0.532 HH21 HD12 ' A' ' 571' ' ' LEU . 29.9 mmt180 -92.15 -51.46 5.17 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.46 -167.87 2.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.173 179.178 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 73.92 39.11 47.58 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.475 -0.869 . . . . 10.0 112.238 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 577' ' ' ARG . . . . . 0.549 ' H ' ' HB3' ' A' ' 580' ' ' ASP . 51.3 mtt180 -97.58 122.45 40.65 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 58.73 41.17 22.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.015 0.436 . . . . 10.0 111.793 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 579' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 416' ' ' ARG . . . 82.16 32.33 29.14 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 121.039 -0.601 . . . . 10.0 113.096 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 580' ' ' ASP . . . . . 0.549 ' HB3' ' H ' ' A' ' 577' ' ' ARG . 6.1 t70 -81.11 163.65 22.98 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -89.47 -139.49 0.13 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.905 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 120.65 167.41 13.36 Favored Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 120.666 -0.778 . . . . 10.0 112.326 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 583' ' ' SER . . . . . 0.543 ' HA ' ' O ' ' A' ' 421' ' ' LYS . 1.3 p -149.19 122.27 8.86 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.442 0.163 . . . . 10.0 110.619 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.49 125.81 39.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.721 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 585' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 4.3 tpm_? -132.99 124.83 28.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.539 -0.3 . . . . 10.0 110.192 179.201 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -116.43 140.01 49.82 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.9 0.381 . . . . 10.0 111.114 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -132.18 122.97 26.12 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.104 -0.702 . . . . 10.0 109.104 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 588' ' ' LEU . . . . . 0.484 HD21 ' HG2' ' A' ' 561' ' ' ARG . 5.3 mt -130.39 179.25 6.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.829 0.347 . . . . 10.0 111.286 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 38.8 p -142.55 178.6 7.5 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.803 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 74.7 mmm -85.31 -4.32 59.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.09 0.471 . . . . 10.0 110.271 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -105.33 0.58 27.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.507 -0.769 . . . . 10.0 109.9 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.57 154.86 41.08 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.76 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -69.59 -24.71 63.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.256 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.62 ' O ' HG12 ' A' ' 597' ' ' ILE . 10.1 tp -59.42 -34.23 72.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.295 -0.411 . . . . 10.0 111.342 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 14.8 mmt -64.38 -16.72 62.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.764 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -82.73 -10.66 58.79 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.62 HG12 ' O ' ' A' ' 594' ' ' LEU . 17.2 pt -82.15 -8.85 11.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.225 -0.59 . . . . 10.0 110.201 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -84.39 -13.9 50.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.26 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.85 -68.36 0.16 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.419 -0.81 . . . . 10.0 111.954 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 28.1 m -71.52 115.78 11.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.35 -0.386 . . . . 10.0 111.233 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -68.45 -19.71 64.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.138 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -38.4 79.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.188 179.227 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.7 t -63.08 -51.84 66.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.011 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 604' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 1.2 m -63.08 -34.5 77.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.446 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -63.21 -39.14 97.56 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.138 -0.553 . . . . 10.0 111.756 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 14.1 tpt -70.02 -29.04 66.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.134 0.492 . . . . 10.0 110.267 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 63.0 mtt -70.66 -21.47 62.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.784 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 608' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 604' ' ' SER . 48.9 mtt180 -73.1 -6.46 45.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.101 0.477 . . . . 10.0 110.409 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -79.97 -4.07 50.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.501 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 31.3 tp -65.75 -39.31 90.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.109 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 109.73 -40.77 2.43 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.916 -0.659 . . . . 10.0 111.458 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 612' ' ' MET . . . . . 0.463 ' CG ' ' HA ' ' A' ' 428' ' ' TYR . 1.7 mpt? 60.63 -106.47 0.26 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.028 0.531 . . . . 10.0 111.677 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.94 109.88 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.326 0 O-C-N 123.666 0.603 . . . . 10.0 111.283 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 614' ' ' PRO . . . . . 0.469 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 37.8 Cg_endo -66.3 85.5 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.61 2.207 . . . . 10.0 112.491 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 162.44 -44.2 0.36 Allowed Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.902 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.43 54.71 3.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.118 0.485 . . . . 10.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -81.47 84.89 6.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.578 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 14.9 tt -86.56 1.87 5.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.936 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 71.75 141.47 0.05 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.435 0.694 . . . . 10.0 111.462 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -147.36 92.89 4.76 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.122 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -61.49 -28.33 83.34 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 123.407 2.738 . . . . 10.0 114.115 -178.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 37.8 p-90 -61.0 -25.3 66.79 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 111.852 0.316 . . . . 10.0 111.852 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.94 -50.12 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.725 0.298 . . . . 10.0 110.232 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 68.0 m -59.6 -38.5 81.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.859 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -63.84 -39.54 94.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.862 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -69.57 -43.61 72.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.175 179.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.13 -44.02 99.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.585 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -61.28 -40.4 94.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.596 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -66.21 -45.04 82.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.199 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 630' ' ' ALA . . . . . 0.456 ' O ' HG23 ' A' ' 634' ' ' VAL . . . -61.67 -46.64 88.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.993 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 631' ' ' GLN . . . . . 0.442 ' HB3' ' HB2' ' A' ' 565' ' ' ARG . 56.5 mt-30 -58.83 -43.15 90.63 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.961 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 51.2 mtp85 -71.08 -33.85 70.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.279 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -63.29 -38.79 92.52 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.007 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 634' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 630' ' ' ALA . 69.6 t -58.63 -47.67 88.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.241 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -73.21 -23.5 60.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.704 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.0 m -67.66 -29.65 69.0 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -78.12 -32.63 50.56 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.846 -1.07 . . . . 10.0 108.526 177.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -60.3 -49.92 75.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.128 -0.942 . . . . 10.0 109.802 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 639' ' ' PHE . . . . . 0.445 ' CD1' ' HG2' ' A' ' 400' ' ' GLU . 32.2 t80 -56.62 -38.22 71.79 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.56 179.087 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 640' ' ' ASP . . . . . 0.472 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 32.4 t70 -59.34 -35.49 73.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.602 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 24.9 mt -82.75 -38.97 15.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.119 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 642' ' ' ARG . . . . . 0.501 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 5.5 mtm180 -61.03 -39.16 88.72 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.666 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 643' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 18.8 pttm -66.31 -25.32 66.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.016 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 644' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 15.8 mm100 -66.95 -39.65 87.33 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.621 -0.511 . . . . 10.0 109.621 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 33.1 mt -66.94 -39.69 87.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.629 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 646' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 46.9 mt -63.42 -35.55 80.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.733 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -63.62 -24.11 67.66 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.115 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 648' ' ' TYR . . . . . 0.423 ' CZ ' ' HG3' ' A' ' 800' ' ' LYS . 48.1 m-85 -97.28 -39.95 8.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.132 0.491 . . . . 10.0 110.979 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -75.21 -27.02 59.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.713 0.634 . . . . 10.0 112.713 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 650' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 5.4 t0 -68.16 -21.56 64.89 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.216 0.531 . . . . 10.0 110.368 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 17.8 t -68.23 -49.45 66.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -68.49 -25.51 65.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.054 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -61.5 -54.24 45.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 10.0 111.043 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -61.9 -42.98 99.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.912 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -64.89 -38.66 91.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.652 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 14.0 ttp-105 -65.25 -45.88 82.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.788 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -61.35 -40.28 93.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.487 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.4 -54.18 36.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.764 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.2 tp -67.09 -35.29 74.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 116.64 -0.255 . . . . 10.0 111.603 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -64.27 -41.71 96.78 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 110.356 -0.239 . . . . 10.0 110.356 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 15.0 t -61.9 -50.3 72.73 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -57.56 -45.95 84.53 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.779 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 19.3 ttt-85 -62.19 -36.98 83.56 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.931 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -74.36 -37.12 63.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.754 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.01 -41.44 96.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 10.0 110.65 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 77.2 mt -83.15 -5.03 58.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.393 0.616 . . . . 10.0 110.499 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 52.1 tp -91.26 -47.19 7.64 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.351 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -65.69 -41.26 92.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.502 -0.772 . . . . 10.0 112.046 -179.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 34.0 m -73.35 145.59 11.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.9 0.381 . . . . 10.0 111.302 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.66 -27.17 29.28 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.974 0.416 . . . . 10.0 110.055 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -81.48 -178.04 6.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.486 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 672' ' ' VAL . . . . . 0.465 ' O ' HG12 ' A' ' 676' ' ' ILE . 7.4 p -179.82 -24.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.392 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -37.29 63.59 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.412 -0.813 . . . . 10.0 111.329 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.96 -53.98 52.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.641 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 675' ' ' THR . . . . . 0.482 ' O ' HG12 ' A' ' 679' ' ' ILE . 0.2 OUTLIER -62.55 -41.92 99.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.837 -0.619 . . . . 10.0 110.564 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 676' ' ' ILE . . . . . 0.465 HG12 ' O ' ' A' ' 672' ' ' VAL . 29.5 mm -57.91 -51.44 70.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.663 -0.698 . . . . 10.0 111.56 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 -68.68 -32.2 71.85 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 49.8 m -65.8 -49.63 67.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.741 0.305 . . . . 10.0 110.548 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 679' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 675' ' ' THR . 42.8 pt -73.83 -21.49 18.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 120.826 -0.35 . . . . 10.0 111.084 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 49.2 ttm-85 -59.58 -38.67 81.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.795 0.331 . . . . 10.0 110.536 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.99 -34.85 79.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.82 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -80.39 -41.95 23.71 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.457 -178.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 64.7 t -59.63 -47.6 90.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-O 120.941 0.4 . . . . 10.0 110.76 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -64.71 -38.52 91.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.07 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.1 tttm -59.95 -51.48 69.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.504 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.85 -36.86 77.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.232 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 25.8 m -68.81 -43.73 75.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.702 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.4 mt -66.74 -47.24 83.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.412 . . . . 10.0 110.394 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -58.32 -24.46 59.72 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.915 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -74.06 -18.28 60.85 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 691' ' ' TYR . . . . . 0.434 ' OH ' ' HD3' ' A' ' 709' ' ' ARG . 97.5 m-85 -122.53 -25.82 4.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.937 0.399 . . . . 10.0 111.071 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 51.4 mt -126.06 102.46 27.74 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.866 -0.607 . . . . 10.0 109.701 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -60.99 132.49 42.3 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.499 2.132 . . . . 10.0 111.594 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -44.3 104.92 0.06 OUTLIER 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 123.654 2.903 . . . . 10.0 113.653 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 53.75 80.98 0.1 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.008 -0.996 . . . . 10.0 111.802 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 8.8 p -137.27 -163.1 1.37 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.98 -0.554 . . . . 10.0 110.604 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 5.1 mt -78.05 128.79 34.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.278 179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 698' ' ' GLU . . . . . 0.588 ' HA ' ' CD2' ' A' ' 701' ' ' TRP . 11.4 pm0 -55.57 -28.14 53.29 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.41 -22.52 61.85 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.074 0.464 . . . . 10.0 110.59 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 22.9 ttt -92.87 11.24 27.86 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.181 0.515 . . . . 10.0 110.797 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 701' ' ' TRP . . . . . 0.588 ' CD2' ' HA ' ' A' ' 698' ' ' GLU . 53.8 m0 -97.77 126.18 42.99 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.227 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -85.38 79.44 9.47 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 703' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.3 mm -62.16 -50.39 80.34 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.318 -0.855 . . . . 10.0 111.461 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 704' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 35.6 Cg_exo -58.24 -46.11 27.11 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.886 1.724 . . . . 10.0 112.189 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -61.03 -44.64 97.94 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.007 -0.616 . . . . 10.0 112.583 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 40.0 tp -66.73 -42.63 85.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.511 0.196 . . . . 10.0 111.053 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -60.6 -50.9 71.65 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.473 -0.33 . . . . 10.0 110.651 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -62.92 -37.22 86.14 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.573 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 709' ' ' ARG . . . . . 0.434 ' HD3' ' OH ' ' A' ' 691' ' ' TYR . 7.1 tpt180 -61.48 -48.64 80.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.502 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 89.4 mt -63.28 -35.59 80.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.292 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -70.49 -41.4 72.75 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.266 0.469 . . . . 10.0 112.266 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -85.31 -44.15 13.08 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 113.051 0.76 . . . . 10.0 113.051 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 713' ' ' ASP . . . . . 0.412 ' O ' ' HE3' ' A' ' 828' ' ' LYS . 1.2 m-20 -83.36 -34.59 25.58 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.444 0.905 . . . . 10.0 113.444 -176.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -115.97 -1.26 12.56 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.735 1.013 . . . . 10.0 113.735 -177.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 33.0 t70 60.72 35.0 19.8 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.672 0.749 . . . . 10.0 109.952 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 13.8 tp -123.2 108.1 12.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.136 -179.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -90.92 103.69 16.37 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.109 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 80.6 mt -122.16 123.84 27.1 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.897 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 719' ' ' PRO . . . . . 0.454 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 87.8 Cg_endo -82.08 70.5 7.08 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.762 2.308 . . . . 10.0 111.233 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 91.7 mt -56.42 -39.6 62.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.295 -0.866 . . . . 10.0 111.649 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -58.49 -47.95 82.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.606 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 722' ' ' GLU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 719' ' ' PRO . 27.0 mm-40 -64.92 -34.59 78.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.428 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -63.19 -49.95 72.22 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.972 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 35.6 tp -75.74 -24.79 56.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.063 0.459 . . . . 10.0 110.736 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -69.17 -50.92 43.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.846 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -81.25 -34.54 32.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.13 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -119.44 90.29 42.21 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.617 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -70.39 -15.68 34.77 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.116 1.877 . . . . 10.0 111.63 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -72.49 -7.88 52.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.303 -0.862 . . . . 10.0 110.918 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 730' ' ' LEU . . . . . 0.45 HD22 ' HA ' ' A' ' 730' ' ' LEU . 0.3 OUTLIER -65.92 -35.56 80.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.301 179.587 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 51.92 -102.18 0.12 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.426 -0.807 . . . . 10.0 111.066 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -141.64 -53.07 0.44 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.017 0.437 . . . . 10.0 110.465 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -56.26 -48.7 76.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.637 -0.71 . . . . 10.0 111.385 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 2.4 m -66.25 -28.4 68.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.239 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 48.1 tp -66.46 -41.95 88.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.462 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 736' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 736' ' ' ARG . 55.9 mtt-85 -60.82 -39.65 89.78 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.815 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -60.75 -42.79 98.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.604 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 738' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 738' ' ' ARG . 7.6 mmm-85 -64.45 -43.41 94.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.561 -0.745 . . . . 10.0 111.388 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 94.1 mt -62.7 -48.71 86.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.976 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 34.3 tp -64.42 -46.23 84.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.054 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.71 88.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 10.0 111.433 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -66.06 -36.06 82.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.554 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 54.1 p -63.79 -37.72 88.41 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.814 0.34 . . . . 10.0 110.2 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 744' ' ' ILE . . . . . 0.409 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 30.6 mt -72.58 -38.21 58.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.079 -0.51 . . . . 10.0 109.882 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -58.97 -49.66 77.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.131 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 60.3 t -66.57 -36.07 76.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.102 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -60.08 -48.2 82.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.414 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 748' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 27.2 mt-30 -60.61 -40.82 93.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.806 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 749' ' ' ARG . . . . . 0.462 ' HD3' ' OE2' ' A' ' 836' ' ' GLU . 19.8 ttp-105 -63.05 -43.39 98.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.349 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -70.09 -37.33 75.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.134 0.492 . . . . 10.0 109.988 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.9 -42.08 98.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.64 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -62.33 -19.95 63.85 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.235 0.458 . . . . 10.0 112.235 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.6 t -82.99 -43.58 18.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.131 0.491 . . . . 10.0 110.68 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 17.4 t -81.84 -37.49 15.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.244 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 119.81 134.25 4.75 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 110.706 -0.957 . . . . 10.0 110.706 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 756' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -54.03 -59.58 4.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.727 0.299 . . . . 10.0 111.789 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 26.3 mp0 -63.51 -36.13 82.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.085 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 16.1 tpt -65.15 -41.46 94.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.688 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 47.3 mmm -62.18 -40.22 95.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.727 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.499 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -59.58 -39.62 84.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.367 0.604 . . . . 10.0 110.027 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -70.59 -36.93 73.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.677 -0.692 . . . . 10.0 109.735 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -66.5 -47.56 72.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.294 -0.866 . . . . 10.0 110.245 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -58.15 -45.33 87.61 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.39 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -60.9 -45.54 94.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.385 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.34 -47.25 90.92 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 121.086 -0.578 . . . . 10.0 112.454 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.28 -44.41 95.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.703 0.287 . . . . 10.0 110.556 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -56.83 -50.4 72.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.119 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.28 -45.94 91.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.579 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.98 -44.25 96.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.591 -0.277 . . . . 10.0 110.979 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 11.1 m -62.64 -38.91 92.1 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.478 -0.328 . . . . 10.0 110.557 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 17.8 mt -59.87 -52.1 66.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.519 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -61.86 -42.02 98.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.718 -0.674 . . . . 10.0 111.303 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 773' ' ' SER . . . . . 0.502 ' HB3' ' HB1' ' B' ' 19' ' ' ALA . 44.1 m -58.95 -54.21 49.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.561 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 6.1 mp -67.7 -27.66 67.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.669 -0.242 . . . . 10.0 111.366 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 15.5 t-105 -62.53 -41.75 99.07 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.47 ' C ' ' HD2' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -61.12 -47.31 86.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.685 -0.688 . . . . 10.0 109.628 178.967 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 777' ' ' GLU . . . . . 0.408 ' CD ' ' HZ3' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -55.93 -42.62 76.4 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.205 179.537 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 778' ' ' HIS . . . . . 0.658 ' O ' ' HG2' ' A' ' 782' ' ' MET . 59.2 t60 -65.01 -46.46 81.27 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.445 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 779' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 779' ' ' LEU . 25.6 mt -59.57 -46.42 88.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.873 0.368 . . . . 10.0 111.01 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.54 90.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.766 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.99 -34.38 76.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.623 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 782' ' ' MET . . . . . 0.658 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 97.3 mmm -58.0 -50.95 71.63 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.176 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 783' ' ' ASP . . . . . 0.539 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 8.1 t70 -73.24 -36.3 66.39 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-O 120.651 0.262 . . . . 10.0 110.417 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -56.98 -36.87 70.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.605 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 57.3 tp -88.62 -30.93 18.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.499 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -56.76 -45.96 81.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.683 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 787' ' ' GLN . . . . . 0.539 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 10.0 pt20 -75.31 -3.18 31.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.158 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -98.02 -11.29 49.99 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.717 -0.553 . . . . 10.0 111.717 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 50.5 mm -73.64 86.14 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.818 0.818 . . . . 10.0 109.717 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -172.63 -30.88 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.662 -1.154 . . . . 10.0 108.666 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 32.5 mt -108.21 -41.58 4.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.056 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 22.1 ttm180 -73.77 128.01 34.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.345 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . 131.49 -175.59 19.55 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.965 -0.635 . . . . 10.0 112.022 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -152.18 -177.19 6.02 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.409 -0.219 . . . . 10.0 110.409 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -74.44 157.15 36.11 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.875 0.369 . . . . 10.0 111.749 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 65.3 35.26 7.72 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.535 -0.757 . . . . 10.0 111.121 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 797' ' ' LYS . . . . . 0.406 ' HG2' ' OE2' ' A' ' 802' ' ' GLU . 4.8 tppp? -148.94 131.47 15.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.328 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -77.65 128.46 79.6 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.192 -0.458 . . . . 10.0 109.877 179.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.91 -38.69 86.9 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.892 2.395 . . . . 10.0 113.321 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 800' ' ' LYS . . . . . 0.475 ' HB2' ' NZ ' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -67.97 -43.5 78.83 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 -179.755 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -64.21 -39.36 93.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.526 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 802' ' ' GLU . . . . . 0.406 ' OE2' ' HG2' ' A' ' 797' ' ' LYS . 2.9 tp10 -65.36 -46.53 79.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.929 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 803' ' ' TYR . . . . . 0.408 ' CD2' ' HD1' ' A' ' 648' ' ' TYR . 72.6 t80 -59.29 -38.92 81.42 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.125 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -59.24 -46.12 89.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.931 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 34.8 mtm105 -58.9 -46.93 86.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.236 0.541 . . . . 10.0 110.077 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 806' ' ' GLU . . . . . 0.403 ' HB3' ' HB3' ' A' ' 301' ' ' PRO . 6.8 mm-40 -59.42 -43.86 92.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.563 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 14.3 m -67.36 -38.78 85.34 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.446 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -67.21 -41.04 86.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.732 0.301 . . . . 10.0 110.4 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 10.9 m -65.77 -39.35 90.92 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 22.9 ttm -63.73 -34.9 78.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.278 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -69.54 -45.72 68.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.543 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.8 -50.55 71.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.972 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -60.1 -32.38 70.93 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.074 0.464 . . . . 10.0 110.861 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 40.8 ttp -65.64 -49.22 69.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.029 179.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.26 -40.57 94.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 816' ' ' GLU . . . . . 0.435 ' HA ' ' HE2' ' A' ' 819' ' ' LYS . 34.6 mm-40 -61.11 -41.88 97.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.083 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 4.8 m -75.78 -28.34 58.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.569 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 31.0 tp -61.08 -60.38 3.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.857 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 819' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 816' ' ' GLU . 44.7 pttt -59.16 -32.97 70.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.692 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -62.82 -57.41 10.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.679 -0.692 . . . . 10.0 111.31 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -65.39 -34.11 77.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.911 -178.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 822' ' ' VAL . . . . . 0.417 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 39.6 t -58.62 -53.27 49.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.712 0.291 . . . . 10.0 110.511 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 33.9 mm -64.66 -39.76 86.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.535 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 36.2 m -62.37 -50.64 70.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.05 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 29.0 m -58.26 -41.77 85.0 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 111.961 0.356 . . . . 10.0 111.961 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 826' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 98.9 mt -65.55 -23.98 67.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.936 0.398 . . . . 10.0 111.343 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 4.5 m -95.34 -21.19 18.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.365 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 828' ' ' LYS . . . . . 0.412 ' HE3' ' O ' ' A' ' 713' ' ' ASP . 88.0 mttt -74.49 -9.92 59.05 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.565 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.4 p -56.97 125.79 13.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 121.198 0.523 . . . . 10.0 110.439 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -104.7 115.71 30.79 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.193 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 3.4 m -138.33 156.21 29.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.322 -0.854 . . . . 10.0 109.089 179.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 8.9 ptt180 -62.78 140.08 58.73 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 123.224 0.327 . . . . 10.0 110.208 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 34.9 mmt -88.68 120.08 70.13 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.729 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.69 159.33 38.96 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.519 2.146 . . . . 10.0 111.858 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -82.9 113.69 20.68 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.179 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 836' ' ' GLU . . . . . 0.462 ' OE2' ' HD3' ' A' ' 749' ' ' ARG . 16.7 mt-10 . . . . . 0 C--O 1.247 0.933 0 CA-C-O 118.531 -0.747 . . . . 10.0 109.825 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 48.2 tpp -83.78 104.92 14.27 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.953 0.406 . . . . 10.0 109.983 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 mt -118.91 86.23 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.069 0.462 . . . . 10.0 110.172 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.86 93.71 4.69 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.59 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 70.0 mt -79.58 86.77 5.19 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.714 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -93.64 132.64 37.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.574 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 24.0 mtmt -124.48 151.37 44.68 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.907 -0.405 . . . . 10.0 109.907 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.493 ' HA ' ' HE ' ' B' ' 8' ' ' ARG . 4.3 mmp_? -133.09 -44.43 0.86 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.957 0.408 . . . . 10.0 110.262 179.395 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.32 104.25 12.49 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 178.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 17.7 pttm -103.15 160.22 14.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.126 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 80.8 mt -107.54 104.0 51.1 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.901 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.98 3.94 5.67 Favored 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.603 2.202 . . . . 10.0 112.219 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 57.2 mt -62.66 -29.5 70.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.307 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.67 -46.18 86.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.193 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 m -84.65 -18.12 9.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.92 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.77 -34.76 78.62 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.37 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.516 HG13 ' HB2' ' A' ' 232' ' ' SER . 42.2 t -65.8 -45.63 91.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.012 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.19 -48.09 83.16 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.421 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.502 ' HB1' ' HB3' ' A' ' 773' ' ' SER . . . -65.75 -32.33 73.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.713 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -65.62 -22.58 69.93 Favored Glycine 0 N--CA 1.452 -0.286 0 CA-C-N 115.676 -0.693 . . . . 10.0 112.549 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.4 ' CG1' ' HE3' ' A' ' 776' ' ' LYS . 99.1 t -57.07 -38.04 58.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.106 0.479 . . . . 10.0 110.962 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 9.6 tpt -86.69 -16.82 35.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.303 0.573 . . . . 10.0 110.728 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 71.1 m -87.5 77.89 8.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.676 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -76.68 68.56 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.075 -0.511 . . . . 10.0 111.054 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -83.83 72.15 10.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.459 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -95.77 -10.68 28.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.18 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -107.78 84.33 1.94 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.307 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.639 -0.696 . . . . 10.0 110.367 -179.869 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.5 t80 . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.848 0.356 . . . . 10.0 110.191 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 114.52 137.27 6.42 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 121.102 -0.57 . . . . 10.0 111.853 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.88 128.2 20.51 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.028 0.442 . . . . 10.0 111.223 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.494 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 1.2 mmp_? -63.19 142.76 58.26 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.668 -0.696 . . . . 10.0 111.492 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.438 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 0.9 OUTLIER 71.89 -81.99 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.302 -0.863 . . . . 10.0 112.232 179.129 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -49.65 -66.16 0.44 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.92 0.711 . . . . 10.0 112.92 -178.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 19' ' ' ARG . 7.8 ttm105 -71.02 -27.63 63.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.679 0.276 . . . . 10.0 111.454 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.9 m -61.88 -38.08 86.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.371 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 14' ' ' ASN . 90.1 mt -59.55 -49.83 76.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.678 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 16' ' ' ARG . 26.8 ptt-85 -75.62 -29.34 59.17 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.813 -0.355 . . . . 10.0 111.383 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -63.93 -40.68 97.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.094 0.473 . . . . 10.0 109.736 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.444 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -68.49 -35.46 77.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.124 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.7 tpp180 -61.26 -35.62 77.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.617 -0.72 . . . . 10.0 110.783 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.89 -40.82 85.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.654 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.0 t -74.78 -39.81 46.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.448 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.8 t -57.57 -37.92 61.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.658 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -62.64 -44.73 95.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.498 . . . . 10.0 110.206 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.1 mt -60.77 -45.11 98.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.345 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 61.9 mt -59.56 -43.16 90.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.513 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -66.68 -33.18 75.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.488 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.496 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -76.81 -34.11 57.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.155 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 16.4 ttt -83.18 -9.66 59.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.361 -0.382 . . . . 10.0 111.295 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.435 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 19.3 tt0 -58.72 -51.74 79.67 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-O 119.39 -0.338 . . . . 10.0 111.885 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.496 ' HD2' ' O ' ' A' ' 30' ' ' ALA . 60.3 Cg_exo -53.87 -33.37 71.3 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.082 1.854 . . . . 10.0 111.772 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -71.37 -39.54 71.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.275 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 20.0 mmt -65.73 -33.59 76.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.621 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -66.5 -14.02 61.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.057 0.456 . . . . 10.0 110.813 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -94.81 -8.09 38.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.362 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.9 mp -88.45 142.0 28.07 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.675 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 p -75.15 167.07 22.62 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.725 0.297 . . . . 10.0 110.529 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.83 -42.98 90.52 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.384 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -69.8 -19.7 63.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.507 -0.315 . . . . 10.0 111.423 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -75.43 -36.76 60.72 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 110.293 -0.262 . . . . 10.0 110.293 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.7 mt -61.79 -41.41 97.7 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -64.74 -35.11 80.01 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.58 -1.191 . . . . 10.0 109.416 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.63 -28.83 70.36 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.341 -0.845 . . . . 10.0 112.295 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -71.83 -37.19 70.36 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 33.1 m -60.87 -45.25 95.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 10.0 109.959 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.62 -33.09 73.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.011 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -63.34 -43.62 97.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.573 -0.74 . . . . 10.0 110.304 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.7 m-30 -61.38 -37.26 82.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.284 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 9.4 tpp180 -60.54 -45.4 93.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.729 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.57 -44.3 74.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.896 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 -61.09 -37.11 81.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.279 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.0 mt -59.93 -38.04 81.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.389 -0.368 . . . . 10.0 111.077 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -86.56 -14.34 43.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.066 0.46 . . . . 10.0 110.706 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -77.69 -52.57 8.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.71 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 157.45 45.93 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.398 -0.819 . . . . 10.0 111.594 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -117.63 139.01 51.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.706 0.289 . . . . 10.0 110.338 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 42.6 t -85.51 138.66 18.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.813 -0.439 . . . . 10.0 109.813 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.46 HD11 ' O ' ' A' ' 118' ' ' LEU . 22.6 tp -57.74 -45.0 86.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.985 0.421 . . . . 10.0 110.836 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 25.7 mp0 -64.7 -16.97 63.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.835 -0.62 . . . . 10.0 111.433 179.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -91.95 -14.7 29.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.07 0.462 . . . . 10.0 110.298 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.2 mt -87.61 -8.91 55.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.144 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.481 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 69.8 mt -50.16 -50.92 66.97 Favored Pre-proline 0 CA--C 1.543 0.699 0 N-CA-C 113.387 0.884 . . . . 10.0 113.387 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.481 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.7 Cg_exo -52.05 -48.39 21.85 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 122.251 1.967 . . . . 10.0 113.199 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.5 ' O ' HG23 ' A' ' 70' ' ' VAL . 48.1 mt-10 -77.04 -43.99 32.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.621 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.502 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -59.15 -51.6 69.31 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.184 0.438 . . . . 10.0 112.184 -178.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -63.74 -32.38 73.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.661 0.267 . . . . 10.0 111.178 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.23 -43.37 91.64 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.855 -0.424 . . . . 10.0 109.855 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 66' ' ' GLU . 96.9 t -62.36 -43.05 97.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.127 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 67' ' ' ALA . 46.2 t -62.01 -44.32 98.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.565 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.427 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 9.8 ttm180 -62.02 -40.87 97.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.393 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -67.57 -52.9 33.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.267 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.72 -41.72 77.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.712 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.1 m -62.59 -31.38 72.19 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -179.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -72.46 -20.43 61.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.662 0.268 . . . . 10.0 111.195 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -100.55 -27.53 13.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.826 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 90.1 t -89.82 -51.45 12.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.688 0.28 . . . . 10.0 111.725 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -104.84 -26.88 12.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.041 0.448 . . . . 10.0 111.124 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 85.66 11.67 73.82 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.862 -0.685 . . . . 10.0 111.499 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 68.3 mtt -112.2 122.02 46.57 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.803 0.335 . . . . 10.0 110.603 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.411 ' HD2' ' OE2' ' A' ' 32' ' ' GLU . 12.7 ttp180 -84.03 134.32 34.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.111 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -70.38 115.66 9.82 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -60.97 156.21 18.19 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.369 0.418 . . . . 10.0 111.254 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -60.12 -37.14 79.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.144 -179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.3 m -65.13 -32.28 57.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.902 0.382 . . . . 10.0 110.57 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -73.77 -33.54 64.3 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.079 -0.509 . . . . 10.0 109.74 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.56 -39.03 92.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.57 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.447 ' O ' HG23 ' A' ' 93' ' ' VAL . 67.8 mt -62.2 -53.05 60.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.198 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.76 -45.95 95.18 Favored Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 115.745 -0.661 . . . . 10.0 112.444 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.22 -32.49 82.78 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.284 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.444 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 25.9 ttm -71.88 -38.95 69.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.826 0.346 . . . . 10.0 110.343 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 89' ' ' LEU . 90.7 t -67.6 -30.96 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.398 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.0 mt -69.2 -3.67 14.57 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.675 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -83.26 -20.85 33.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.527 0.68 . . . . 10.0 109.369 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -93.39 -162.92 0.98 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.538 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.7 ttt180 -107.38 58.64 0.62 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.56 -0.904 . . . . 10.0 108.56 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 3.1 m -130.58 164.52 24.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.295 -0.866 . . . . 10.0 111.224 -178.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.513 HD12 HG11 ' A' ' 211' ' ' VAL . 44.4 mm -109.88 127.36 66.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.692 -0.685 . . . . 10.0 109.24 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.83 127.94 53.84 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.995 0.369 . . . . 10.0 111.995 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -82.07 124.49 29.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.64 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 19.0 ttm -120.03 124.32 45.59 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.76 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.589 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 8.8 mmm180 -70.24 152.33 44.34 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.675 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.05 106.12 1.53 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.788 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 124.74 -18.96 7.08 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.618 -0.801 . . . . 10.0 113.884 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.649 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 10.2 mm-40 -58.82 -41.47 86.92 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 117.112 0.456 . . . . 10.0 112.095 -178.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.48 85.87 1.28 Allowed Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.523 -0.846 . . . . 10.0 112.324 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -65.43 -47.76 75.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.7 0.286 . . . . 10.0 111.551 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 55.7 m -63.55 -29.27 70.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.914 0.387 . . . . 10.0 111.559 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.2 tp -87.4 6.92 31.39 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.956 0.408 . . . . 10.0 111.154 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 40.8 m -120.83 -43.09 2.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.877 0.37 . . . . 10.0 110.597 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.67 -15.63 63.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.405 0.521 . . . . 10.0 112.405 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.6 -21.83 61.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.821 0.343 . . . . 10.0 111.921 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 11.6 mt -74.43 -57.57 2.09 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.58 -28.22 69.82 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 122.005 1.803 . . . . 10.0 112.156 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -64.96 -50.28 67.02 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.505 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.403 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 58.6 t80 -61.87 -44.37 96.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.952 0.405 . . . . 10.0 110.797 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.46 ' O ' HD11 ' A' ' 60' ' ' LEU . 49.6 tp -59.47 -54.31 48.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.83 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -71.0 -22.8 62.12 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.024 -0.27 . . . . 10.0 111.629 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.485 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -67.43 -27.71 67.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.817 0.342 . . . . 10.0 111.121 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 73.7 mt -60.17 -25.16 65.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.605 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.3 p -71.66 -20.46 61.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.018 0.437 . . . . 10.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.47 6.39 76.0 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.161 -0.542 . . . . 10.0 112.986 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 46.2 mmtt -79.2 -24.22 43.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.921 0.36 . . . . 10.0 110.778 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 106.05 117.01 4.24 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.629 -0.796 . . . . 10.0 113.559 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 74.1 t -87.82 115.05 27.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.1 m170 -94.03 101.39 13.43 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.084 0.468 . . . . 10.0 111.17 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 40.7 t -89.94 122.75 41.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.924 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.2 t -101.84 119.98 50.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.669 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.05 158.0 18.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.674 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.4 m -72.3 -31.12 37.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.977 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -145.79 172.04 13.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.584 0.231 . . . . 10.0 110.922 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -73.96 -26.81 60.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.198 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -58.67 -58.68 7.52 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.665 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.28 -35.6 80.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.912 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.58 -50.07 74.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.107 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.64 -25.3 49.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.879 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -66.22 -60.29 2.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.754 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.58 -29.63 69.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.057 -0.519 . . . . 10.0 111.475 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.52 -49.77 76.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.82 0.343 . . . . 10.0 111.237 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -79.36 -27.86 41.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.151 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . 0.432 ' O ' ' HD2' ' A' ' 145' ' ' PRO . 8.2 t30 -71.55 -45.42 62.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.298 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -86.68 -3.26 59.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.209 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.515 ' HA ' HG21 ' A' ' 154' ' ' VAL . 59.6 ttm-85 -59.81 -50.08 88.42 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' PRO . . . . . 0.496 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 24.5 Cg_exo -64.56 -5.22 9.7 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 122.201 1.934 . . . . 10.0 112.701 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 23.9 tp -96.7 -54.65 3.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.955 0.407 . . . . 10.0 110.224 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -67.81 -44.34 77.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.265 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.462 ' HA ' ' O ' ' A' ' 152' ' ' LEU . 3.7 mt-10 -70.69 -16.7 62.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.918 0.389 . . . . 10.0 111.135 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.468 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 73.3 t80 -73.03 -27.43 61.76 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.422 0.629 . . . . 10.0 109.588 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 30.5 mt -95.55 -8.03 36.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.206 -0.907 . . . . 10.0 110.94 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 112.96 -14.85 23.8 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.559 -0.829 . . . . 10.0 113.454 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 148' ' ' GLU . 85.3 mt -71.41 156.27 39.67 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.951 0.405 . . . . 10.0 111.021 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 16.2 p -107.51 136.41 47.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.336 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.515 HG21 ' HA ' ' A' ' 144' ' ' ARG . 45.1 t -110.27 122.4 64.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.135 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -117.31 139.34 14.91 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 121.119 -0.562 . . . . 10.0 112.002 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 5.5 tp -112.89 130.45 66.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.05 0.452 . . . . 10.0 110.688 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -115.57 107.35 15.03 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.003 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 94.0 mt -102.36 145.44 30.52 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.495 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' PRO . . . . . 0.428 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 19.7 Cg_endo -59.02 113.94 1.79 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.612 2.208 . . . . 10.0 112.049 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 105.81 0.45 39.35 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.801 -0.714 . . . . 10.0 112.433 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . 0.599 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 39.4 ttm -66.22 137.87 95.79 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 110.396 -0.224 . . . . 10.0 110.396 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.97 152.38 71.43 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.491 2.128 . . . . 10.0 112.371 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . 0.415 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.45 -47.39 96.45 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.862 0.69 . . . . 10.0 112.862 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.415 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 77.6 Cg_exo -52.26 -49.42 17.46 Favored 'Trans proline' 0 C--N 1.361 1.218 0 C-N-CA 121.831 1.687 . . . . 10.0 112.645 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.59 -38.06 86.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.088 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 161' ' ' MET . 59.1 mttm -59.92 -45.09 93.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.48 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -59.62 -35.32 74.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.845 -0.616 . . . . 10.0 111.124 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -70.15 -39.0 75.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.052 0.453 . . . . 10.0 110.422 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -73.6 -38.43 65.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.74 -0.663 . . . . 10.0 111.551 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -74.9 -25.2 58.76 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.524 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -84.34 -1.84 56.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.114 0.483 . . . . 10.0 110.712 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -79.9 168.35 19.35 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.45 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . 0.485 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 18.3 m-20 -71.04 -40.59 71.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.16 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.2 mp -127.01 127.23 69.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.168 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 5.2 m -117.33 125.37 50.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.884 0.373 . . . . 10.0 111.244 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -103.28 129.57 50.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -165.95 172.15 41.27 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.103 -1.046 . . . . 10.0 113.171 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.95 151.84 19.69 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.466 -0.198 . . . . 10.0 110.466 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -61.57 -36.42 80.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.755 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -58.26 -54.91 41.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.255 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.428 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 3.7 tp10 -67.72 -35.71 79.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.959 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -55.03 -40.99 70.8 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.385 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -74.68 -40.97 36.32 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.008 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -63.92 -39.28 93.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.75 0.31 . . . . 10.0 110.573 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 185' ' ' ASP . . . . . 0.411 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 19.6 m-20 -60.86 -41.98 96.97 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.98 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -62.73 -39.62 94.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.197 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 75.3 mt -66.86 -45.95 76.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.883 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 68.5 mtm-85 -63.82 -38.54 91.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.888 0.375 . . . . 10.0 110.969 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -64.45 -46.39 83.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.616 -0.72 . . . . 10.0 111.087 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -73.24 -20.98 60.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.622 -0.717 . . . . 10.0 112.064 -178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 22.9 ttp -99.87 26.57 6.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.112 0.482 . . . . 10.0 110.9 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -87.89 161.53 17.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.537 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -102.56 -29.06 11.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.083 0.468 . . . . 10.0 110.484 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.09 140.56 31.24 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.02 -26.28 81.98 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.693 2.262 . . . . 10.0 112.638 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -75.62 -11.09 59.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.542 -0.299 . . . . 10.0 111.305 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.78 -13.81 58.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.629 -0.26 . . . . 10.0 110.672 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -53.45 155.23 3.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.951 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 14.7 m -130.93 -20.81 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.374 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -89.31 -179.09 5.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.753 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -133.44 -79.87 0.48 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.534 -0.303 . . . . 10.0 110.974 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 19.5 ttmm -151.93 142.27 22.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.8 0.334 . . . . 10.0 110.562 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 9.9 mt -93.04 60.41 3.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.343 0.592 . . . . 10.0 109.752 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -81.01 -56.71 3.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.623 -0.717 . . . . 10.0 112.285 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -132.69 137.36 46.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.033 0.445 . . . . 10.0 111.623 -178.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.497 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -134.01 129.43 36.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.427 -0.806 . . . . 10.0 109.741 178.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 55.0 tp -124.07 108.49 12.4 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.176 -0.465 . . . . 10.0 109.808 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -96.82 132.1 42.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.184 0.516 . . . . 10.0 111.254 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -60.98 -53.84 52.29 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.368 -0.833 . . . . 10.0 112.352 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 210' ' ' GLU . . . . . 0.55 ' HB2' HH21 ' A' ' 509' ' ' ARG . 34.4 tt0 -123.97 108.3 12.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.005 0.431 . . . . 10.0 111.027 -179.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.513 HG11 HD12 ' A' ' 99' ' ' ILE . 32.9 m -84.47 -21.11 8.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.6 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 212' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.0 OUTLIER -53.77 -34.56 59.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.703 -0.68 . . . . 10.0 111.379 -179.703 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 8.9 p -107.2 -57.16 2.11 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.923 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.66 -37.91 68.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 113.485 0.92 . . . . 10.0 113.485 -177.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 215' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 219' ' ' ALA . 10.9 mt -94.19 -28.79 15.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.773 0.657 . . . . 10.0 112.773 -178.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 216' ' ' ILE . . . . . 0.404 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 40.3 mm -92.1 -63.05 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 112.406 0.521 . . . . 10.0 112.406 -178.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -69.65 -47.47 63.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.857 0.317 . . . . 10.0 111.857 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 218' ' ' GLU . . . . . 0.439 ' HA ' ' OG1' ' A' ' 221' ' ' THR . 6.1 mm-40 -80.3 12.31 3.02 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.682 0.623 . . . . 10.0 112.682 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 215' ' ' LEU . . . -63.92 -42.83 97.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.773 0.32 . . . . 10.0 111.515 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 7.1 mtp-105 -102.39 28.24 6.11 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 221' ' ' THR . . . . . 0.439 ' OG1' ' HA ' ' A' ' 218' ' ' GLU . 4.5 m -96.44 110.29 52.0 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 120.712 0.291 . . . . 10.0 110.232 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -90.54 125.53 1.15 Allowed 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.901 2.401 . . . . 10.0 112.795 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 223' ' ' LEU . . . . . 0.603 ' O ' ' HA ' ' A' ' 374' ' ' SER . 80.8 mt -78.79 90.65 4.67 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.343 -0.614 . . . . 10.0 109.343 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 90.1 mt -88.95 117.49 32.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.801 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 58.7 mt . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 177.9 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.342 0 N-CA-C 108.136 -1.061 . . . . 10.0 108.136 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 374' ' ' SER . . . . . 0.603 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 24.3 m -152.4 148.16 27.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.051 0.453 . . . . 10.0 111.769 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 16.7 tt -155.41 139.53 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.504 -0.771 . . . . 10.0 109.977 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.1 143.98 26.76 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -57.21 -41.37 79.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.672 0.272 . . . . 10.0 110.983 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 378' ' ' GLN . . . . . 0.429 ' HA ' ' CE1' ' A' ' 405' ' ' TYR . 1.5 tm0? -59.89 -39.92 86.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.174 0.511 . . . . 10.0 110.359 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -81.71 -0.85 44.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.311 -179.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -102.59 -48.04 4.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.173 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -71.04 -21.58 62.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.123 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -72.43 -12.17 60.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.882 0.372 . . . . 10.0 110.999 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 42.7 mt -84.91 -18.38 34.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.798 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . 0.497 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 39.0 m-85 -77.03 142.41 39.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.169 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -73.96 -64.31 1.04 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.95 0.405 . . . . 10.0 110.347 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -95.5 98.24 10.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.669 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 52.0 tp -107.41 110.03 21.9 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.072 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -130.21 163.99 25.49 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.206 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.35 168.89 41.97 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.422 -0.894 . . . . 10.0 112.398 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 35.9 mtm -105.75 140.01 39.44 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.211 -0.292 . . . . 10.0 110.211 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 3.4 t -124.27 156.5 36.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -91.22 174.76 38.93 Favored Glycine 0 N--CA 1.441 -0.988 0 C-N-CA 120.622 -0.799 . . . . 10.0 111.599 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 393' ' ' THR . . . . . 0.589 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 1.3 m -74.49 62.95 1.04 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.289 0.566 . . . . 10.0 110.499 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . 0.535 ' HB1' ' HG2' ' A' ' 566' ' ' ARG . . . -113.81 -43.18 3.31 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.474 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 395' ' ' ASP . . . . . 0.427 ' CG ' ' H ' ' A' ' 396' ' ' THR . 35.9 t70 59.66 -126.76 1.19 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 396' ' ' THR . . . . . 0.594 ' HB ' ' OE1' ' A' ' 397' ' ' GLU . 1.8 m 59.07 -93.78 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.77 0.428 . . . . 10.0 112.069 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 397' ' ' GLU . . . . . 0.594 ' OE1' ' HB ' ' A' ' 396' ' ' THR . 3.5 mp0 -75.77 2.28 12.59 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.943 0.401 . . . . 10.0 111.206 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -59.17 -26.09 64.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.65 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 399' ' ' PHE . . . . . 0.418 ' HD1' ' O ' ' A' ' 396' ' ' THR . 16.7 p90 -69.16 -23.06 63.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.969 0.414 . . . . 10.0 110.76 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.44 -13.38 60.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.5 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -59.37 -35.99 74.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.846 0.355 . . . . 10.0 110.558 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 402' ' ' SER . . . . . 0.481 ' O ' ' HA ' ' A' ' 406' ' ' LYS . 2.3 m -78.28 -18.23 55.58 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.656 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.2 m -100.36 -32.2 10.96 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.39 0.515 . . . . 10.0 112.39 -178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 55.4 mt -87.82 -49.58 14.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 111.736 0.273 . . . . 10.0 111.736 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 405' ' ' TYR . . . . . 0.429 ' CE1' ' HA ' ' A' ' 378' ' ' GLN . 96.6 m-85 -112.14 -5.73 14.21 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.994 -0.282 . . . . 10.0 111.654 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 406' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 402' ' ' SER . 3.9 mtpp 62.71 48.64 4.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.825 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 407' ' ' LEU . . . . . 0.418 HD13 HD11 ' A' ' 99' ' ' ILE . 16.6 mt -109.76 152.21 25.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.071 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 408' ' ' ASP . . . . . 0.494 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 22.3 t0 -93.52 135.22 34.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.506 -0.315 . . . . 10.0 110.318 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.83 118.65 27.5 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.31 -0.405 . . . . 10.0 111.373 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.26 137.43 57.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.294 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 5.1 m -102.32 140.18 21.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.592 0.235 . . . . 10.0 110.619 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 91.2 t -108.44 131.77 21.55 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.63 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.5 152.56 80.57 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.63 2.22 . . . . 10.0 112.278 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 1.5 p -78.71 157.03 28.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.491 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -64.92 -39.27 93.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.359 0.599 . . . . 10.0 109.835 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 -124.45 157.84 63.64 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.563 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.49 122.24 10.08 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.403 2.069 . . . . 10.0 111.793 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 27.6 mtm -72.47 112.02 8.16 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.851 0.358 . . . . 10.0 111.16 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 4.0 mt -103.84 54.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.562 0.696 . . . . 10.0 109.695 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 420' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 420' ' ' ARG . 33.5 ttp180 -98.38 104.2 16.21 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.358 -0.837 . . . . 10.0 109.905 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.86 98.89 2.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.933 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 422' ' ' ASP . . . . . 0.411 ' OD2' ' HD2' ' A' ' 572' ' ' ARG . 26.4 m-20 -84.02 114.66 21.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.765 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 39.5 mt -98.41 155.73 36.53 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.468 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -66.86 176.73 4.11 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.929 2.419 . . . . 10.0 112.878 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -93.03 130.02 38.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.559 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 64.2 mt -101.19 93.64 5.56 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.01 0.433 . . . . 10.0 109.956 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 427' ' ' VAL . . . . . 0.507 HG22 ' HB3' ' A' ' 588' ' ' LEU . 61.8 t -84.31 125.1 40.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.71 -0.677 . . . . 10.0 111.003 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 428' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 4.6 m-85 -114.45 176.73 4.92 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.85 -0.613 . . . . 10.0 109.942 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.2 mmm -78.55 -75.44 0.23 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.13 -0.228 . . . . 10.0 111.195 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 58.3 p -90.63 162.12 15.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.845 0.355 . . . . 10.0 111.353 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -61.95 -32.93 73.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.527 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 436' ' ' GLN . . . -57.32 -42.64 82.25 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.728 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -65.37 -46.94 78.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.277 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 434' ' ' LYS . . . . . 0.505 ' O ' HG13 ' A' ' 438' ' ' ILE . 4.7 ttpt -58.95 -54.14 50.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.314 -0.857 . . . . 10.0 111.129 -179.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 435' ' ' ILE . . . . . 0.558 ' O ' HG12 ' A' ' 439' ' ' ILE . 40.3 mm -60.09 -45.64 95.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.388 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 432' ' ' ALA . 0.2 OUTLIER -60.96 -37.22 81.65 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.218 -179.438 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.98 -36.66 83.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.087 0.47 . . . . 10.0 109.847 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 438' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 434' ' ' LYS . 79.9 mt -65.25 -46.48 90.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.753 178.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 439' ' ' ILE . . . . . 0.558 HG12 ' O ' ' A' ' 435' ' ' ILE . 42.1 mm -57.51 -41.16 78.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.497 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -66.24 -45.07 81.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.174 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.77 -39.14 87.68 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.13 0.491 . . . . 10.0 110.117 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.557 HG12 HG11 ' A' ' 452' ' ' VAL . 71.2 mt -70.83 -49.68 48.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.565 -0.743 . . . . 10.0 111.068 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -54.08 -42.6 69.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.791 -0.641 . . . . 10.0 112.081 -178.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.99 -34.6 78.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.303 0.573 . . . . 10.0 110.684 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.469 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 66.5 mtt-85 -82.19 -17.48 46.06 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.825 -179.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 1.8 m -69.25 -28.35 66.25 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -84.71 -23.66 29.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.656 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -87.36 -14.06 41.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.938 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 79.14 36.78 26.73 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.762 -0.733 . . . . 10.0 112.619 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 450' ' ' GLN . . . . . 0.469 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 63.7 tt0 -105.44 126.42 30.91 Favored Pre-proline 0 C--N 1.324 -0.531 0 O-C-N 122.712 -0.287 . . . . 10.0 110.542 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.87 136.17 44.12 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.535 2.157 . . . . 10.0 111.421 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 452' ' ' VAL . . . . . 0.557 HG11 HG12 ' A' ' 442' ' ' ILE . 91.8 t -119.16 124.76 73.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.356 -0.384 . . . . 10.0 111.392 -178.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 52.5 tp -112.21 108.25 17.42 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.965 -0.562 . . . . 10.0 109.544 178.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 12.2 t -90.92 115.27 29.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.169 -0.468 . . . . 10.0 110.418 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -96.46 79.59 0.74 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.867 -0.682 . . . . 10.0 112.294 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 6.4 p -82.43 120.43 25.45 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.386 -0.227 . . . . 10.0 110.386 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 41.9 pt -89.93 -10.28 10.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.086 0.47 . . . . 10.0 110.638 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 458' ' ' SER . . . . . 0.499 ' OG ' ' HB2' ' A' ' 461' ' ' LYS . 25.8 p -116.57 127.01 54.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.506 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 24.2 mt -62.68 -32.95 57.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-O 120.897 0.38 . . . . 10.0 111.02 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -62.88 -33.03 74.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.977 0.418 . . . . 10.0 110.568 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.499 ' HB2' ' OG ' ' A' ' 458' ' ' SER . 0.0 OUTLIER -83.37 -30.66 27.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.769 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 17.5 m -59.32 -46.94 87.22 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.875 0.369 . . . . 10.0 110.697 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.74 -33.61 66.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.858 0.361 . . . . 10.0 110.376 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 46.7 tp -63.39 -53.05 58.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.69 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 8.1 p -63.56 -33.69 63.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.695 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 75.6 m -64.43 -42.22 96.15 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 120.744 0.307 . . . . 10.0 110.442 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -67.54 -40.3 85.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.13 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . 0.499 ' HG3' HG21 ' A' ' 435' ' ' ILE . 8.4 mm-40 -65.57 -41.66 92.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.851 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 51.8 mt -61.75 -36.69 81.75 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.9 0.381 . . . . 10.0 110.477 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.4 m -71.01 -33.45 70.38 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.294 0.569 . . . . 10.0 109.873 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -66.28 -40.36 90.03 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.483 -0.781 . . . . 10.0 110.576 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.94 -21.27 37.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.584 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 89.79 52.82 2.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.709 -0.758 . . . . 10.0 112.489 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 50.0 mt -124.82 127.28 72.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.722 0.296 . . . . 10.0 110.566 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' A' ' 500' ' ' VAL . 50.6 mttm -62.16 138.76 58.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.136 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 45.4 p-80 -156.88 147.54 21.56 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.882 0.372 . . . . 10.0 111.231 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -130.54 119.59 22.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.304 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.7 t -89.59 133.87 30.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.006 0.431 . . . . 10.0 111.408 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 86.4 mt -84.81 83.83 7.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.263 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -78.28 113.45 16.27 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.812 -0.44 . . . . 10.0 109.812 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -62.68 -10.11 11.42 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.897 0.703 . . . . 10.0 112.897 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -81.36 -10.17 59.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.985 0.422 . . . . 10.0 109.992 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -135.47 85.23 2.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.537 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' HIS . . . . . 0.406 ' HA ' ' OE1' ' A' ' 487' ' ' GLU . 30.8 m170 -61.57 -32.96 73.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.259 -178.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.51 -36.03 82.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.025 0.441 . . . . 10.0 110.086 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.93 -44.06 73.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.462 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.406 ' OE1' ' HA ' ' A' ' 484' ' ' HIS . 37.5 mt-10 -59.73 -47.83 84.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.433 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -60.26 -33.96 73.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.63 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -70.52 -38.56 74.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.808 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 50.8 mt -74.84 -45.68 43.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.799 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.0 t -55.36 -34.62 34.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.138 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -57.4 -31.49 65.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.542 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -124.62 26.59 7.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.734 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -69.02 -21.25 64.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.132 0.492 . . . . 10.0 110.902 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -100.08 14.12 60.04 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.771 -0.728 . . . . 10.0 111.671 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -75.52 140.44 71.94 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.208 -0.293 . . . . 10.0 110.208 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -52.59 125.98 19.54 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.689 2.26 . . . . 10.0 113.356 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 70.78 16.52 6.69 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.449 -0.796 . . . . 10.0 112.8 178.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.23 115.29 26.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.897 0.379 . . . . 10.0 110.105 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' A' ' 475' ' ' LYS . 53.8 t -96.1 108.03 20.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.247 0.546 . . . . 10.0 110.205 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 7.4 m -106.11 130.18 54.05 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.601 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 49.0 mt -109.41 119.28 58.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.2 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -109.19 130.29 55.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.87 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 7.0 m -100.72 93.58 5.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.816 0.341 . . . . 10.0 110.75 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 55.51 78.41 0.19 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.456 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 8.6 ttt -83.87 142.88 30.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.421 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -70.8 173.01 7.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.007 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -61.69 156.82 35.18 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 116.144 -0.48 . . . . 10.0 113.172 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.55 HH21 ' HB2' ' A' ' 210' ' ' GLU . 75.5 mtt180 70.77 -82.05 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.463 0.705 . . . . 10.0 111.302 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 79.73 170.65 40.72 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.53 -0.628 . . . . 10.0 111.53 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.28 148.47 49.72 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.585 0.231 . . . . 10.0 110.584 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.53 90.68 4.51 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.822 -0.436 . . . . 10.0 109.822 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 70.8 mt -70.7 114.74 9.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.692 -0.685 . . . . 10.0 111.235 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 3.9 t -89.71 133.84 30.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.663 -0.698 . . . . 10.0 110.182 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 53.7 mt -64.9 131.57 47.05 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.515 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 98.13 -17.17 59.06 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 121.079 -0.582 . . . . 10.0 111.743 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 115.66 -164.38 12.2 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.0 p -135.05 101.79 4.99 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 117.061 0.431 . . . . 10.0 110.624 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 53.3 p-90 -56.28 -28.15 57.75 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.315 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -61.0 -43.32 99.05 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.055 0.455 . . . . 10.0 110.662 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -73.09 -23.03 60.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.873 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -79.49 -47.06 16.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.042 -0.527 . . . . 10.0 110.574 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . 0.449 HG12 HD12 ' A' ' 537' ' ' ILE . 34.0 m -69.4 -23.45 26.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.927 0.394 . . . . 10.0 110.848 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -78.89 -10.85 59.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.009 0.433 . . . . 10.0 110.916 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -94.25 -3.1 51.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.665 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 58.5 mt -97.19 152.28 18.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.317 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -64.64 -61.22 2.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.554 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -131.1 97.28 20.34 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 529' ' ' PRO . . . . . 0.446 ' HA ' ' OE1' ' A' ' 533' ' ' GLN . 60.7 Cg_endo -81.17 93.18 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.613 2.209 . . . . 10.0 112.057 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 17.5 p -71.04 168.84 16.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.448 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.92 -41.42 70.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.936 0.398 . . . . 10.0 111.025 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -61.01 -43.58 98.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.053 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . 0.446 ' OE1' ' HA ' ' A' ' 529' ' ' PRO . 75.0 mt-30 -65.3 -46.64 79.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.731 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.421 HG22 ' HE2' ' A' ' 538' ' ' LYS . 75.1 mt -58.85 -49.24 83.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.314 -179.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -61.98 -41.88 98.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.036 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 20.1 tptp -61.08 -49.05 78.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.801 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . 0.449 HD12 HG12 ' A' ' 523' ' ' VAL . 74.6 mt -63.79 -39.29 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.706 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . 0.421 ' HE2' HG22 ' A' ' 534' ' ' ILE . 25.1 mtmt -62.11 -39.62 93.12 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.865 0.364 . . . . 10.0 110.277 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -62.92 -44.41 96.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.225 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -67.26 -41.95 84.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.115 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 70.9 t90 -60.46 -39.63 88.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.568 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -57.5 -46.03 84.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.469 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.61 -42.06 94.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.883 179.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 544' ' ' ARG . . . . . 0.465 ' O ' HG23 ' A' ' 548' ' ' VAL . 31.6 mtp180 -62.41 -38.54 90.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.824 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -66.77 -47.39 72.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.469 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -33.4 75.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.859 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.7 99.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.926 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 548' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 544' ' ' ARG . 67.7 t -65.82 -35.14 74.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.386 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 84.0 mt -62.26 -43.64 98.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.315 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.18 -18.15 61.29 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.913 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 551' ' ' ALA . . . . . 0.458 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -80.19 -30.49 38.76 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.398 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 125.82 19.14 2.29 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.571 -0.823 . . . . 10.0 112.973 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 72.21 -163.76 54.52 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.938 -0.649 . . . . 10.0 112.505 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 51.8 tp -77.91 119.68 21.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.918 0.389 . . . . 10.0 110.336 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.4 t60 -92.51 115.54 28.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.163 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 14.8 mm -98.83 132.8 43.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.929 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 557' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.8 mt -124.21 122.72 64.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.918 0.39 . . . . 10.0 110.517 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.89 116.71 5.24 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.897 -0.668 . . . . 10.0 111.437 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 19.0 p -74.37 -43.19 57.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.125 0.488 . . . . 10.0 110.656 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . 0.43 ' OE2' ' HG2' ' A' ' 461' ' ' LYS . 19.8 mp0 -136.72 145.21 44.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.631 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 561' ' ' ARG . . . . . 0.475 ' HB2' HD22 ' A' ' 594' ' ' LEU . 88.1 mtt-85 -95.36 166.85 11.68 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.854 -0.424 . . . . 10.0 109.854 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 562' ' ' HIS . . . . . 0.42 ' CE1' HD12 ' A' ' 567' ' ' ILE . 46.2 t-80 -107.39 149.85 27.41 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -57.02 -64.98 0.7 Allowed 'General case' 0 N--CA 1.462 0.148 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.75 117.45 10.48 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 108.937 -0.764 . . . . 10.0 108.937 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 565' ' ' ARG . . . . . 0.409 ' HB3' ' OG1' ' A' ' 396' ' ' THR . 14.2 tpt180 -61.66 -14.36 30.53 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.891 -178.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 566' ' ' ARG . . . . . 0.535 ' HG2' ' HB1' ' A' ' 394' ' ' ALA . 5.4 ttm180 -55.06 -45.41 75.32 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 121.002 0.43 . . . . 10.0 110.939 179.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 567' ' ' ILE . . . . . 0.42 HD12 ' CE1' ' A' ' 562' ' ' HIS . 61.3 mt -81.1 -31.75 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.458 . . . . 10.0 110.401 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -61.41 -51.48 68.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.135 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 569' ' ' ASN . . . . . 0.533 ' HB3' ' O ' ' A' ' 393' ' ' THR . 31.3 m-20 -65.27 -28.95 69.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.634 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -62.13 -36.75 82.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.214 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 40.3 tp -76.65 -35.72 57.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.377 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 572' ' ' ARG . . . . . 0.411 ' HD2' ' OD2' ' A' ' 422' ' ' ASP . 14.4 ttp180 -69.32 -30.8 68.94 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.16 0.505 . . . . 10.0 110.497 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -85.37 13.82 53.4 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 121.035 -0.602 . . . . 10.0 113.76 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 574' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 574' ' ' ARG . 3.9 mmt180 -75.46 -32.38 60.6 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 117.231 0.515 . . . . 10.0 110.279 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 4.7 t -91.03 166.63 12.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.471 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 67.16 54.02 23.01 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.724 -0.75 . . . . 10.0 112.571 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 15.2 mmt180 -69.02 117.23 10.41 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 578' ' ' GLN . . . . . 0.649 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 3.5 tt0 61.45 26.79 16.49 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.968 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 86.4 55.97 2.36 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.867 -0.683 . . . . 10.0 112.679 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -108.36 -169.3 1.48 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.94 -0.393 . . . . 10.0 109.94 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -95.25 150.3 20.39 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.962 0.41 . . . . 10.0 111.596 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.59 -179.18 48.37 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.135 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.6 p -155.31 128.57 8.3 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.144 -0.317 . . . . 10.0 110.144 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.11 125.45 52.16 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.785 0.326 . . . . 10.0 111.147 -179.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 585' ' ' ARG . . . . . 0.43 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 2.0 tpm_? -129.69 122.51 29.11 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -113.48 149.8 33.76 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.046 0.451 . . . . 10.0 110.777 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 587' ' ' TYR . . . . . 0.494 ' CD1' HG12 ' A' ' 438' ' ' ILE . 59.9 m-85 -129.0 162.06 28.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.988 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 588' ' ' LEU . . . . . 0.507 ' HB3' HG22 ' A' ' 427' ' ' VAL . 44.6 tp -162.51 149.41 13.32 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.104 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 92.5 p -123.3 169.94 10.8 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.808 -0.442 . . . . 10.0 109.808 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 71.4 mmm -83.61 0.22 47.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.144 0.497 . . . . 10.0 110.075 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -100.91 -17.37 16.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.005 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -70.71 147.48 49.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.13 0.49 . . . . 10.0 111.451 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -65.12 -15.88 62.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.558 -0.746 . . . . 10.0 112.735 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 594' ' ' LEU . . . . . 0.546 ' O ' HG12 ' A' ' 597' ' ' ILE . 14.5 tp -64.81 -23.15 67.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.703 0.287 . . . . 10.0 111.406 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 7.0 mmt -75.49 -2.42 28.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.725 0.298 . . . . 10.0 111.442 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -95.17 -7.66 38.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.514 -0.312 . . . . 10.0 111.37 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 597' ' ' ILE . . . . . 0.546 HG12 ' O ' ' A' ' 594' ' ' LEU . 20.2 pt -79.51 -13.09 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-O 120.945 0.402 . . . . 10.0 111.298 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -84.75 50.48 1.92 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.409 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 70.6 -55.83 0.62 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.812 0.845 . . . . 10.0 111.167 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 59.4 m -155.0 137.74 15.27 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -62.88 -17.2 61.28 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 602' ' ' ARG . . . . . 0.416 ' HD2' ' O ' ' A' ' 602' ' ' ARG . 1.8 tmm_? -64.32 -35.46 80.93 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 48.5 t -71.2 -46.37 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.91 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -20.03 63.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.522 -0.763 . . . . 10.0 111.213 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -62.93 -15.08 55.15 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 116.018 -0.537 . . . . 10.0 113.088 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 46.2 tpp -67.37 -21.56 65.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.095 0.474 . . . . 10.0 110.431 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 66.6 mtt -78.32 -11.24 59.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.569 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 608' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 608' ' ' ARG . 59.8 mtt-85 -69.17 -17.64 63.83 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.089 0.471 . . . . 10.0 110.298 179.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -102.74 28.37 6.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.766 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 22.6 tp -88.17 -14.59 38.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.23 0.538 . . . . 10.0 110.099 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 111.26 -48.07 0.98 Allowed Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.803 -0.635 . . . . 10.0 112.193 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 66.98 -77.54 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.368 0.667 . . . . 10.0 111.836 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 59.86 83.98 0.2 Allowed Pre-proline 0 N--CA 1.464 0.229 0 O-C-N 123.613 0.571 . . . . 10.0 110.992 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 614' ' ' PRO . . . . . 0.453 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 31.8 Cg_exo -58.13 105.03 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.833 2.355 . . . . 10.0 112.278 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 125.0 -14.68 7.46 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 121.023 -0.608 . . . . 10.0 111.71 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -110.57 129.56 55.77 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.061 -0.348 . . . . 10.0 110.061 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -83.3 100.65 10.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.542 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 4.7 tp -66.93 -28.53 43.3 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.758 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 40.01 82.64 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.611 0.967 . . . . 10.0 113.611 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 40.8 m170 -119.71 100.57 48.94 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -57.48 -30.17 87.3 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 123.368 2.712 . . . . 10.0 113.752 -178.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 65.9 p-90 -63.59 -22.08 66.7 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 121.12 -0.232 . . . . 10.0 111.583 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 70.1 t -66.84 -48.7 79.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 109.704 -0.48 . . . . 10.0 109.704 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 43.8 m -60.56 -40.39 91.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.38 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -67.13 -32.34 73.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.661 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -70.8 -43.81 67.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.959 0.409 . . . . 10.0 110.126 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.67 -45.25 92.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.289 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.36 -34.9 74.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.808 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -65.21 -48.8 72.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.817 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . 0.47 ' O ' HG23 ' A' ' 634' ' ' VAL . . . -65.99 -36.87 84.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.832 179.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -58.11 -44.93 87.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.066 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 632' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 632' ' ' ARG . 9.5 mtp180 -74.05 -25.46 59.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.294 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -68.62 -37.13 79.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.32 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 634' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 630' ' ' ALA . 88.5 t -57.46 -48.06 83.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 109.786 -0.45 . . . . 10.0 109.786 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -70.18 -28.18 65.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.818 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.8 m -63.48 -35.25 79.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.181 -0.674 . . . . 10.0 109.181 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -70.25 -40.96 74.11 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.359 -0.837 . . . . 10.0 109.084 178.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -66.77 -35.6 80.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.257 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -58.13 -43.88 87.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.093 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.22 -40.63 90.84 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 641' ' ' ILE . . . . . 0.444 ' O ' ' HG ' ' A' ' 645' ' ' LEU . 61.3 mt -67.77 -46.22 82.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.3 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 64.8 mtm-85 -58.16 -42.79 86.73 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.038 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -61.65 -45.52 93.68 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.73 179.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -60.9 -39.74 90.43 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.862 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 641' ' ' ILE . 85.0 mt -71.03 -40.45 71.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.675 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 646' ' ' LEU . . . . . 0.433 ' HA ' ' HB2' ' A' ' 649' ' ' ASP . 82.4 mt -67.46 -24.43 65.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.578 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 647' ' ' GLU . . . . . 0.519 ' O ' HG23 ' A' ' 651' ' ' VAL . 2.6 mm-40 -58.33 -44.68 88.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.043 178.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -77.63 -31.17 52.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.333 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 649' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 646' ' ' LEU . 88.1 m-20 -65.9 -45.43 82.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.428 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 650' ' ' ASP . . . . . 0.459 ' HA ' ' HB3' ' A' ' 653' ' ' ASN . 15.9 t70 -63.46 -28.75 70.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.51 -0.313 . . . . 10.0 111.469 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 651' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 647' ' ' GLU . 53.7 t -61.25 -50.46 80.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.444 -0.576 . . . . 10.0 109.444 178.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -70.48 -27.61 64.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.991 179.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 653' ' ' ASN . . . . . 0.459 ' HB3' ' HA ' ' A' ' 650' ' ' ASP . 20.5 t30 -63.13 -52.14 63.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.395 -0.821 . . . . 10.0 111.11 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -62.03 -44.56 96.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.808 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -60.73 -42.1 96.63 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.871 0.367 . . . . 10.0 110.083 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 6.6 ttp-105 -63.75 -45.99 87.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.02 178.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 657' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 657' ' ' ARG . 13.2 ttp180 -60.09 -43.16 95.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.694 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.71 -53.84 44.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.719 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.8 tp -65.31 -32.17 57.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-O 120.655 0.264 . . . . 10.0 111.419 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -69.78 -32.41 70.89 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 110.39 -0.226 . . . . 10.0 110.39 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 49.1 m -65.62 -46.29 79.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -63.77 -43.78 95.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.371 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 28.3 ttt-85 -63.26 -36.73 84.63 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.521 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -66.1 -40.71 90.98 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.776 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 665' ' ' GLU . . . . . 0.405 ' O ' HG22 ' A' ' 669' ' ' VAL . 1.6 tp10 -60.67 -49.74 76.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.054 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 61.7 mt -67.32 -17.19 64.66 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.066 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 44.2 tp -83.18 -44.13 15.38 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.385 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -71.63 -47.96 51.09 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 665' ' ' GLU . 20.0 m -68.59 149.36 11.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.073 0.463 . . . . 10.0 111.566 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -42.54 9.92 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.917 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -94.99 140.86 29.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.386 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 8.6 p -135.2 11.8 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.918 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 8.1 m -55.18 -38.61 68.57 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.587 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -59.17 -51.74 68.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 10.0 111.219 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 675' ' ' THR . . . . . 0.504 ' O ' HG12 ' A' ' 679' ' ' ILE . 0.2 OUTLIER -63.99 -46.12 86.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.051 -179.76 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 676' ' ' ILE . . . . . 0.408 ' O ' ' HB2' ' A' ' 680' ' ' ARG . 34.0 mm -58.47 -44.2 88.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.874 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -72.52 -40.5 66.76 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.949 -0.3 . . . . 10.0 111.613 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 60.6 m -61.92 -39.43 92.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.659 -0.246 . . . . 10.0 111.464 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 679' ' ' ILE . . . . . 0.504 HG12 ' O ' ' A' ' 675' ' ' THR . 45.9 pt -83.49 -21.07 8.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 120.835 -0.346 . . . . 10.0 111.011 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 680' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 676' ' ' ILE . 30.3 ttm-85 -59.66 -51.13 71.11 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.917 0.389 . . . . 10.0 110.702 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 681' ' ' GLU . . . . . 0.425 ' HG2' ' H ' ' A' ' 681' ' ' GLU . 2.8 pt-20 -63.76 -36.38 83.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.057 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -66.95 -46.5 74.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.836 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 683' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 679' ' ' ILE . 72.1 t -60.09 -45.1 96.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.361 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -62.98 -45.55 91.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.308 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 34.3 tttm -58.81 -49.2 78.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.694 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -60.4 -41.04 93.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.402 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 25.6 m -67.87 -40.08 83.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.39 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 92.1 mt -68.61 -43.4 83.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.213 -0.448 . . . . 10.0 110.377 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -60.92 -19.09 60.1 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.866 0.365 . . . . 10.0 111.721 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -79.59 -21.06 45.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.736 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -117.4 -29.28 5.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.995 0.426 . . . . 10.0 110.995 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 692' ' ' ILE . . . . . 0.56 HG23 ' CD1' ' A' ' 701' ' ' TRP . 55.6 mt -124.79 106.16 29.4 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.386 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -72.72 138.74 29.61 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.701 2.267 . . . . 10.0 111.389 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 694' ' ' PRO . . . . . 0.444 ' HA ' ' OE1' ' A' ' 732' ' ' GLU . 37.4 Cg_endo -67.21 131.37 24.9 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.344 2.029 . . . . 10.0 112.891 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 64.11 41.33 6.37 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.708 -0.678 . . . . 10.0 112.03 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 40.4 p -107.86 -150.98 0.46 Allowed 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 96.8 mt -113.55 158.71 20.42 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.174 -0.306 . . . . 10.0 110.174 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -58.99 -36.73 75.39 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.237 0.458 . . . . 10.0 112.237 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -78.29 1.39 21.89 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.032 0.444 . . . . 10.0 111.294 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 60.9 mtt -104.38 7.05 35.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.145 0.498 . . . . 10.0 110.071 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 701' ' ' TRP . . . . . 0.56 ' CD1' HG23 ' A' ' 692' ' ' ILE . 48.7 m0 -104.5 121.49 43.58 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.437 -178.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -86.05 82.74 7.98 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 703' ' ' ILE . . . . . 0.477 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 39.2 mm -61.74 -48.99 88.22 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.34 -0.846 . . . . 10.0 112.009 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 704' ' ' PRO . . . . . 0.477 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 42.9 Cg_exo -58.15 -43.69 45.47 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.008 1.805 . . . . 10.0 112.425 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -62.82 -42.93 99.59 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.954 -0.641 . . . . 10.0 112.299 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 35.2 tp -69.16 -42.49 75.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.659 0.266 . . . . 10.0 110.472 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -60.97 -44.91 96.64 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.706 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.83 -41.86 99.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.785 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -64.16 -41.98 96.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.888 0.375 . . . . 10.0 110.567 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 89.9 mt -62.64 -38.96 92.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.237 0.541 . . . . 10.0 110.011 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 21.1 mtpp -86.49 13.13 8.87 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.588 -0.733 . . . . 10.0 111.349 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -125.8 -51.95 1.57 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.767 0.318 . . . . 10.0 111.511 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -98.03 -23.64 15.68 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.353 0.871 . . . . 10.0 113.353 -177.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -108.63 -6.46 15.99 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.363 -0.535 . . . . 10.0 112.204 -178.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 39.1 t70 57.01 32.92 22.51 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.596 0.713 . . . . 10.0 110.7 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 12.5 tp -120.69 117.65 28.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.171 0.51 . . . . 10.0 111.06 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -90.96 99.24 12.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.459 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 77.7 mt -121.97 123.06 27.46 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.832 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -85.16 73.69 4.09 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.816 2.344 . . . . 10.0 111.653 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 46.7 mt -57.81 -37.67 61.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.115 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -62.34 -29.69 70.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.799 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -81.67 -37.61 27.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.003 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 42.5 m0 -60.92 -56.72 17.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.645 -0.707 . . . . 10.0 111.233 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 18.2 tp -65.07 -24.44 67.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.041 0.448 . . . . 10.0 111.244 -179.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -66.81 -39.93 87.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.042 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 726' ' ' LYS . . . . . 0.444 ' O ' ' HD3' ' A' ' 728' ' ' PRO . 8.8 mttp -99.84 -29.51 12.56 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.446 0.536 . . . . 10.0 112.446 -178.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -114.97 87.41 15.15 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 120.719 0.295 . . . . 10.0 111.049 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . 0.504 ' HD2' ' OE1' ' A' ' 729' ' ' GLU . 10.6 Cg_exo -72.27 -22.23 22.31 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.683 2.255 . . . . 10.0 112.346 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . 0.504 ' OE1' ' HD2' ' A' ' 728' ' ' PRO . 4.0 mp0 -74.59 1.95 10.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.75 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 730' ' ' LEU . . . . . 0.421 HD21 ' NH1' ' A' ' 738' ' ' ARG . 16.4 mt -66.12 -27.34 67.97 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 56.42 -101.41 0.13 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.801 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 732' ' ' GLU . . . . . 0.444 ' OE1' ' HA ' ' A' ' 694' ' ' PRO . 8.4 tt0 -148.99 -54.31 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.924 -0.31 . . . . 10.0 111.428 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.78 -50.51 73.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.454 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.59 -35.61 74.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.559 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 4.5 tt -65.0 -43.47 92.44 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.164 -0.471 . . . . 10.0 109.898 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 736' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 736' ' ' ARG . 52.8 mtt180 -62.67 -46.75 86.72 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.115 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -63.13 -38.1 89.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.198 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 738' ' ' ARG . . . . . 0.421 ' NH1' HD21 ' A' ' 730' ' ' LEU . 21.9 mmm-85 -57.47 -49.83 75.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.853 0.359 . . . . 10.0 110.089 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 79.8 mt -57.31 -46.34 85.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.218 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 740' ' ' LEU . . . . . 0.434 ' O ' HG13 ' A' ' 744' ' ' ILE . 53.6 tp -62.0 -47.2 85.86 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.11 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -59.44 -46.71 87.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.382 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.9 -35.73 77.42 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.199 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 20.4 m -66.66 -44.84 80.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.435 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 744' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 740' ' ' LEU . 73.1 mt -64.49 -37.65 80.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.458 . . . . 10.0 110.614 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.47 -55.66 25.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.363 -0.381 . . . . 10.0 110.611 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 85.0 t -62.23 -35.47 69.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.758 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -58.67 -49.48 77.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.463 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 748' ' ' GLN . . . . . 0.588 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 44.0 mt-30 -64.52 -35.99 82.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.493 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 64.8 mtp180 -64.68 -36.77 85.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.147 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -71.08 -37.72 72.45 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.45 -45.43 91.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.877 -1.056 . . . . 10.0 112.269 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 752' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 56.2 mt-10 -58.61 -28.7 65.86 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -178.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 17.8 t -78.74 -32.6 15.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.992 0.425 . . . . 10.0 111.147 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.9 t -86.59 -46.04 16.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.082 0.468 . . . . 10.0 110.946 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 130.78 137.78 4.17 Favored Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 111.137 -0.785 . . . . 10.0 111.137 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 756' ' ' ALA . . . . . 0.441 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -57.64 -59.26 5.47 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 757' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 757' ' ' GLU . 27.1 mp0 -63.09 -36.03 82.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.762 0.315 . . . . 10.0 111.032 -179.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 17.5 tpt -65.85 -43.86 87.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.82 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 40.3 mmm -63.03 -42.51 99.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.516 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.441 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.7 mmp_? -60.12 -39.25 85.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.249 0.547 . . . . 10.0 109.834 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -69.45 -38.11 77.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.711 178.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -64.07 -49.96 70.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.158 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -59.08 -46.12 89.1 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.213 -0.448 . . . . 10.0 110.31 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -57.44 -46.2 83.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.24 178.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -66.68 -46.04 79.19 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.832 -0.622 . . . . 10.0 112.351 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 61.6 t -59.66 -42.01 87.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.408 0.147 . . . . 10.0 110.822 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 22.7 mtp -59.94 -48.82 80.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.726 0.298 . . . . 10.0 110.427 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.99 -43.3 96.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.644 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -62.5 -48.3 80.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.312 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 8.4 m -63.0 -40.17 96.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.85 0.357 . . . . 10.0 110.292 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.6 tt -61.61 -46.92 87.78 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.433 -0.581 . . . . 10.0 109.433 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 772' ' ' ASP . . . . . 0.593 ' O ' ' HG2' ' A' ' 776' ' ' LYS . 0.3 OUTLIER -63.99 -43.6 95.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.796 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 42.1 m -55.86 -45.98 78.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.896 0.379 . . . . 10.0 110.844 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.24 -24.96 59.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.723 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -67.62 -38.84 84.48 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.996 -0.372 . . . . 10.0 109.996 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.593 ' HG2' ' O ' ' A' ' 772' ' ' ASP . 3.8 mmtt -62.38 -40.84 97.79 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 108.816 -0.809 . . . . 10.0 108.816 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 15.5 tm-20 -63.4 -53.29 54.65 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.912 -1.04 . . . . 10.0 109.374 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 778' ' ' HIS . . . . . 0.537 ' O ' ' HG2' ' A' ' 782' ' ' MET . 16.0 t60 -54.77 -37.27 65.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.31 -0.859 . . . . 10.0 111.86 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.16 -44.31 97.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.999 0.428 . . . . 10.0 110.361 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -75.43 -38.14 59.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.433 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.97 -42.06 93.33 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.9 -0.591 . . . . 10.0 111.281 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 782' ' ' MET . . . . . 0.537 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 97.5 mmm -60.0 -37.67 80.38 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.171 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 783' ' ' ASP . . . . . 0.424 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 9.1 t70 -71.79 -45.82 60.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.421 179.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -54.48 -42.52 70.82 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.531 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 21.9 tp -78.93 -30.97 44.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.858 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -58.5 -45.15 89.36 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.956 0.407 . . . . 10.0 110.984 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 787' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 6.9 pt20 . . . . . 0 C--N 1.322 -0.598 0 C-N-CA 120.749 -0.38 . . . . 10.0 110.627 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo . . . . . 0 CA--C 1.529 0.239 0 N-CA-C 113.807 0.657 . . . . 10.0 113.807 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 25.7 mtmm -82.45 -45.48 14.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.001 0.429 . . . . 10.0 109.95 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -62.95 -44.19 96.74 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.695 -0.684 . . . . 10.0 111.418 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -65.66 -36.55 83.99 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -61.36 -47.52 85.48 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.003 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -58.3 -40.46 82.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.114 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -60.39 -53.5 56.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.33 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -60.77 -37.49 82.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.692 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 28.4 m -65.97 -36.77 84.23 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.904 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -67.37 -41.46 85.03 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 6.6 m -65.47 -38.25 89.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.204 0.526 . . . . 10.0 109.827 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 32.7 ttm -63.52 -41.85 98.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.327 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -65.83 -42.49 90.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.57 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.42 -46.53 89.73 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.008 0.432 . . . . 10.0 110.32 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.75 85.03 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.463 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 22.4 ttp -63.61 -40.72 97.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.098 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.5 -40.59 95.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.523 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -65.05 -40.88 95.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.149 0.5 . . . . 10.0 110.173 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 14.4 m -68.93 -30.84 69.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.256 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 61.5 tp -63.55 -57.43 10.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.608 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt -61.13 -34.52 75.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.691 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -60.45 -61.44 2.6 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.582 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.79 -31.57 72.29 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.554 0.576 . . . . 10.0 112.554 -178.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 822' ' ' VAL . . . . . 0.442 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 14.6 t -60.22 -54.58 32.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.851 -0.34 . . . . 10.0 110.282 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 34.3 mm -66.6 -40.63 86.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.934 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 50.7 m -60.65 -50.9 71.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.005 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 93.3 m -59.6 -38.72 82.0 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.749 0.309 . . . . 10.0 111.593 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 826' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 94.6 mt -66.65 -18.27 65.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.823 0.344 . . . . 10.0 111.347 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 5.4 m -102.51 -34.1 9.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.913 0.387 . . . . 10.0 110.309 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -63.35 -23.89 67.61 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.624 -0.717 . . . . 10.0 111.722 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.82 122.33 4.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 121.586 0.708 . . . . 10.0 111.323 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -86.38 93.13 9.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.549 -0.751 . . . . 10.0 110.161 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 62.1 t . . . . . 0 C--N 1.319 -0.743 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.606 179.664 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 74.0 t80 . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 120.887 0.375 . . . . 10.0 110.84 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 136.62 150.0 5.76 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.908 -0.663 . . . . 10.0 112.444 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' HB3' ' A' ' 16' ' ' ARG . 6.0 m -63.31 148.16 49.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.906 0.384 . . . . 10.0 110.421 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.665 ' HD2' ' OD1' ' A' ' 408' ' ' ASP . 2.3 mmp_? -66.94 143.9 56.55 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.53 0.567 . . . . 10.0 112.53 -178.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.9 t30 68.33 -82.96 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 114.76 -1.109 . . . . 10.0 112.801 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -51.63 -59.64 4.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.509 0.929 . . . . 10.0 113.509 -177.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 16' ' ' ARG . 8.1 tpt180 -72.13 -41.73 66.84 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.76 0.652 . . . . 10.0 112.76 -177.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.6 p -59.44 -50.55 73.51 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.9 mt -64.06 -37.88 89.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.762 0.315 . . . . 10.0 111.041 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 23.6 ttp-105 -65.62 -45.12 84.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.469 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -63.58 -41.74 98.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.124 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.419 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 52.1 mtt -65.81 -34.81 79.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.618 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -61.96 -33.4 74.23 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.012 0.434 . . . . 10.0 110.135 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 19' ' ' ARG . 25.0 mtpp -66.88 -35.61 80.42 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.33 -0.618 . . . . 10.0 109.33 179.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 56.9 t -71.87 -38.83 66.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.504 -0.771 . . . . 10.0 109.476 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.574 HG13 HD12 ' A' ' 88' ' ' LEU . 59.5 t -58.49 -36.18 57.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.683 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -60.66 -38.66 85.62 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.069 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.7 mt -65.72 -43.97 93.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 65.9 mt -62.65 -36.44 75.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.503 -0.772 . . . . 10.0 110.233 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -63.35 -36.27 83.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.478 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.2 -25.28 36.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.71 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 46.8 mtt -80.35 -19.05 47.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.064 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.487 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 5.8 tt0 -59.65 -55.87 41.46 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-O 119.356 -0.355 . . . . 10.0 110.973 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.487 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 27.5 Cg_exo -63.7 -19.34 67.1 Favored 'Trans proline' 0 C--N 1.359 1.09 0 C-N-CA 121.97 1.78 . . . . 10.0 111.712 179.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -74.3 -45.09 49.72 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.4 mmt -68.96 -24.02 64.21 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.357 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 96.5 mt-10 -65.06 -22.77 67.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.76 179.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.9 mttt -86.35 -6.61 58.9 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.386 0.613 . . . . 10.0 109.915 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.2 mp -98.38 141.21 31.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.383 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.8 p -74.48 170.15 16.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.241 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -60.23 -38.05 82.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.959 0.409 . . . . 10.0 110.846 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -68.12 -32.89 73.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.721 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.71 -34.34 73.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.764 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.88 -43.65 98.42 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -67.04 -32.48 73.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.093 -0.958 . . . . 10.0 109.761 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.5 -34.91 90.86 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.351 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -66.74 -36.88 83.49 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.3 m -60.78 -44.83 96.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.136 178.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.15 -33.85 76.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.284 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -65.16 -40.51 94.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.65 179.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.413 ' CD1' HD22 ' A' ' 63' ' ' LEU . 23.2 m-30 -61.01 -42.66 98.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.777 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -59.02 -43.12 91.53 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.016 0.436 . . . . 10.0 110.372 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.37 -41.37 76.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.891 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -61.44 -38.11 86.0 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.153 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 55.3 mt -63.22 -40.16 96.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.801 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -70.14 -31.96 69.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.539 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -69.65 -61.79 1.64 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.785 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 168.95 27.27 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.204 -0.998 . . . . 10.0 113.27 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -94.02 140.92 29.13 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.1 t -87.09 139.43 17.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.572 HD11 ' O ' ' A' ' 118' ' ' LEU . 20.6 tp -56.26 -40.75 74.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.967 0.413 . . . . 10.0 111.107 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -63.43 -21.55 66.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.626 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -82.31 -20.73 36.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.076 0.465 . . . . 10.0 110.358 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.413 HD22 ' CD1' ' A' ' 50' ' ' PHE . 90.6 mt -82.15 -9.32 59.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.625 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.538 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 76.8 mt -49.43 -53.4 40.72 Favored Pre-proline 0 CA--C 1.542 0.645 0 N-CA-C 113.013 0.746 . . . . 10.0 113.013 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.538 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 33.5 Cg_exo -58.95 -49.83 10.4 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.963 1.776 . . . . 10.0 113.204 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.442 ' O ' HG23 ' A' ' 70' ' ' VAL . 48.6 mt-10 -69.61 -43.8 72.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.335 -0.393 . . . . 10.0 111.955 -178.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.42 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -64.9 -47.56 77.36 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.002 0.371 . . . . 10.0 112.002 -178.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -61.5 -34.03 74.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.7 -0.227 . . . . 10.0 110.663 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.58 -43.98 88.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.372 179.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 66' ' ' GLU . 95.5 t -61.59 -47.44 93.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.024 -0.534 . . . . 10.0 110.265 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 67' ' ' ALA . 48.2 t -61.58 -42.52 94.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.442 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -59.82 -46.22 89.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.488 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -64.17 -44.25 92.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.383 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.46 -33.39 72.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.374 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.5 m -63.76 -37.11 86.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.38 179.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.6 mtmm -72.33 -12.51 61.17 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.83 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -110.89 -39.32 4.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -178.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 62.0 t -82.07 -45.09 20.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.957 0.408 . . . . 10.0 111.702 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -101.21 -27.88 12.96 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.854 0.359 . . . . 10.0 111.212 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.11 4.63 81.35 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.017 -0.611 . . . . 10.0 111.784 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 18.0 mtt -117.27 139.94 50.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.587 -0.523 . . . . 10.0 109.587 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.434 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 8.5 ttp180 -85.66 138.05 32.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.815 0.34 . . . . 10.0 110.711 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.41 114.31 5.33 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -55.56 152.52 8.98 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 123.596 0.56 . . . . 10.0 112.022 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.75 -40.17 96.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.975 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.9 m -68.29 -27.33 36.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 10.0 111.084 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.463 HE22 HD23 ' A' ' 110' ' ' LEU . 96.7 mt-30 -70.96 -30.29 66.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.221 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.574 HD12 HG13 ' A' ' 25' ' ' VAL . 86.9 mt -65.22 -36.21 83.45 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.466 ' O ' HG23 ' A' ' 93' ' ' VAL . 82.2 mt -65.19 -50.57 65.41 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.835 -0.621 . . . . 10.0 109.719 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.09 99.5 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.666 -0.697 . . . . 10.0 112.089 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -66.44 -32.2 81.1 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.886 -0.673 . . . . 10.0 112.079 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.419 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 13.9 ttm -71.27 -36.09 71.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.846 0.355 . . . . 10.0 110.424 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 89' ' ' LEU . 76.5 t -65.82 -33.78 65.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.223 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.76 -2.27 22.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.702 -0.681 . . . . 10.0 112.13 -179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -80.5 -28.03 37.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.207 0.527 . . . . 10.0 109.988 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -103.73 175.43 5.48 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.167 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 43.1 ttt85 -78.49 77.83 4.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.888 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 408' ' ' ASP . 0.4 OUTLIER -152.0 159.85 43.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.099 0.476 . . . . 10.0 111.582 -179.676 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.577 HD12 HG11 ' A' ' 211' ' ' VAL . 49.9 mm -100.12 134.64 39.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.713 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.84 111.95 23.69 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.851 0.358 . . . . 10.0 111.287 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -86.99 117.11 25.49 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.7 mtt -111.59 177.67 4.58 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.281 0.562 . . . . 10.0 111.495 -178.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.466 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 9.2 mmm180 -108.73 142.71 38.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.312 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.63 110.0 2.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.771 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.445 ' O ' ' HG2' ' A' ' 578' ' ' GLN . . . 127.17 -23.36 5.51 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.856 -0.687 . . . . 10.0 112.535 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -75.85 -41.06 53.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.939 0.4 . . . . 10.0 110.834 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 155.27 150.38 5.56 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.971 -0.633 . . . . 10.0 111.63 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.416 ' HE2' ' HA ' ' A' ' 108' ' ' LYS . 0.3 OUTLIER -121.55 -80.43 0.62 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.777 0.289 . . . . 10.0 110.687 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.74 -24.64 38.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.061 0.457 . . . . 10.0 110.675 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.463 HD23 HE22 ' A' ' 87' ' ' GLN . 45.9 tp -63.14 -25.29 68.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.323 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.96 -20.99 26.5 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.23 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -83.06 -8.84 59.49 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.435 0.531 . . . . 10.0 112.435 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 11.5 p -67.1 -33.36 75.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.768 0.318 . . . . 10.0 111.793 -179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.403 ' HB2' ' CD ' ' A' ' 115' ' ' PRO . 26.3 mt -65.71 -57.6 13.74 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.929 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.403 ' CD ' ' HB2' ' A' ' 114' ' ' LEU . 33.2 Cg_endo -63.13 -32.28 74.83 Favored 'Trans proline' 0 C--N 1.357 0.977 0 C-N-CA 121.935 1.757 . . . . 10.0 111.959 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.98 -52.88 45.57 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.689 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.413 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 63.6 t80 -59.92 -44.55 94.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.865 0.364 . . . . 10.0 110.633 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.572 ' O ' HD11 ' A' ' 60' ' ' LEU . 36.6 tp -59.44 -54.74 43.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.462 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -69.94 -23.29 63.18 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.876 0.324 . . . . 10.0 111.876 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.48 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -67.28 -26.19 66.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.019 0.438 . . . . 10.0 110.882 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 63.5 mt -60.81 -25.55 66.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.382 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.7 p -70.17 -19.32 63.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.864 0.364 . . . . 10.0 111.089 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 72.45 12.09 76.84 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 121.048 -0.596 . . . . 10.0 112.711 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.1 mmpp? -85.28 -21.99 28.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.688 0.28 . . . . 10.0 111.034 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.39 115.23 3.78 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.554 -0.831 . . . . 10.0 112.962 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.408 HG13 ' CD2' ' A' ' 205' ' ' TYR . 96.4 t -83.78 112.18 20.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 19.0 m170 -86.87 96.43 10.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.799 0.333 . . . . 10.0 110.387 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.5 t -86.1 120.34 35.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.127 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 26.0 t -98.88 113.58 34.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.326 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.36 151.8 21.84 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.99 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.412 ' H ' HG22 ' A' ' 131' ' ' VAL . 0.6 OUTLIER -69.06 -49.15 65.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.353 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -126.96 157.6 39.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.421 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.08 -17.77 63.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.703 -178.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -68.51 -55.44 11.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.837 0.351 . . . . 10.0 110.559 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.68 -31.94 73.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.69 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.05 -44.62 74.9 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.866 -0.607 . . . . 10.0 111.118 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -80.7 -40.45 25.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.792 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -52.55 -61.37 2.32 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.922 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -70.11 -27.3 64.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.259 -0.428 . . . . 10.0 112.073 -178.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.61 -50.49 64.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.949 0.404 . . . . 10.0 110.494 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -71.17 -33.21 69.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.052 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -70.88 -36.69 72.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.569 -0.287 . . . . 10.0 111.658 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -92.69 -3.12 55.4 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.027 -0.269 . . . . 10.0 111.559 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.486 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 63.2 ttm-85 -59.77 -49.16 93.05 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-O 119.293 -0.384 . . . . 10.0 111.877 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' PRO . . . . . 0.559 ' O ' ' HB2' ' A' ' 149' ' ' PHE . 29.2 Cg_exo -63.15 -9.12 16.03 Favored 'Trans proline' 0 C--N 1.361 1.204 0 C-N-CA 122.228 1.952 . . . . 10.0 112.692 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.5 tp -93.09 -52.39 4.59 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.018 0.437 . . . . 10.0 110.245 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -72.24 -45.5 59.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.888 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -67.0 -23.29 65.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.764 0.316 . . . . 10.0 110.971 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.559 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 29.7 t80 -68.29 -26.11 65.48 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.751 -0.463 . . . . 10.0 109.751 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 54.2 mt -94.5 -1.0 54.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.637 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 97.62 1.8 58.83 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.819 -0.705 . . . . 10.0 113.447 178.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 28.8 mt -80.9 140.79 35.12 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.057 0.429 . . . . 10.0 110.794 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.86 123.95 34.26 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.754 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 56.7 t -104.95 119.78 54.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.574 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -115.51 146.87 18.89 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.652 -0.785 . . . . 10.0 112.201 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.5 tp -119.99 127.4 75.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.038 0.447 . . . . 10.0 110.45 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -108.46 105.83 15.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.137 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 161' ' ' MET . 86.1 mt -96.65 146.68 31.73 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.897 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' PRO . . . . . 0.494 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 27.5 Cg_endo -62.37 116.96 3.84 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.856 2.371 . . . . 10.0 112.355 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 96.21 6.19 59.01 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.749 -0.739 . . . . 10.0 112.825 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . 0.449 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.5 OUTLIER -67.97 150.09 97.92 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.539 0.17 . . . . 10.0 110.612 179.679 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -63.52 152.53 79.75 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.628 2.219 . . . . 10.0 112.14 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . 0.527 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.46 -50.92 80.29 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 113.12 0.785 . . . . 10.0 113.12 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.527 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 52.7 Cg_exo -57.03 -44.59 42.92 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 122.029 1.819 . . . . 10.0 112.416 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.12 -41.89 97.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.848 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.44 ' HZ2' ' CG ' ' A' ' 185' ' ' ASP . 54.4 mttm -63.91 -41.38 97.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.955 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' ARG . . . . . 0.43 ' HG2' ' HA ' ' A' ' 199' ' ' VAL . 64.3 mtt180 -58.35 -36.8 74.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.285 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -70.5 -38.79 74.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.962 0.41 . . . . 10.0 110.26 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.02 -44.19 85.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.524 -0.762 . . . . 10.0 111.11 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 41.7 m-85 -73.76 -28.2 61.55 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.307 -0.406 . . . . 10.0 111.036 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -76.27 -10.3 59.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.753 0.311 . . . . 10.0 111.274 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -75.12 174.67 9.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.615 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . 0.48 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 9.4 m-20 -75.44 -38.55 59.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.12 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 66.4 mt -130.84 125.95 59.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.006 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.9 m -115.5 117.21 29.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.917 0.389 . . . . 10.0 111.626 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -96.06 131.21 42.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.998 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -166.43 173.66 41.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.284 -0.96 . . . . 10.0 112.768 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.17 153.54 20.87 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 122.214 0.205 . . . . 10.0 111.074 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -61.48 -36.59 80.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.684 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -63.23 -56.44 16.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.44 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.494 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.5 tp10 -62.81 -37.85 88.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.238 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.67 -34.69 71.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.767 0.318 . . . . 10.0 110.993 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -81.21 -40.3 11.58 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.92 -0.657 . . . . 10.0 111.835 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -64.38 -36.09 83.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.826 0.346 . . . . 10.0 110.75 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 185' ' ' ASP . . . . . 0.44 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 29.8 m-20 -61.42 -40.74 95.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.333 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -61.53 -38.12 86.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.418 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 54.8 mt -67.24 -41.68 85.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.554 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 72.9 mtm-85 -67.61 -41.71 83.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.951 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.39 -23.79 67.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.19 0.519 . . . . 10.0 111.264 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -90.95 1.66 56.86 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.966 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 66.6 mtp -108.88 -7.11 15.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.736 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -62.42 160.52 13.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.621 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -110.8 -14.9 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.281 0.563 . . . . 10.0 109.932 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -129.24 138.15 32.54 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.481 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -58.3 -29.97 89.57 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.639 2.226 . . . . 10.0 112.743 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -70.77 -16.09 62.73 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.662 0.245 . . . . 10.0 111.662 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -76.36 -15.96 59.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.668 -0.242 . . . . 10.0 111.549 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 75.1 mtt180 -57.88 134.82 56.65 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.959 0.409 . . . . 10.0 111.521 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 199' ' ' VAL . . . . . 0.43 ' HA ' ' HG2' ' A' ' 167' ' ' ARG . 20.5 m -108.07 -20.49 6.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.496 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -89.47 -178.61 5.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.209 0.528 . . . . 10.0 111.729 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -137.73 -179.02 5.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.588 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -52.91 133.56 37.8 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.432 0.635 . . . . 10.0 112.351 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 17.3 mt -87.55 61.99 6.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.473 -0.785 . . . . 10.0 110.034 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -80.06 -50.08 10.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.337 0.495 . . . . 10.0 112.337 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 205' ' ' TYR . . . . . 0.408 ' CD2' HG13 ' A' ' 126' ' ' VAL . 33.3 t80 -131.22 138.02 49.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.993 0.425 . . . . 10.0 111.701 -178.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.608 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -134.53 125.28 27.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.697 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 30.5 tp -122.68 108.57 13.23 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.877 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.4 p -96.04 129.87 45.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.207 0.527 . . . . 10.0 110.836 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -58.81 -55.9 29.16 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.377 -0.829 . . . . 10.0 111.981 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 210' ' ' GLU . . . . . 0.468 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 23.0 tt0 -126.27 114.72 18.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.867 0.365 . . . . 10.0 110.924 -179.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.577 HG11 HD12 ' A' ' 99' ' ' ILE . 25.5 m -85.22 -9.56 11.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.792 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 212' ' ' ASP . . . . . 0.424 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 10.0 t70 -52.97 -68.07 0.2 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.363 -0.835 . . . . 10.0 110.99 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 7.8 p -82.4 -50.8 8.49 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.996 -0.547 . . . . 10.0 112.119 -179.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 69.2 mt -55.52 -41.71 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 114.37 1.248 . . . . 10.0 114.37 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 10.8 mt -97.76 -51.95 3.91 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.614 0.968 . . . . 10.0 113.614 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 216' ' ' ILE . . . . . 0.424 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 47.0 mm -70.76 -56.24 11.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 113.387 0.884 . . . . 10.0 113.387 -177.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -74.49 -41.24 61.07 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.87 0.693 . . . . 10.0 112.87 -177.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -91.11 28.21 1.67 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 111.88 0.326 . . . . 10.0 111.88 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -66.78 -52.61 42.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.015 0.436 . . . . 10.0 111.907 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 220' ' ' ARG . . . . . 0.431 ' O ' ' HD3' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -94.74 16.73 15.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.325 -178.419 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 90.1 m -79.82 116.92 64.51 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 120.819 0.342 . . . . 10.0 110.298 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -92.33 141.49 2.29 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.022 2.481 . . . . 10.0 113.065 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 223' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.71 112.95 25.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.528 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 53.3 mt -115.16 124.43 71.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.405 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 6.5 pt . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.974 179.968 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.227 0 CA-C-O 120.65 0.262 . . . . 10.0 111.074 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 374' ' ' SER . . . . . . . . . . . . . 18.9 m -153.82 153.21 31.71 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.42 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.5 tt -146.45 146.22 19.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.754 0.311 . . . . 10.0 110.534 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.71 142.03 28.17 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -56.39 -52.3 65.13 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -56.05 -41.84 75.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.462 . . . . 10.0 110.62 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -69.68 -21.19 63.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.693 -0.685 . . . . 10.0 111.577 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -82.04 -42.71 18.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.857 0.36 . . . . 10.0 110.268 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -70.24 -17.77 63.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.312 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -78.26 -7.48 57.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.835 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 25.5 mt -89.25 -2.86 58.64 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.548 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . 0.608 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 43.9 m-85 -96.48 137.79 35.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.793 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -70.64 -74.04 0.15 Allowed 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.169 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -88.86 98.51 11.77 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.432 HD23 HD21 ' A' ' 407' ' ' LEU . 56.2 tp -109.08 111.48 23.14 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.019 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -124.57 154.78 40.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.987 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -156.02 158.49 28.64 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.21 -0.995 . . . . 10.0 112.573 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 24.5 mtm -115.71 160.88 19.5 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.684 0.278 . . . . 10.0 110.419 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 391' ' ' THR . . . . . 0.576 ' HB ' HG22 ' A' ' 211' ' ' VAL . 6.6 t -164.31 169.79 17.01 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.111 178.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -93.71 166.21 27.58 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.832 -0.907 . . . . 10.0 110.832 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 393' ' ' THR . . . . . 0.466 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 0.2 OUTLIER -60.77 102.55 0.2 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.558 0.218 . . . . 10.0 110.594 179.719 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -141.79 -29.26 0.62 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.546 0.572 . . . . 10.0 112.546 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 38.8 t70 55.76 -119.63 1.41 Allowed 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 110.12 -0.326 . . . . 10.0 110.12 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 396' ' ' THR . . . . . 0.48 ' HB ' ' OE1' ' A' ' 397' ' ' GLU . 2.3 m 51.99 -100.9 0.1 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.97 0.73 . . . . 10.0 112.97 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 397' ' ' GLU . . . . . 0.48 ' OE1' ' HB ' ' A' ' 396' ' ' THR . 3.7 mp0 -76.91 9.8 2.68 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -58.8 -30.5 67.65 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.247 0.462 . . . . 10.0 112.247 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -72.2 -17.0 61.96 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.103 0.409 . . . . 10.0 112.103 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -81.59 -13.43 58.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.657 0.265 . . . . 10.0 111.277 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -61.16 -44.98 96.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.619 -0.264 . . . . 10.0 111.487 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 11.9 m -74.64 -4.44 37.22 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 48.9 m -111.15 -54.89 2.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.037 0.384 . . . . 10.0 112.037 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 49.3 mt -71.31 -47.95 56.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -106.3 -5.77 18.86 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm 60.5 47.5 8.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.37 0.605 . . . . 10.0 110.288 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 407' ' ' LEU . . . . . 0.525 HD13 HD11 ' A' ' 99' ' ' ILE . 42.0 mt -117.04 135.81 53.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.626 -0.715 . . . . 10.0 109.866 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 408' ' ' ASP . . . . . 0.665 ' OD1' ' HD2' ' A' ' 13' ' ' ARG . 1.1 t0 -75.69 175.87 8.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 10.2 m -138.78 125.61 21.0 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.947 -0.47 . . . . 10.0 111.881 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 47.2 t -130.97 137.39 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.851 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.9 t -92.74 134.67 29.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 110.195 -0.298 . . . . 10.0 110.195 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 412' ' ' VAL . . . . . 0.414 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 38.8 t -95.16 127.71 41.53 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.125 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 412' ' ' VAL . 24.6 Cg_exo -64.19 154.26 71.81 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.843 2.362 . . . . 10.0 112.055 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.3 p -84.11 154.42 23.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.196 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -66.85 -36.66 82.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.284 0.564 . . . . 10.0 109.588 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 41.2 mtm180 -129.45 154.19 80.72 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.001 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.48 115.3 2.94 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.429 2.086 . . . . 10.0 111.973 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 51.1 ttp -75.71 105.37 6.71 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.959 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -97.58 62.06 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.212 0.53 . . . . 10.0 110.936 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 36.2 ttp180 -98.42 115.57 28.78 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 47.0 mtpt -82.95 100.84 10.67 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.495 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 422' ' ' ASP . . . . . 0.47 ' HA ' ' OG ' ' A' ' 584' ' ' SER . 8.2 m-20 -89.0 102.35 14.99 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 68.1 mt -82.82 153.31 67.27 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.295 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.49 168.26 6.87 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.12 2.547 . . . . 10.0 113.444 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -88.17 124.31 33.69 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.312 -0.858 . . . . 10.0 110.706 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 58.3 mt -98.49 86.89 3.7 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.5 -0.556 . . . . 10.0 109.5 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 22.6 t -81.18 129.45 37.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.394 -179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 428' ' ' TYR . . . . . 0.505 ' CE2' ' HA ' ' A' ' 614' ' ' PRO . 6.9 m-85 -112.42 -178.17 3.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.358 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 62.9 mtm -80.99 -74.22 0.33 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.909 -0.317 . . . . 10.0 111.166 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 67.8 p -89.5 162.56 15.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.912 0.387 . . . . 10.0 111.415 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 431' ' ' GLU . . . . . 0.41 ' O ' HG12 ' A' ' 435' ' ' ILE . 3.9 tt0 -63.09 -29.8 71.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.175 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -59.43 -46.01 89.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.768 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -61.2 -44.46 97.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.23 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 434' ' ' LYS . . . . . 0.423 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 37.4 ttpt -58.69 -50.3 74.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.544 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 435' ' ' ILE . . . . . 0.46 ' O ' HG12 ' A' ' 439' ' ' ILE . 45.7 mm -61.25 -46.0 97.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.904 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 55.9 tp60 -58.13 -43.5 87.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.876 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.52 86.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.811 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 438' ' ' ILE . . . . . 0.431 HD13 HG22 ' A' ' 559' ' ' THR . 92.0 mt -62.42 -49.64 83.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.051 178.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 439' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 435' ' ' ILE . 45.6 mm -60.24 -38.76 78.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.253 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -61.83 -44.52 96.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.675 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . 0.604 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 14.8 t70 -63.98 -45.15 90.36 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 86.6 mt -58.65 -39.62 76.71 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.692 -0.686 . . . . 10.0 110.964 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -58.29 -40.62 82.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.676 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 444' ' ' GLU . . . . . 0.419 ' O ' ' HE2' ' A' ' 448' ' ' LYS . 63.2 mm-40 -69.18 -40.14 78.28 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.765 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.604 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 17.7 mmt180 -65.66 -45.52 82.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.548 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 7.6 m -63.04 -38.48 91.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.593 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.7 -31.61 72.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.252 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 448' ' ' LYS . . . . . 0.419 ' HE2' ' O ' ' A' ' 444' ' ' GLU . 0.2 OUTLIER -86.86 -23.15 25.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.233 -179.491 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 95.93 29.25 8.71 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.838 -0.696 . . . . 10.0 111.825 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 450' ' ' GLN . . . . . 0.561 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 64.2 tt0 -101.43 130.99 23.61 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 120.451 0.167 . . . . 10.0 111.046 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.96 140.58 50.63 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.676 2.251 . . . . 10.0 111.282 178.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 23.9 t -121.61 133.69 67.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.692 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 60.4 tp -120.68 106.27 11.57 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 22.5 t -95.09 127.77 46.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.752 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -115.5 115.17 3.34 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.958 -0.639 . . . . 10.0 111.911 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 21.8 p -103.72 148.58 25.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.633 0.254 . . . . 10.0 110.839 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' ILE . . . . . 0.426 HG12 ' OE1' ' A' ' 560' ' ' GLU . 21.1 pt -92.36 -4.54 10.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.853 0.358 . . . . 10.0 111.107 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 7.5 m -148.82 146.98 28.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.082 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 47.6 mt -63.09 -36.68 76.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.396 -0.366 . . . . 10.0 111.127 -179.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.86 -37.23 71.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.036 0.446 . . . . 10.0 110.326 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -67.48 -40.03 85.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.04 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.87 -43.75 91.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.481 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -61.99 -43.05 99.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.637 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 40.6 tp -65.13 -50.17 67.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.901 -0.591 . . . . 10.0 111.546 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 9.3 p -64.88 -33.93 66.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 121.048 -0.261 . . . . 10.0 111.393 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 71.1 m -65.44 -38.91 91.27 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 120.84 0.352 . . . . 10.0 110.363 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -63.32 -48.27 78.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.261 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.94 -39.7 95.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.76 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 18.8 mt -63.49 -37.24 86.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.891 0.377 . . . . 10.0 110.432 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 20.7 m -68.92 -39.93 79.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.43 0.633 . . . . 10.0 109.807 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt -64.7 -32.11 73.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.215 -0.902 . . . . 10.0 110.493 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -87.41 -4.61 59.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.293 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 68.31 31.55 74.53 Favored Glycine 0 C--N 1.329 0.169 0 CA-C-N 116.116 -0.493 . . . . 10.0 112.963 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 57.5 mt -101.06 136.68 31.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.731 0.301 . . . . 10.0 110.62 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.483 ' O ' ' HB ' ' A' ' 500' ' ' VAL . 52.8 mttm -61.0 134.63 57.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.135 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' HIS . . . . . 0.405 ' HA ' ' O ' ' A' ' 500' ' ' VAL . 45.5 p-80 -152.84 125.4 8.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.066 0.46 . . . . 10.0 111.289 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -110.13 124.25 51.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.868 -0.606 . . . . 10.0 109.467 178.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 19.1 t -94.16 122.24 45.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.805 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.469 HD12 ' HB2' ' A' ' 503' ' ' ALA . 21.0 mt -79.5 72.83 6.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.429 0.633 . . . . 10.0 110.412 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -68.8 126.03 28.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.473 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -66.95 -18.57 65.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.618 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -72.51 -29.88 63.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.003 0.43 . . . . 10.0 110.567 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -107.71 74.33 0.95 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.955 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -65.71 -32.55 74.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.921 0.391 . . . . 10.0 110.68 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.36 -38.74 90.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.572 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -80.44 -29.88 37.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.098 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.43 ' HG3' HD22 ' A' ' 479' ' ' LEU . 26.4 tt0 -54.49 -47.41 73.07 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.516 -0.766 . . . . 10.0 110.864 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -56.82 -41.45 77.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.288 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -68.64 -41.33 79.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.956 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.2 mt -64.35 -47.82 87.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.911 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 97.4 t -63.58 -36.96 78.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.918 0.389 . . . . 10.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -62.9 -33.95 76.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.672 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -113.0 23.16 13.67 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.972 0.415 . . . . 10.0 111.106 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -73.18 -18.81 61.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.107 0.48 . . . . 10.0 110.928 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -94.38 15.0 64.21 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.867 -0.682 . . . . 10.0 111.744 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' TYR . . . . . 0.402 ' HA ' ' HD3' ' A' ' 497' ' ' PRO . 5.5 t80 -71.27 140.63 85.3 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 110.365 -0.235 . . . . 10.0 110.365 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 496' ' ' TYR . 52.4 Cg_exo -56.54 128.11 28.69 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.398 2.065 . . . . 10.0 112.371 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 64.6 32.94 11.14 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.031 179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -111.52 121.6 45.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.566 -0.288 . . . . 10.0 110.274 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' VAL . . . . . 0.483 ' HB ' ' O ' ' A' ' 475' ' ' LYS . 44.5 t -101.92 117.75 47.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.035 0.445 . . . . 10.0 110.927 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.6 m -109.47 135.88 49.77 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.282 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 25.9 mt -115.99 123.47 71.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.706 0.289 . . . . 10.0 110.548 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . 0.469 ' HB2' HD12 ' A' ' 479' ' ' LEU . . . -122.51 136.89 54.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.777 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 10.3 m -107.48 122.23 46.22 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.702 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 16.7 m120 53.37 68.04 0.9 Allowed 'General case' 0 N--CA 1.465 0.294 0 O-C-N 123.682 0.614 . . . . 10.0 110.743 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.03 135.04 57.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.176 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.9 172.59 12.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.712 -0.677 . . . . 10.0 110.848 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -68.9 167.1 46.17 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 121.009 -0.615 . . . . 10.0 112.422 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.468 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 74.8 mtt180 64.96 -86.71 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.023 0.529 . . . . 10.0 111.179 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.2 133.23 5.68 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.835 -0.697 . . . . 10.0 112.376 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.35 153.88 39.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.714 0.292 . . . . 10.0 111.046 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -76.96 112.98 14.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.806 0.336 . . . . 10.0 110.462 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 82.5 mt -84.56 125.0 40.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.186 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 2.0 t -85.84 125.47 40.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.788 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.4 HD21 ' HB2' ' A' ' 554' ' ' LEU . 72.4 mt -74.99 132.07 41.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.585 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 91.94 -4.31 78.24 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.505 -0.638 . . . . 10.0 111.505 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 113.0 -175.32 16.55 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.608 -0.997 . . . . 10.0 110.608 -179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 1.6 p -123.26 93.83 4.07 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.304 0.552 . . . . 10.0 111.018 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 34.8 p-90 -59.22 -32.99 70.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.009 0.433 . . . . 10.0 110.405 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -66.54 -23.58 66.25 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.32 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -92.96 -33.22 14.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.095 0.474 . . . . 10.0 109.864 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -68.2 -39.83 82.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.748 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . 0.544 HG12 HD12 ' A' ' 537' ' ' ILE . 26.8 m -73.53 -23.1 19.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.973 0.416 . . . . 10.0 110.318 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -81.94 -27.67 33.18 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.716 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -66.26 -27.77 68.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.442 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 25.2 mt -75.98 136.5 40.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.979 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -69.33 -32.21 71.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.987 0.422 . . . . 10.0 110.027 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -134.36 88.11 31.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.312 179.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -84.34 103.01 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.462 2.108 . . . . 10.0 112.06 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 20.8 p -75.83 162.7 27.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.52 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -60.37 -34.42 73.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.937 0.398 . . . . 10.0 110.364 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.38 -47.39 76.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.107 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -64.26 -43.08 95.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.826 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 72.4 mt -59.46 -42.78 88.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.609 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.64 -36.84 68.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.541 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 9.5 tptt -64.18 -50.27 68.78 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.327 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . 0.544 HD12 HG12 ' A' ' 523' ' ' VAL . 81.4 mt -63.6 -36.05 74.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 110.114 -0.328 . . . . 10.0 110.114 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -62.3 -45.79 91.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.064 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -68.32 -40.5 81.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.449 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.56 -45.16 94.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.574 -0.739 . . . . 10.0 109.454 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 50.0 t90 -61.68 -37.63 84.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.842 -1.072 . . . . 10.0 110.877 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 40.2 tp60 -57.39 -44.9 84.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.778 0.323 . . . . 10.0 110.879 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 42.2 t -64.03 -42.74 96.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.083 0.468 . . . . 10.0 110.314 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -68.83 -38.14 79.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.588 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -62.27 -45.21 94.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.963 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.08 -34.22 77.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.271 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -60.22 -39.39 86.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.732 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 99.6 t -69.69 -39.05 77.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.526 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.88 -45.94 90.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.598 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -69.51 -15.52 63.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.503 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 551' ' ' ALA . . . . . 0.561 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -86.02 -25.86 25.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.974 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 123.89 22.75 2.14 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.567 -0.825 . . . . 10.0 112.896 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 71.12 -162.51 54.14 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.007 -0.616 . . . . 10.0 112.636 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.4 ' HB2' HD21 ' A' ' 515' ' ' LEU . 50.7 tp -74.36 126.71 31.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.089 -0.337 . . . . 10.0 110.089 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 555' ' ' HIS . . . . . 0.421 ' HA ' ' O ' ' A' ' 583' ' ' SER . 65.9 t60 -97.86 110.97 23.44 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.328 -179.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 16.7 mm -92.8 132.88 35.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.427 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 26.4 mt -127.5 124.51 63.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.909 0.385 . . . . 10.0 110.239 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -110.13 129.92 9.62 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 111.32 -0.712 . . . . 10.0 111.32 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 559' ' ' THR . . . . . 0.431 HG22 HD13 ' A' ' 438' ' ' ILE . 16.1 p -79.58 -34.31 40.96 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.155 0.502 . . . . 10.0 110.62 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . 0.426 ' OE1' HG12 ' A' ' 457' ' ' ILE . 25.8 mp0 -142.04 160.19 40.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.074 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 561' ' ' ARG . . . . . 0.508 ' HB2' HD22 ' A' ' 594' ' ' LEU . 24.7 mmt180 -98.11 150.35 21.53 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.257 -0.645 . . . . 10.0 109.257 178.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 562' ' ' HIS . . . . . 0.428 ' CE1' HD12 ' A' ' 567' ' ' ILE . 6.3 t-80 -93.91 145.35 24.69 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -62.33 -57.54 10.96 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.2 107.96 6.7 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.064 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 41.8 ttt85 -60.53 -16.96 42.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.952 -0.567 . . . . 10.0 112.275 -178.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -55.85 -41.96 75.1 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 121.236 0.541 . . . . 10.0 110.299 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 567' ' ' ILE . . . . . 0.428 HD12 ' CE1' ' A' ' 562' ' ' HIS . 58.9 mt -84.59 -28.99 6.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.367 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -61.52 -48.08 82.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.415 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -64.13 -36.27 83.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.667 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -70.89 -28.79 64.8 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.196 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.429 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 25.5 tp -66.44 -39.84 89.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.994 0.426 . . . . 10.0 110.467 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 32.5 mtm105 -82.4 -16.03 50.51 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.19 0.519 . . . . 10.0 110.009 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.26 4.2 34.7 Favored Glycine 0 CA--C 1.52 0.355 0 CA-C-N 115.731 -0.668 . . . . 10.0 113.225 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 574' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 2.4 mmt180 -77.08 -24.29 51.85 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 3.8 t -106.97 162.39 13.88 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.915 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 66.67 40.91 94.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.224 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -87.43 143.81 27.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.178 -0.305 . . . . 10.0 110.178 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 578' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 105' ' ' GLY . 60.4 mt-30 64.75 23.56 12.74 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.637 0.586 . . . . 10.0 110.371 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 69.85 45.14 59.22 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.524 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -107.52 -167.27 1.24 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.296 -0.261 . . . . 10.0 110.296 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -88.82 167.82 12.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.22 0.533 . . . . 10.0 111.877 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 168.86 166.06 27.29 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.512 -0.635 . . . . 10.0 111.512 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.421 ' O ' ' HA ' ' A' ' 555' ' ' HIS . 4.8 p -152.51 142.38 22.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.919 0.359 . . . . 10.0 110.52 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 584' ' ' SER . . . . . 0.47 ' OG ' ' HA ' ' A' ' 422' ' ' ASP . 84.6 p -126.61 139.67 53.01 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.07 0.462 . . . . 10.0 110.554 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 4.3 tpm_? -135.83 109.42 7.98 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.909 -0.775 . . . . 10.0 108.909 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -102.34 145.31 29.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.269 0.557 . . . . 10.0 111.671 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 587' ' ' TYR . . . . . 0.423 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 68.6 m-85 -127.5 164.45 21.91 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.193 -0.912 . . . . 10.0 109.39 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 588' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 587' ' ' TYR . 5.5 mt -163.57 166.89 22.01 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.194 -0.299 . . . . 10.0 110.194 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 589' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 428' ' ' TYR . 0.3 OUTLIER -139.01 150.43 45.81 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 178.262 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 590' ' ' MET . . . . . 0.437 ' HA ' ' HG3' ' A' ' 595' ' ' MET . 75.3 mmm -68.47 -8.51 41.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.563 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -93.66 2.12 56.41 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.875 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -80.58 154.46 27.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.849 0.357 . . . . 10.0 110.864 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -68.15 -17.86 64.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.746 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 594' ' ' LEU . . . . . 0.546 ' O ' HG12 ' A' ' 597' ' ' ILE . 9.1 tp -65.61 -24.01 66.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.992 0.425 . . . . 10.0 110.998 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.437 ' HG3' ' HA ' ' A' ' 590' ' ' MET . 13.6 mmt -73.89 1.63 10.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.652 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -96.84 -3.11 42.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.24 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 597' ' ' ILE . . . . . 0.546 HG12 ' O ' ' A' ' 594' ' ' LEU . 24.0 pt -84.9 -3.22 7.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.07 0.462 . . . . 10.0 110.971 -179.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -89.78 1.55 55.99 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.696 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.84 -66.03 0.23 Allowed 'General case' 0 N--CA 1.466 0.35 0 O-C-N 124.001 0.813 . . . . 10.0 111.827 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.7 m -86.74 120.53 28.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.011 0.434 . . . . 10.0 110.918 -179.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.16 -19.39 64.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.656 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -61.26 -34.57 75.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.69 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 49.4 t -65.13 -49.36 79.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.067 0.46 . . . . 10.0 109.885 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.0 -35.63 81.08 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.378 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -64.94 -38.02 94.99 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 116.076 -0.511 . . . . 10.0 112.237 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 37.8 tpp -68.16 -28.36 67.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.905 0.383 . . . . 10.0 110.543 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 58.0 mtt -68.28 -24.61 64.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.809 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 80.1 mtt-85 -69.59 -17.99 63.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.866 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -82.39 9.21 9.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.072 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 4.2 tp -78.79 -11.01 59.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.056 0.455 . . . . 10.0 110.461 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 611' ' ' GLY . . . . . 0.443 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 87.79 -45.64 3.36 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.575 -0.821 . . . . 10.0 111.776 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 612' ' ' MET . . . . . 0.443 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.6 OUTLIER 73.36 -56.8 0.65 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.625 0.77 . . . . 10.0 111.912 179.154 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 18.2 mtpp 61.21 80.79 0.25 Allowed Pre-proline 0 N--CA 1.463 0.204 0 O-C-N 123.523 0.515 . . . . 10.0 111.153 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 614' ' ' PRO . . . . . 0.505 ' HA ' ' CE2' ' A' ' 428' ' ' TYR . 32.5 Cg_exo -58.93 106.86 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.018 2.479 . . . . 10.0 112.451 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 120.0 -22.29 8.61 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.921 -0.657 . . . . 10.0 112.009 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -106.1 116.65 32.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.814 0.34 . . . . 10.0 110.1 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -69.14 102.01 1.57 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.873 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 10.5 tp -71.99 -33.09 46.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.174 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 48.14 86.29 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.428 0.691 . . . . 10.0 112.853 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -120.51 96.75 48.95 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.245 179.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.59 -29.49 85.35 Favored 'Trans proline' 0 N--CA 1.476 0.446 0 C-N-CA 123.49 2.793 . . . . 10.0 114.456 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 56.0 p-90 -63.21 -24.44 67.88 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.638 -0.425 . . . . 10.0 111.374 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 95.9 t -65.71 -48.24 83.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 91.3 m -61.1 -38.86 87.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.463 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -35.22 79.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.27 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -68.7 -45.04 72.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.196 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 77.9 mt -66.28 -41.48 89.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.706 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.03 -41.49 92.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.976 0.417 . . . . 10.0 110.75 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -70.07 -38.77 75.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.125 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . 0.403 ' O ' HG23 ' A' ' 634' ' ' VAL . . . -61.36 -42.09 98.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.943 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -58.93 -42.21 89.22 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.299 0.571 . . . . 10.0 110.022 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -70.48 -34.81 72.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.563 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -59.47 -38.05 79.77 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.786 0.327 . . . . 10.0 110.327 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 634' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 630' ' ' ALA . 95.1 t -57.09 -52.64 53.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.423 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -73.07 -25.7 61.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.353 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 56.9 m -64.19 -38.27 90.44 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -77.44 -34.93 54.45 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.21 -0.663 . . . . 10.0 109.21 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 28.6 t30 -64.67 -40.51 95.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.088 -0.96 . . . . 10.0 110.606 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.09 -37.7 83.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.75 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 640' ' ' ASP . . . . . 0.502 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 3.4 t70 -62.09 -27.6 69.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.084 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 58.0 mt -81.6 -37.24 15.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.408 -0.589 . . . . 10.0 109.408 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 53.9 mtm-85 -62.02 -38.49 88.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.33 179.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 14.6 pttm -65.56 -27.16 68.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.958 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -65.44 -41.7 93.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.159 0.504 . . . . 10.0 109.734 179.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.98 -41.61 77.67 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.043 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 646' ' ' LEU . . . . . 0.409 ' O ' ' HB2' ' A' ' 650' ' ' ASP . 96.1 mt -61.07 -40.7 94.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.696 -0.683 . . . . 10.0 110.939 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -56.46 -36.37 68.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.101 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -83.8 -41.47 17.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.673 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -70.95 -32.09 68.88 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 650' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 653' ' ' ASN . 0.3 OUTLIER -63.59 -32.58 74.09 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.892 0.377 . . . . 10.0 110.731 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 651' ' ' VAL . . . . . 0.474 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 44.8 t -63.53 -44.08 98.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.382 0.61 . . . . 10.0 109.435 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -73.6 -24.42 60.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.412 -0.813 . . . . 10.0 110.34 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 653' ' ' ASN . . . . . 0.411 ' HB3' ' O ' ' A' ' 650' ' ' ASP . 18.1 t30 -61.83 -51.57 67.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.584 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.84 -43.93 97.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.798 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 655' ' ' GLN . . . . . 0.474 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 29.7 mt-30 -61.89 -44.57 96.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.368 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 16.6 ttp-105 -61.79 -42.89 99.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.124 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 45.3 ttp180 -66.39 -43.19 86.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.656 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.7 -47.11 79.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.125 -0.489 . . . . 10.0 112.014 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.8 tp -67.79 -39.84 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 120.935 -0.306 . . . . 10.0 111.389 -179.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -70.55 -31.19 68.14 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.672 -0.411 . . . . 10.0 110.088 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 27.6 t -61.34 -51.0 70.65 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -59.29 -46.52 88.34 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.34 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -60.11 -43.28 95.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.085 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -74.6 -35.19 62.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.756 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -64.57 -43.01 95.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.874 0.369 . . . . 10.0 110.038 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 79.7 mt -76.42 -17.08 59.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.343 0.592 . . . . 10.0 109.98 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 24.4 tp -76.54 -37.44 56.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.247 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -54.38 28.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.584 -0.735 . . . . 10.0 111.288 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 26.8 m -76.39 149.05 6.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.079 -0.509 . . . . 10.0 111.603 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.61 -24.0 16.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.334 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -83.37 108.63 16.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.273 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 672' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 676' ' ' ILE . 7.9 p -113.59 -3.94 11.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.221 0.534 . . . . 10.0 109.863 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -42.16 72.63 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.338 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.85 -46.74 88.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.916 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 675' ' ' THR . . . . . 0.414 ' O ' HG12 ' A' ' 679' ' ' ILE . 3.8 m -64.26 -48.03 77.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.297 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 676' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 672' ' ' VAL . 48.2 mm -57.29 -43.86 82.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.45 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.81 -40.34 75.99 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.045 -0.262 . . . . 10.0 111.372 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 69.6 m -61.43 -44.07 97.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.573 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 679' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 675' ' ' THR . 45.0 pt -77.26 -23.62 14.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 120.839 -0.344 . . . . 10.0 111.285 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 36.2 ttm-85 -60.4 -46.07 91.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.951 0.405 . . . . 10.0 110.61 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -63.84 -37.84 88.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.744 -0.662 . . . . 10.0 111.014 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -70.29 -47.56 60.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.205 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 683' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 679' ' ' ILE . 75.8 t -59.79 -46.81 93.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.969 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -63.44 -42.72 98.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.482 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.4 tttm -60.54 -50.87 71.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.457 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.81 89.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.908 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 95.5 m -62.84 -46.27 88.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.727 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 95.8 mt -66.29 -41.29 88.79 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 116.58 -0.282 . . . . 10.0 110.381 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -56.61 -29.73 62.46 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.677 0.391 . . . . 10.0 111.921 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -72.97 -23.25 60.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 10.0 112.033 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -111.71 -30.41 7.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.894 0.378 . . . . 10.0 111.184 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 692' ' ' ILE . . . . . 0.617 HG23 ' CD1' ' A' ' 701' ' ' TRP . 86.1 mt -127.84 108.03 20.34 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.454 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.14 132.1 20.52 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.352 2.035 . . . . 10.0 111.001 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -52.04 116.21 2.64 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.633 2.222 . . . . 10.0 112.69 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 63.57 74.06 0.43 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.801 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 17.1 p -135.25 -162.2 1.23 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.557 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 88.9 mt -98.41 159.29 15.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.598 -0.273 . . . . 10.0 110.585 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.41 -38.63 71.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.883 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -67.24 -16.19 64.14 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.96 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 43.0 mtt -92.49 -6.1 50.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.983 0.42 . . . . 10.0 110.482 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 701' ' ' TRP . . . . . 0.617 ' CD1' HG23 ' A' ' 692' ' ' ILE . 46.5 m0 -90.75 103.67 16.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.431 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -80.81 77.96 7.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.364 0.602 . . . . 10.0 110.006 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 703' ' ' ILE . . . . . 0.492 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.5 mm -61.65 -48.09 90.86 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.304 -0.862 . . . . 10.0 111.197 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 704' ' ' PRO . . . . . 0.492 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.2 Cg_exo -55.85 -47.27 25.94 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 121.889 1.726 . . . . 10.0 112.134 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -65.03 -43.01 96.41 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.033 -0.603 . . . . 10.0 112.293 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 61.9 tp -61.63 -46.58 89.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.767 0.318 . . . . 10.0 110.466 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -63.64 -40.46 96.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.788 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -56.52 -41.62 77.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.994 0.426 . . . . 10.0 110.862 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 709' ' ' ARG . 1.2 tpt180 -75.77 -47.62 25.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.176 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 66.6 mt -60.67 -45.68 93.23 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 44.8 mttt -75.38 -5.88 47.16 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -178.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -116.6 -57.37 2.19 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.09 0.774 . . . . 10.0 113.09 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -89.29 -16.76 30.39 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.929 0.715 . . . . 10.0 112.929 -177.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -108.48 -7.22 15.83 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.14 -0.624 . . . . 10.0 111.603 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.16 27.28 17.07 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.068 0.461 . . . . 10.0 110.786 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 1.9 mp -108.53 100.76 9.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.486 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -86.26 77.25 9.57 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.013 -0.539 . . . . 10.0 109.712 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.64 131.52 21.72 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.346 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 719' ' ' PRO . . . . . 0.501 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 85.4 Cg_endo -83.75 65.81 7.33 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.152 2.568 . . . . 10.0 112.23 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 720' ' ' ILE . . . . . 0.401 ' HA ' ' CE3' ' A' ' 723' ' ' TRP . 52.6 mt -59.53 -43.77 91.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.689 -179.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -66.45 -27.27 67.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.022 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 722' ' ' GLU . . . . . 0.501 ' HB2' ' HB2' ' A' ' 719' ' ' PRO . 1.0 OUTLIER -98.58 27.58 4.74 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.776 -179.581 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 723' ' ' TRP . . . . . 0.401 ' CE3' ' HA ' ' A' ' 720' ' ' ILE . 4.7 m0 -115.41 -47.44 2.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.636 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 94.8 mt -63.84 -21.1 66.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.089 -0.505 . . . . 10.0 112.081 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -78.4 -17.32 56.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.039 0.447 . . . . 10.0 110.613 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -107.39 -29.9 9.0 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.784 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 727' ' ' GLU . . . . . 0.545 ' O ' ' HB2' ' A' ' 730' ' ' LEU . 33.7 mt-10 -123.65 87.35 52.44 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.53 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -63.75 -30.73 69.23 Favored 'Trans proline' 0 CA--C 1.528 0.195 0 C-N-CA 122.577 2.185 . . . . 10.0 112.218 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -91.11 20.11 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.411 -0.358 . . . . 10.0 111.258 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 730' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 727' ' ' GLU . 0.5 OUTLIER -66.75 -30.09 70.22 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.829 -0.434 . . . . 10.0 109.829 178.938 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 32.4 m170 62.44 -167.71 0.2 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.54 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.84 -45.0 6.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.164 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -61.22 -55.12 35.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.636 -0.257 . . . . 10.0 111.154 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 730' ' ' LEU . 1.3 m -58.27 -32.89 68.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.839 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 37.5 tp -63.56 -42.94 98.31 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 51.7 mtt180 -62.84 -44.85 95.04 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.949 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -62.09 -36.18 80.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.91 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 20.8 mmm-85 -61.08 -50.64 72.45 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.943 -0.391 . . . . 10.0 109.943 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 59.7 mt -60.08 -43.36 92.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.381 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 34.1 tp -63.29 -48.12 79.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.767 -0.651 . . . . 10.0 111.029 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.18 -40.21 95.62 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.869 0.366 . . . . 10.0 111.014 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -39.36 93.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.919 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 743' ' ' SER . . . . . 0.41 ' O ' ' HB2' ' A' ' 747' ' ' TYR . 48.3 p -61.27 -38.3 86.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.76 0.314 . . . . 10.0 110.444 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 58.2 mt -70.2 -41.89 78.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.192 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -60.87 -46.59 90.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.553 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 87.6 t -69.49 -37.27 74.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.433 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 747' ' ' TYR . . . . . 0.41 ' HB2' ' O ' ' A' ' 743' ' ' SER . 20.8 t80 -61.04 -51.95 67.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.341 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 748' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 21.9 mt-30 -63.84 -28.05 69.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.438 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -46.03 79.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.847 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -67.13 -33.6 75.79 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.154 -0.476 . . . . 10.0 109.824 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.44 -25.24 67.87 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.367 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 752' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 85.5 mt-10 -62.15 -24.8 67.39 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.895 0.332 . . . . 10.0 111.895 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 1.7 t -102.59 4.93 10.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.266 0.555 . . . . 10.0 110.611 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 47.8 t -113.64 -49.68 5.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.17 145.82 6.96 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.047 -0.821 . . . . 10.0 111.047 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 756' ' ' ALA . . . . . 0.471 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -59.98 -66.25 0.55 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.056 0.428 . . . . 10.0 111.785 -178.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.48 -27.48 66.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.068 0.461 . . . . 10.0 110.742 -179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.5 tpt -66.56 -46.91 74.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.876 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 759' ' ' MET . . . . . 0.404 ' O ' ' HG3' ' A' ' 763' ' ' GLU . 12.4 tpt -62.39 -38.66 90.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.556 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.9 mmp_? -59.13 -35.11 72.9 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.267 0.556 . . . . 10.0 110.41 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -69.96 -38.41 76.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.581 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -65.51 -44.93 85.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.085 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . 0.446 ' HA ' HD21 ' A' ' 826' ' ' LEU . 84.9 mt-10 -58.95 -49.29 78.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.857 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -59.74 -42.97 94.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.306 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.89 -46.82 92.79 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.946 -0.645 . . . . 10.0 112.011 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.15 -42.09 91.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-O 120.686 0.279 . . . . 10.0 110.637 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 23.7 mtp -59.09 -48.47 81.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.606 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.7 -44.94 92.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.53 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 -59.35 -46.26 89.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.115 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 9.2 m -65.74 -39.94 91.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.974 0.416 . . . . 10.0 110.416 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.2 tt -61.46 -49.88 75.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.942 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -64.29 -30.98 72.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.934 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 7.8 t -64.69 -52.67 55.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.214 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 71.4 mt -72.79 -26.96 61.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.245 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 9.3 t-105 -60.5 -47.01 88.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.621 -0.263 . . . . 10.0 110.835 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -69.96 -31.34 69.02 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.768 -0.373 . . . . 10.0 110.337 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.24 -47.16 74.66 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 38.1 t60 -60.06 -40.46 89.54 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.69 -1.141 . . . . 10.0 110.64 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 19.7 mt -63.46 -46.77 84.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.537 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -65.69 -43.29 89.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.382 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.57 -46.43 89.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.03 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 50.8 mmm -63.1 -41.58 99.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.762 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.21 -46.95 86.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.828 0.347 . . . . 10.0 110.52 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -65.24 -38.81 91.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.03 0.443 . . . . 10.0 110.458 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 15.8 tp -67.4 -38.89 85.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.468 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -57.06 -42.51 80.73 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.63 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 . . . . . 0 C--N 1.326 -0.418 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.388 -179.402 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo . . . . . 0 CA--C 1.529 0.241 0 N-CA-C 113.314 0.467 . . . . 10.0 113.314 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 22.1 mtmm -90.88 -49.6 6.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.947 0.403 . . . . 10.0 110.022 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -65.07 -39.46 93.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.104 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -65.9 -41.97 90.8 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -59.83 -37.03 78.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.479 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -67.01 -25.7 66.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.466 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 44.9 ttp85 -80.16 -47.95 13.92 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -58.1 -43.46 87.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.644 -0.707 . . . . 10.0 111.048 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 3.9 p -66.86 -37.73 85.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.265 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -66.11 -48.44 70.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.555 -0.293 . . . . 10.0 110.416 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 15.0 m -63.11 -34.78 78.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.092 0.472 . . . . 10.0 110.169 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 35.0 ttm -66.78 -36.48 82.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.86 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -70.55 -44.08 68.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.334 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -59.67 -47.07 87.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.385 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.64 81.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.799 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 23.6 ttp -62.78 -36.25 82.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.447 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 95.7 mt -71.88 -30.02 64.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.479 . . . . 10.0 109.876 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 816' ' ' GLU . . . . . 0.475 ' HA ' ' CE ' ' A' ' 819' ' ' LYS . 74.4 mm-40 -69.8 -45.14 68.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.474 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 1.3 p -70.11 -28.73 65.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.615 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 818' ' ' LEU . . . . . 0.41 ' O ' HG23 ' A' ' 822' ' ' VAL . 58.8 tp -56.7 -63.15 1.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.705 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 819' ' ' LYS . . . . . 0.475 ' CE ' ' HA ' ' A' ' 816' ' ' GLU . 31.0 pttt -62.31 -32.8 73.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.797 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -60.91 -59.22 5.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.271 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -66.42 -32.58 74.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.309 -0.405 . . . . 10.0 111.584 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 822' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 818' ' ' LEU . 20.3 t -60.87 -53.25 51.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-O 120.792 0.33 . . . . 10.0 110.211 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 33.7 mm -65.36 -37.46 80.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.42 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 45.5 t -58.44 -57.88 10.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.229 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 22.1 m -59.19 -42.61 91.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.377 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 826' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 763' ' ' GLU . 68.2 mt -65.39 -43.26 91.26 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -178.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 4.9 m -75.03 -26.06 59.2 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.974 0.416 . . . . 10.0 111.059 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -87.06 11.95 12.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.451 0.538 . . . . 10.0 112.451 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.8 p -64.17 128.98 27.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -101.69 115.26 30.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.035 0.445 . . . . 10.0 111.15 -179.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 4.4 m . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.607 179.59 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.703 0.287 . . . . 10.0 110.773 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 109.76 -168.43 13.18 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.117 -0.563 . . . . 10.0 111.94 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.428 ' H ' ' HD2' ' A' ' 16' ' ' ARG . 0.3 OUTLIER -57.0 140.38 49.16 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.942 0.401 . . . . 10.0 110.452 179.472 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.456 ' HD2' ' OD1' ' A' ' 408' ' ' ASP . 16.9 mmt85 -88.98 164.15 15.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.696 -178.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.9 t30 64.84 -88.4 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.167 -0.924 . . . . 10.0 112.652 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -55.52 -60.07 3.94 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.825 0.676 . . . . 10.0 112.825 -177.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.428 ' HD2' ' H ' ' A' ' 12' ' ' SER . 11.7 ttt85 -63.56 -38.13 89.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.668 -0.242 . . . . 10.0 111.437 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -57.85 -51.54 69.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.739 0.304 . . . . 10.0 110.982 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.4 mt -64.72 -35.38 80.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.203 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.7 ttp-105 -66.87 -44.42 80.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.807 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -39.47 90.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.149 0.499 . . . . 10.0 110.133 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.465 ' O ' HG23 ' A' ' 25' ' ' VAL . 55.4 mtt -71.84 -28.28 63.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.644 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -29.96 69.09 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.366 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -71.07 -39.92 71.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.714 -0.675 . . . . 10.0 109.584 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.1 t -65.84 -38.44 82.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.62 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.647 HG13 HD12 ' A' ' 88' ' ' LEU . 98.7 t -58.79 -37.42 66.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.233 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -63.4 -41.34 98.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.431 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.1 mt -62.32 -44.65 99.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.079 0.466 . . . . 10.0 109.885 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' A' ' 65' ' ' PRO . 48.8 mt -62.66 -44.57 99.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.341 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -63.35 -38.77 92.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.787 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.483 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -75.01 -26.06 59.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.477 -0.328 . . . . 10.0 111.531 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 15.9 ttt -84.25 -12.55 54.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.066 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.504 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 7.1 tt0 -57.2 -51.96 77.74 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 116.371 -0.377 . . . . 10.0 111.34 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.504 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 61.1 Cg_exo -54.11 -30.64 61.34 Favored 'Trans proline' 0 C--N 1.363 1.296 0 C-N-CA 122.207 1.938 . . . . 10.0 112.429 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -70.13 -44.24 69.33 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 23.3 mmt -66.92 -31.07 71.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.749 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -63.06 -20.36 65.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.902 0.382 . . . . 10.0 111.0 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.6 mtmt -96.42 1.55 51.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.566 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 mp -100.14 148.85 24.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.095 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.4 p -81.66 166.81 19.82 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -58.58 -38.74 78.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.965 0.412 . . . . 10.0 110.999 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -68.89 -33.14 73.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.977 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -68.55 -35.65 77.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.836 0.35 . . . . 10.0 110.144 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.3 mt -66.58 -46.97 74.24 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -60.64 -33.75 73.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.338 -0.846 . . . . 10.0 110.305 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.64 -33.25 86.72 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 115.538 -0.755 . . . . 10.0 111.873 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -69.09 -36.87 78.06 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.5 m -60.07 -46.25 90.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.946 0.403 . . . . 10.0 110.221 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.37 -34.93 79.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.932 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -62.26 -45.04 95.09 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.995 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -60.36 -42.57 96.03 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.102 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -58.35 -38.23 76.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.872 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.89 -40.38 32.52 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.967 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -60.51 -40.49 91.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.571 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 32.2 mt -63.94 -20.9 66.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.707 0.289 . . . . 10.0 111.62 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -106.34 9.85 31.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.07 0.462 . . . . 10.0 110.857 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -117.52 -50.29 2.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.365 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 168.57 64.51 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.602 -0.809 . . . . 10.0 112.309 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -144.35 149.42 36.12 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.42 ' HB ' ' HB2' ' A' ' 62' ' ' ASN . 4.7 t -97.3 142.53 14.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.52 -179.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 39.1 tp -61.3 -47.14 87.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.945 0.403 . . . . 10.0 111.238 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -73.82 1.35 10.74 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.265 -0.425 . . . . 10.0 111.45 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.42 ' HB2' ' HB ' ' A' ' 59' ' ' VAL . 65.6 t30 -105.54 -11.05 16.54 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.311 0.577 . . . . 10.0 109.839 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.6 mt -93.56 -4.64 50.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.798 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.454 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 73.9 mt -49.58 -56.64 15.53 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 115.806 -0.634 . . . . 10.0 112.62 -179.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 64' ' ' ILE . 11.3 Cg_endo -54.32 -47.28 27.78 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.34 2.027 . . . . 10.0 113.474 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -71.44 -42.96 67.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.84 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.422 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -65.64 -48.25 72.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.898 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -63.72 -31.55 72.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.512 -0.313 . . . . 10.0 111.11 -179.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.45 -44.73 93.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.832 0.348 . . . . 10.0 110.288 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 81.9 t -62.82 -43.93 99.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.442 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 67' ' ' ALA . 40.4 t -64.06 -44.34 97.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.835 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.497 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 1.1 ttm180 -59.01 -39.73 82.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.843 0.354 . . . . 10.0 110.212 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.8 tp10 -68.45 -49.81 57.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.664 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.28 -30.75 69.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.654 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.6 m -57.79 -40.6 80.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.505 -0.316 . . . . 10.0 111.392 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.0 mtmt -77.65 -17.86 57.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.699 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -95.65 -29.92 14.05 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.938 0.348 . . . . 10.0 111.938 -178.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 64.9 t -94.31 -55.51 6.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.618 0.246 . . . . 10.0 111.458 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -90.95 -40.84 11.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.88 0.371 . . . . 10.0 111.039 -179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.45 9.94 34.71 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.681 -0.771 . . . . 10.0 111.94 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.1 mtt -122.83 151.72 41.41 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.459 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 11.7 ttp180 -98.79 138.48 35.88 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.979 0.418 . . . . 10.0 111.192 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.02 110.89 4.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.584 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -56.9 156.88 6.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.299 0.571 . . . . 10.0 112.003 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.38 -38.17 79.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.229 -0.896 . . . . 10.0 111.182 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.77 -31.64 51.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.839 0.352 . . . . 10.0 111.082 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -67.08 -34.04 76.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.647 HD12 HG13 ' A' ' 25' ' ' VAL . 80.9 mt -65.82 -36.16 82.69 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.415 ' O ' HG23 ' A' ' 93' ' ' VAL . 62.6 mt -66.46 -49.62 66.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.705 178.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.449 ' O ' ' HG ' ' A' ' 94' ' ' LEU . . . -60.12 -43.85 97.91 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.842 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.26 -32.75 85.22 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.03 -0.605 . . . . 10.0 112.096 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 8.7 ttm -69.2 -42.11 76.21 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.901 -0.407 . . . . 10.0 109.901 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 89' ' ' LEU . 85.2 t -65.9 -36.42 77.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.656 -0.702 . . . . 10.0 110.071 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 90' ' ' GLY . 79.9 mt -68.14 -8.83 41.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.734 -0.666 . . . . 10.0 111.993 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -81.36 -20.68 40.09 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.499 0.666 . . . . 10.0 109.236 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -102.18 174.56 5.87 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.315 -0.857 . . . . 10.0 110.236 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -83.63 67.88 9.62 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.308 0.575 . . . . 10.0 109.564 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 16.4 m -141.01 161.77 37.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.4 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.651 HD11 HD13 ' A' ' 407' ' ' LEU . 44.0 mm -103.17 131.0 52.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.734 179.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -110.06 122.97 48.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.891 0.377 . . . . 10.0 111.793 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.62 ' CD ' ' HA ' ' A' ' 393' ' ' THR . 42.5 tt0 -94.72 130.08 41.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.134 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 41.6 mtm -145.34 176.94 9.19 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.707 0.289 . . . . 10.0 110.78 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.496 ' HB2' ' HG2' ' A' ' 106' ' ' GLU . 16.9 mmm180 -105.76 175.77 5.39 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.808 -0.442 . . . . 10.0 109.808 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 18.9 p -77.2 -36.65 54.69 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.757 0.313 . . . . 10.0 111.821 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -72.55 -9.4 73.81 Favored Glycine 0 N--CA 1.453 -0.23 0 CA-C-N 116.08 -0.509 . . . . 10.0 113.888 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.496 ' HG2' ' HB2' ' A' ' 103' ' ' ARG . 3.2 mm-40 -90.86 -1.29 57.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.226 0.513 . . . . 10.0 110.6 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.94 62.16 4.44 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.381 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -52.94 -45.54 67.74 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 111.884 0.327 . . . . 10.0 111.884 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -33.97 76.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.707 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 25.5 tp -70.46 -28.98 65.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.936 0.398 . . . . 10.0 110.494 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 64.8 m -70.81 -30.24 66.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.327 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.17 -15.94 63.56 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.3 0.852 . . . . 10.0 113.3 -178.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 41.1 p -72.41 -25.4 61.47 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.403 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 31.1 mt -68.18 -57.26 9.37 Favored Pre-proline 0 CA--C 1.537 0.478 0 N-CA-C 112.411 0.523 . . . . 10.0 112.411 -178.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.403 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 30.1 Cg_endo -62.38 -31.42 81.27 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 121.994 1.796 . . . . 10.0 111.85 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.67 -49.48 68.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.431 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.471 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 59.1 t80 -62.5 -45.74 91.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.961 0.41 . . . . 10.0 110.66 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 62.8 tp -59.77 -49.36 78.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.668 -0.697 . . . . 10.0 111.616 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 14.0 m-80 -72.41 -26.43 61.86 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.433 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -66.13 -26.08 67.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.7 0.286 . . . . 10.0 111.137 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 60.7 mt -60.71 -21.25 62.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.75 -179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.7 p -79.92 -17.31 53.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.704 0.288 . . . . 10.0 111.027 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.53 6.83 59.59 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.099 -0.572 . . . . 10.0 112.802 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.92 -24.08 44.31 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.857 -0.202 . . . . 10.0 111.326 -179.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 109.21 123.85 4.81 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.342 -0.932 . . . . 10.0 113.546 179.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 68.9 t -102.15 119.05 49.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -99.73 107.13 19.13 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.894 0.378 . . . . 10.0 110.806 -179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 64.0 t -96.27 122.03 47.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.242 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 26.5 t -102.02 110.0 27.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.527 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.52 162.31 13.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.528 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.429 ' HA ' HD11 ' A' ' 214' ' ' ILE . 4.4 m -67.23 -40.42 84.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 111.876 0.324 . . . . 10.0 111.876 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -145.41 161.07 40.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.359 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -64.68 -24.61 67.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.892 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -59.18 -55.85 29.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.474 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 89.8 mt -73.68 -31.49 63.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.512 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.85 -52.0 67.28 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.696 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -33.8 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.417 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -59.17 -57.15 14.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.488 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.32 -29.65 67.53 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.518 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.533 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -60.24 -41.64 93.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.811 0.339 . . . . 10.0 110.69 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -89.16 -25.33 21.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.337 -0.392 . . . . 10.0 111.329 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -75.56 -43.28 49.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.79 0.329 . . . . 10.0 111.466 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.7 m-20 -90.35 -1.92 57.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.936 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.533 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 59.2 ttm-85 -60.44 -48.83 92.68 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 116.102 -0.499 . . . . 10.0 112.084 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' PRO . . . . . 0.59 ' O ' ' HB2' ' A' ' 149' ' ' PHE . 34.1 Cg_exo -61.86 -12.69 26.82 Favored 'Trans proline' 0 C--N 1.359 1.092 0 C-N-CA 122.083 1.855 . . . . 10.0 112.946 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.3 tp -88.52 -53.96 4.41 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.982 0.42 . . . . 10.0 110.322 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -70.89 -42.79 69.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.868 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.43 -10.13 59.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.803 0.335 . . . . 10.0 111.54 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.59 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 19.1 t80 -83.97 -26.01 29.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.365 0.603 . . . . 10.0 109.714 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 37.4 mt -95.47 -8.19 36.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.434 -0.803 . . . . 10.0 110.805 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 106.28 15.31 18.02 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.619 -0.8 . . . . 10.0 113.634 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 90.0 mt -101.84 136.76 41.12 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.15 0.475 . . . . 10.0 109.903 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.8 p -90.6 130.18 36.66 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.062 0.458 . . . . 10.0 111.298 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.447 HG21 ' HA ' ' A' ' 144' ' ' ARG . 61.4 t -102.46 120.06 51.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.379 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -111.54 139.63 15.68 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.746 -0.74 . . . . 10.0 111.701 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.2 tp -117.28 130.21 72.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.833 0.349 . . . . 10.0 110.125 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -115.26 129.75 56.72 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.11 -0.495 . . . . 10.0 109.913 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 66.0 mt -121.61 147.8 48.83 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.362 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' PRO . . . . . 0.526 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 17.9 Cg_endo -59.92 102.11 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.212 2.608 . . . . 10.0 112.658 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 110.72 4.03 28.33 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.695 -0.764 . . . . 10.0 112.611 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . 0.481 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 48.1 ttm -64.33 138.97 97.6 Favored Pre-proline 0 C--N 1.327 -0.394 0 C-N-CA 122.254 0.222 . . . . 10.0 110.696 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -52.06 144.32 37.75 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.801 2.334 . . . . 10.0 112.601 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . 0.454 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.77 -48.34 93.79 Favored Pre-proline 0 CA--C 1.54 0.586 0 N-CA-C 113.054 0.761 . . . . 10.0 113.054 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.8 Cg_exo -55.51 -41.57 76.58 Favored 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 121.935 1.757 . . . . 10.0 112.39 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -69.16 -39.89 78.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.642 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.481 ' HE2' ' O ' ' A' ' 161' ' ' MET . 58.7 mttm -58.78 -45.12 90.56 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.33 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -59.94 -29.26 68.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.625 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -78.8 -43.63 24.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.919 0.39 . . . . 10.0 110.288 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.7 -38.47 91.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.377 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -78.11 -26.63 48.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.307 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.22 -11.29 59.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.178 0.513 . . . . 10.0 110.424 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -70.84 177.94 3.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.591 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . 0.433 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 19.1 m-20 -76.18 -46.31 29.08 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.597 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 49.2 mt -127.49 125.95 66.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.207 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.9 m -111.46 126.87 55.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.408 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -103.33 137.17 41.82 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -179.19 177.19 48.31 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.368 -0.92 . . . . 10.0 112.727 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -93.7 158.86 15.47 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.713 0.292 . . . . 10.0 110.835 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -68.37 -32.65 72.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.816 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -59.68 -53.93 52.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.123 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.526 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.9 tp10 -68.13 -35.6 78.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.768 0.318 . . . . 10.0 110.661 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -54.85 -42.93 72.59 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.286 -0.416 . . . . 10.0 111.005 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -72.84 -41.0 50.95 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.844 -0.694 . . . . 10.0 112.147 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -64.94 -37.39 87.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 10.0 110.464 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 185' ' ' ASP . . . . . 0.457 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 15.1 m-20 -62.3 -41.76 98.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.021 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -62.13 -41.84 98.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.666 -0.697 . . . . 10.0 110.051 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 187' ' ' LEU . . . . . 0.469 ' O ' ' HB2' ' A' ' 191' ' ' MET . 67.8 mt -62.35 -45.19 94.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.828 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 58.3 mtm-85 -67.91 -38.94 83.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.888 0.375 . . . . 10.0 110.885 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -62.82 -50.95 68.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.76 -0.655 . . . . 10.0 111.618 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.22 1.66 20.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.569 0.581 . . . . 10.0 112.569 -178.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 191' ' ' MET . . . . . 0.469 ' HB2' ' O ' ' A' ' 187' ' ' LEU . 23.1 ttp -106.52 2.84 26.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.048 0.451 . . . . 10.0 110.568 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 197' ' ' GLU . . . -73.3 167.67 20.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.199 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -105.56 -29.77 9.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.126 0.488 . . . . 10.0 110.004 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.12 144.88 35.7 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.813 179.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.77 -24.87 74.66 Favored 'Trans proline' 0 CA--C 1.527 0.163 0 C-N-CA 122.364 2.042 . . . . 10.0 112.629 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 45.1 mp0 -75.29 -10.44 59.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.361 -0.381 . . . . 10.0 111.384 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.465 ' HB2' ' HB1' ' A' ' 192' ' ' ALA . 46.1 mt-10 -89.03 -3.27 58.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.778 0.323 . . . . 10.0 110.544 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 198' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 198' ' ' ARG . 30.5 mtt85 -61.42 158.67 14.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.569 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 4.8 m -136.32 -18.41 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.756 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -88.81 177.87 6.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.15 0.5 . . . . 10.0 111.085 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -137.44 176.6 8.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.462 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.7 tmtm? -60.01 126.95 29.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.277 0.56 . . . . 10.0 111.143 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . 0.411 HD22 ' CZ ' ' A' ' 384' ' ' TYR . 14.2 mt -80.47 91.08 5.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.528 -0.76 . . . . 10.0 109.691 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 29.9 t-80 -99.91 -63.28 1.14 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.295 -0.412 . . . . 10.0 111.082 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -128.54 138.06 52.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.139 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.497 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -133.37 129.55 37.58 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.476 -0.783 . . . . 10.0 109.659 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 45.7 tp -119.53 110.53 17.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.167 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 2.4 p -92.43 126.22 44.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.521 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -58.26 -65.58 0.62 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.617 -0.72 . . . . 10.0 111.269 -179.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 210' ' ' GLU . . . . . 0.474 ' CD ' HH21 ' A' ' 509' ' ' ARG . 0.5 OUTLIER -112.64 113.91 26.28 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.923 0.392 . . . . 10.0 110.745 -179.83 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.649 HG11 HD12 ' A' ' 99' ' ' ILE . 27.6 m -76.56 -14.13 14.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.041 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 212' ' ' ASP . . . . . 0.535 ' OD2' ' HD3' ' A' ' 566' ' ' ARG . 1.1 m-20 -45.91 -78.17 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 124.061 0.851 . . . . 10.0 112.247 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.34 -47.09 9.68 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.455 -0.793 . . . . 10.0 112.17 -178.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 214' ' ' ILE . . . . . 0.433 ' HA ' ' HG3' ' A' ' 218' ' ' GLU . 53.2 mt -53.25 -31.89 18.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 N-CA-C 113.876 1.065 . . . . 10.0 113.876 -177.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 215' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 215' ' ' LEU . 10.6 mt -106.26 -58.46 1.92 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 39.1 mm -68.22 -54.46 21.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 113.207 0.817 . . . . 10.0 113.207 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -73.27 -45.04 58.11 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.798 0.666 . . . . 10.0 112.798 -177.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 218' ' ' GLU . . . . . 0.433 ' HG3' ' HA ' ' A' ' 214' ' ' ILE . 5.2 mm-40 -73.45 1.7 9.25 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.36 0.504 . . . . 10.0 112.36 -178.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.47 -25.37 68.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.689 0.281 . . . . 10.0 111.73 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 220' ' ' ARG . . . . . 0.478 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -114.31 19.38 16.33 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.069 -0.253 . . . . 10.0 111.306 -179.241 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 5.6 m -97.45 106.28 31.48 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 120.951 -0.3 . . . . 10.0 110.605 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 222' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 81.7 Cg_endo -92.84 131.46 0.93 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.925 2.417 . . . . 10.0 113.202 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 223' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 374' ' ' SER . 47.6 mt -85.56 124.02 31.64 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 83.3 mt -117.68 130.67 72.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.787 0.327 . . . . 10.0 111.663 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 20.8 pt . . . . . 0 C--N 1.329 -0.285 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 178.452 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 109.732 -0.47 . . . . 10.0 109.732 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 374' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 4.2 t -153.33 152.92 31.66 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.763 0.316 . . . . 10.0 110.519 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 14.4 tt -156.9 140.51 7.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.47 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.91 147.77 22.56 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.424 178.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -59.44 -37.97 79.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.478 0.18 . . . . 10.0 111.301 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 378' ' ' GLN . . . . . 0.486 HE21 HG23 ' A' ' 404' ' ' ILE . 1.5 tm0? -59.84 -39.04 83.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.305 0.574 . . . . 10.0 110.12 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -82.96 -2.49 55.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.344 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -101.12 -46.13 5.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.278 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -70.31 -20.66 62.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.169 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 42.8 mtp180 -76.54 -9.05 58.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.805 0.336 . . . . 10.0 111.031 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 80.3 mt -83.25 -19.56 36.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.016 0.436 . . . . 10.0 110.001 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . 0.497 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 49.1 m-85 -77.39 141.45 39.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.304 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -71.17 -67.61 0.5 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.154 0.502 . . . . 10.0 110.235 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -100.75 102.32 13.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.169 0.509 . . . . 10.0 110.039 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 50.1 tp -111.05 115.72 29.93 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.879 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -121.3 158.21 28.68 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.104 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -154.52 158.28 28.13 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.198 -1.001 . . . . 10.0 112.61 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 39.6 mtm -115.47 154.79 28.66 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 391' ' ' THR . . . . . 0.465 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 14.7 t -149.94 159.52 44.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.533 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -88.49 157.83 28.13 Favored Glycine 0 N--CA 1.441 -1.016 0 N-CA-C 109.99 -1.244 . . . . 10.0 109.99 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 393' ' ' THR . . . . . 0.62 ' HA ' ' CD ' ' A' ' 101' ' ' GLU . 9.5 m -56.69 99.99 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.11 0.455 . . . . 10.0 111.218 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . 0.519 ' HA ' HD22 ' A' ' 569' ' ' ASN . . . -160.11 -27.96 0.06 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.816 -0.629 . . . . 10.0 112.037 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 6.7 t70 59.26 -95.27 0.05 Allowed 'General case' 0 N--CA 1.474 0.729 0 O-C-N 123.326 0.391 . . . . 10.0 110.499 -179.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 5.7 m 55.97 -105.6 0.28 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.045 0.757 . . . . 10.0 113.045 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -84.24 25.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.118 0.414 . . . . 10.0 112.118 -177.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 398' ' ' ALA . . . . . 0.523 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -67.69 -31.02 70.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.9 0.381 . . . . 10.0 110.858 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -65.99 -18.61 65.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.587 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -83.41 -19.67 35.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.682 -0.235 . . . . 10.0 111.235 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 401' ' ' PHE . . . . . 0.523 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 17.5 m-85 -60.56 -42.02 95.74 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.909 0.337 . . . . 10.0 111.909 -179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 6.8 m -70.39 -19.87 62.98 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.423 0.527 . . . . 10.0 112.423 -178.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 26.7 m -98.82 -43.68 6.67 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.998 0.37 . . . . 10.0 111.998 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . 0.486 HG23 HE21 ' A' ' 378' ' ' GLN . 60.4 mt -77.87 -62.01 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 112.843 0.683 . . . . 10.0 112.843 -178.083 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 405' ' ' TYR . . . . . 0.434 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 81.9 m-85 -97.36 -2.7 41.83 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -177.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt 62.73 48.1 4.37 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.161 0.505 . . . . 10.0 110.427 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 407' ' ' LEU . . . . . 0.651 HD13 HD11 ' A' ' 99' ' ' ILE . 16.2 mt -113.2 142.08 46.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.028 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 408' ' ' ASP . . . . . 0.456 ' OD1' ' HD2' ' A' ' 13' ' ' ARG . 9.5 t0 -80.79 166.09 21.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.599 0.238 . . . . 10.0 110.602 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 2.0 m -118.42 109.18 15.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.717 0.294 . . . . 10.0 110.953 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 42.1 t -121.6 115.91 47.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.966 0.412 . . . . 10.0 110.918 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 53.3 t -83.99 108.67 16.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.017 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 58.6 t -79.15 130.47 69.28 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.927 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.21 146.46 81.43 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.49 2.127 . . . . 10.0 111.507 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 74.3 p -89.14 149.34 23.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.809 0.337 . . . . 10.0 111.136 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -83.65 -28.16 28.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 178.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -97.87 128.26 34.57 Favored Pre-proline 0 N--CA 1.448 -0.573 0 CA-C-N 114.765 -1.107 . . . . 10.0 109.13 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.36 124.91 12.19 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.62 2.213 . . . . 10.0 113.451 -178.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 48.9 mtm -90.26 82.1 6.03 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.527 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 419' ' ' ILE . . . . . 0.444 HG13 ' HA ' ' A' ' 581' ' ' ALA . 5.9 pt -92.31 42.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.118 -179.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 420' ' ' ARG . . . . . 0.558 ' HA ' ' O ' ' A' ' 581' ' ' ALA . 38.5 ttp180 -73.83 137.46 43.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.413 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 583' ' ' SER . 83.0 mttt -93.38 95.65 9.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.248 0.547 . . . . 10.0 110.398 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -80.26 125.33 29.74 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.51 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 89.9 mt -109.43 152.08 42.5 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.259 -0.428 . . . . 10.0 109.951 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.77 160.14 42.1 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.586 2.19 . . . . 10.0 112.895 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -81.72 119.6 24.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.568 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 426' ' ' LEU . 12.6 mt -99.87 102.75 14.25 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.241 0.543 . . . . 10.0 110.661 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 427' ' ' VAL . . . . . 0.534 HG23 HG11 ' A' ' 623' ' ' VAL . 6.0 t -94.65 125.49 47.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.817 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 428' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' A' ' 590' ' ' MET . 2.7 m-85 -104.29 179.86 4.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.636 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 28.4 mmm -73.54 -76.78 0.12 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.682 0.277 . . . . 10.0 111.383 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 64.4 p -88.26 159.75 17.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.971 0.415 . . . . 10.0 111.389 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.79 -31.5 70.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.624 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -61.63 -38.05 86.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.93 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 433' ' ' GLU . . . . . 0.443 ' HG2' ' HG3' ' A' ' 614' ' ' PRO . 31.8 mt-10 -65.58 -39.42 91.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.039 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -59.53 -48.5 81.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.948 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 435' ' ' ILE . . . . . 0.529 ' O ' HG12 ' A' ' 439' ' ' ILE . 41.1 mm -61.81 -43.38 97.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.458 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -56.67 -44.7 81.66 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.709 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.36 -38.91 91.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.732 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 438' ' ' ILE . . . . . 0.441 ' O ' HG13 ' A' ' 442' ' ' ILE . 92.4 mt -62.47 -49.91 81.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.658 179.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 439' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 435' ' ' ILE . 47.9 mm -58.45 -43.25 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.268 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -63.13 -44.81 94.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.717 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . 0.612 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 14.1 t70 -63.56 -44.88 92.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.775 0.321 . . . . 10.0 110.326 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.487 HG12 HG11 ' A' ' 452' ' ' VAL . 54.8 mt -59.9 -42.17 88.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.378 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -57.3 -42.8 82.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.5 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -41.71 98.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.408 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.612 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 15.7 mmt180 -68.25 -39.63 82.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.485 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 13.3 m -62.94 -37.15 85.88 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.773 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.12 71.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.035 -0.529 . . . . 10.0 111.363 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 47.7 mttp -85.48 -19.4 31.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.215 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 89.41 33.55 9.29 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.67 -0.776 . . . . 10.0 111.321 -178.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 450' ' ' GLN . . . . . 0.54 ' OE1' ' HD2' ' A' ' 445' ' ' ARG . 60.2 tt0 -105.37 129.58 24.51 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 120.432 0.158 . . . . 10.0 110.836 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.28 141.71 63.66 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.683 2.255 . . . . 10.0 111.462 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 452' ' ' VAL . . . . . 0.487 HG11 HG12 ' A' ' 442' ' ' ILE . 51.7 t -121.94 128.11 75.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.396 -178.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 57.1 tp -115.07 109.1 17.55 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 18.9 t -95.93 127.93 47.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.358 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -110.26 109.86 2.74 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.887 -0.673 . . . . 10.0 112.391 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' THR . . . . . 0.402 ' HG1' ' HA ' ' A' ' 504' ' ' THR . 15.9 p -105.06 146.84 28.56 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.397 -0.223 . . . . 10.0 110.397 179.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 24.3 pt -94.13 -17.66 7.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.829 0.347 . . . . 10.0 111.294 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 23.2 m -130.75 137.85 49.68 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.339 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 39.4 mt -60.4 -32.24 50.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.091 0.472 . . . . 10.0 110.886 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.67 -33.74 71.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.712 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 -33.8 47.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.512 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.3 m -61.33 -43.74 98.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.545 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -68.62 -36.79 79.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.16 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.48 -53.71 50.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.81 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 10.2 p -65.04 -32.7 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 120.775 0.321 . . . . 10.0 110.322 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 47.0 t -65.0 -43.49 92.37 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.464 -0.569 . . . . 10.0 109.464 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -60.4 -49.38 77.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.661 -0.699 . . . . 10.0 110.294 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . 0.51 ' HG3' HG21 ' A' ' 435' ' ' ILE . 10.7 mm-40 -62.16 -38.89 90.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.706 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 24.0 mt -63.16 -38.15 90.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.078 0.466 . . . . 10.0 110.279 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.1 m -72.09 -34.38 68.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.762 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -63.57 -36.91 85.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.437 -0.801 . . . . 10.0 110.004 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -79.45 -30.78 42.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.743 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 97.91 34.31 5.49 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.955 -0.641 . . . . 10.0 112.281 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 70.6 mt -102.71 127.98 55.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.641 0.258 . . . . 10.0 110.849 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -63.63 129.31 39.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.141 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -155.38 153.74 30.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.832 0.349 . . . . 10.0 111.195 -179.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -130.48 132.87 45.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.033 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . 0.456 HG22 HD12 ' A' ' 502' ' ' ILE . 19.2 t -100.03 130.0 49.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.356 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 36.6 mt -75.76 94.17 3.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.856 0.36 . . . . 10.0 110.574 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -78.66 108.13 11.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.636 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -65.2 -7.69 13.98 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.888 0.699 . . . . 10.0 112.888 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -88.05 -11.44 47.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.988 0.423 . . . . 10.0 110.254 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -126.66 90.95 3.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.036 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -60.72 -30.67 70.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.3 -179.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.97 -37.25 87.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.069 0.461 . . . . 10.0 109.939 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.66 -38.71 64.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.431 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -52.32 -60.91 2.65 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.692 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -59.63 -36.67 76.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.243 -0.89 . . . . 10.0 111.953 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.41 86.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.876 0.37 . . . . 10.0 111.529 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 83.1 mt -70.91 -45.99 70.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.241 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 71.6 t -58.88 -35.26 55.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 120.836 0.351 . . . . 10.0 111.305 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -59.29 -33.21 70.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.998 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -121.11 24.37 10.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.642 0.258 . . . . 10.0 111.165 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.77 -19.38 62.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.042 0.449 . . . . 10.0 111.198 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -97.88 14.44 62.81 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.858 -0.687 . . . . 10.0 112.023 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -73.4 143.04 82.23 Favored Pre-proline 0 C--N 1.327 -0.407 0 N-CA-C 110.07 -0.345 . . . . 10.0 110.07 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.98 123.8 14.01 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.591 2.194 . . . . 10.0 113.167 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.8 17.65 7.59 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -91.8 113.71 26.05 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.017 0.437 . . . . 10.0 110.315 179.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 33.0 t -92.3 112.05 25.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.598 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 12.0 m -108.35 131.62 54.56 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.526 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 502' ' ' ILE . . . . . 0.456 HD12 HG22 ' A' ' 478' ' ' VAL . 55.5 mt -109.84 117.6 55.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 120.827 0.346 . . . . 10.0 110.311 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -111.95 122.84 48.89 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.811 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 504' ' ' THR . . . . . 0.402 ' HA ' ' HG1' ' A' ' 456' ' ' THR . 8.8 m -103.28 124.15 48.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.19 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 52.88 68.71 0.79 Allowed 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.864 0.728 . . . . 10.0 110.763 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.0 132.87 36.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.838 -179.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.57 177.02 7.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.066 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -67.09 163.19 45.45 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.125 -0.56 . . . . 10.0 112.486 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.474 HH21 ' CD ' ' A' ' 210' ' ' GLU . 98.5 mtt180 64.83 -92.98 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 122.849 0.46 . . . . 10.0 111.016 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 86.43 141.16 6.22 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.941 -0.647 . . . . 10.0 112.252 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.84 137.06 58.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.762 0.315 . . . . 10.0 110.835 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.17 116.48 8.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.641 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 59.2 mt -80.32 123.12 36.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.557 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 3.4 t -83.31 133.51 28.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.601 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 52.0 mt -70.8 130.49 41.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.566 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 84.65 10.15 79.91 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.103 -0.799 . . . . 10.0 111.103 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 93.55 -175.15 35.57 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 110.432 -1.067 . . . . 10.0 110.432 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 13.0 p -124.68 111.44 15.58 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 117.517 0.659 . . . . 10.0 110.539 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 519' ' ' TRP . . . . . 0.411 ' O ' HG22 ' A' ' 523' ' ' VAL . 41.7 p-90 -61.51 -20.2 62.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.049 0.452 . . . . 10.0 110.096 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -59.63 -40.95 89.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.421 -0.809 . . . . 10.0 110.277 178.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -74.63 -32.44 62.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.755 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -70.43 -45.19 66.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.91 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 519' ' ' TRP . 27.7 m -69.3 -28.36 38.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.966 0.412 . . . . 10.0 110.265 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -75.11 -22.96 57.88 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.498 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -78.29 -24.13 46.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.009 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 63.0 mt -75.7 145.56 40.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.741 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -75.7 -46.0 33.62 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.018 0.437 . . . . 10.0 110.295 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -138.15 84.39 20.61 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.263 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 529' ' ' PRO . . . . . 0.443 ' HA ' ' OE1' ' A' ' 533' ' ' GLN . 64.6 Cg_endo -78.88 104.15 1.76 Allowed 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.758 2.305 . . . . 10.0 112.66 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 72.2 p -82.4 175.07 10.53 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.309 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.11 -39.88 72.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.545 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 57.9 mp0 -60.89 -43.01 99.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.142 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . 0.443 ' OE1' ' HA ' ' A' ' 529' ' ' PRO . 52.4 mt-30 -69.72 -51.14 37.0 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.169 -0.468 . . . . 10.0 110.727 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.04 -42.8 87.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 10.0 111.024 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -64.13 -40.61 96.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.036 0.446 . . . . 10.0 110.45 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.449 ' HG3' ' N ' ' A' ' 537' ' ' ILE . 0.0 OUTLIER -67.1 -43.22 83.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.478 179.804 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . 0.449 ' N ' ' HG3' ' A' ' 536' ' ' LYS . 77.2 mt -64.21 -41.83 93.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-N 116.398 -0.365 . . . . 10.0 110.755 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -59.84 -41.15 90.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.799 0.333 . . . . 10.0 110.547 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -67.36 -45.63 75.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.384 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -42.31 99.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.348 0.594 . . . . 10.0 110.028 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 66.4 t90 -63.81 -38.72 92.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.274 -0.875 . . . . 10.0 110.59 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 31.7 tp60 -56.37 -44.41 80.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.551 -0.295 . . . . 10.0 110.591 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 16.9 t -59.77 -46.7 93.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.033 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -65.49 -44.6 86.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.572 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -57.88 -52.72 64.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.147 -0.933 . . . . 10.0 111.922 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.11 -27.12 63.36 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.657 -178.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.7 91.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.994 0.426 . . . . 10.0 110.065 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 64.7 t -65.5 -43.74 94.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.072 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 24.9 mt -62.29 -41.32 98.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.191 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.85 -36.06 81.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.808 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 551' ' ' ALA . . . . . 0.404 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -68.16 -38.38 82.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.963 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 148.26 6.74 0.24 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.379 -0.915 . . . . 10.0 113.584 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 553' ' ' GLY . . . . . 0.402 ' HA3' ' H ' ' A' ' 582' ' ' GLY . . . 82.75 -164.24 42.85 Favored Glycine 0 CA--C 1.516 0.103 0 C-N-CA 120.762 -0.732 . . . . 10.0 112.062 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 36.0 tp -74.06 118.09 16.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.27 0.557 . . . . 10.0 110.864 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -91.45 119.6 31.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.807 0.337 . . . . 10.0 110.808 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 29.9 mm -104.19 132.07 51.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.554 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 557' ' ' ILE . . . . . 0.455 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.1 mt -128.19 123.04 59.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.972 0.415 . . . . 10.0 110.052 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -106.02 129.72 9.88 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.741 -0.742 . . . . 10.0 111.667 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 23.7 p -86.13 -34.13 20.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.233 0.54 . . . . 10.0 110.584 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -134.14 162.28 32.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.335 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -109.46 138.68 45.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.511 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 562' ' ' HIS . . . . . 0.406 ' HB3' ' HB2' ' A' ' 568' ' ' ASP . 66.2 t60 -86.58 141.15 29.22 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -52.21 -63.85 1.01 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.607 0.567 . . . . 10.0 111.037 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.64 131.9 41.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.112 178.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 565' ' ' ARG . . . . . 0.489 ' HA ' ' HB3' ' A' ' 568' ' ' ASP . 9.3 tpt180 -64.1 -19.58 65.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.381 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 566' ' ' ARG . . . . . 0.535 ' HD3' ' OD2' ' A' ' 212' ' ' ASP . 9.9 ttm180 -52.08 -64.64 0.75 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.528 -179.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 25.8 mt -75.59 -28.28 19.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.965 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 568' ' ' ASP . . . . . 0.489 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 20.5 t70 -61.73 -49.28 77.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.245 0.545 . . . . 10.0 111.005 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 569' ' ' ASN . . . . . 0.519 HD22 ' HA ' ' A' ' 394' ' ' ALA . 40.2 t30 -73.12 -31.6 64.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.473 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -67.94 -29.45 68.51 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.773 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.495 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 32.1 tp -66.89 -34.08 77.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.443 0.639 . . . . 10.0 109.474 178.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 26.5 ttp180 -83.3 -22.82 32.84 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.15 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -71.88 12.94 2.66 Favored Glycine 0 CA--C 1.522 0.5 0 CA-C-N 115.862 -0.608 . . . . 10.0 113.972 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 574' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 1.5 mmt180 -77.15 -35.48 56.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 117.277 0.538 . . . . 10.0 109.806 179.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.593 ' OG ' ' HA3' ' A' ' 582' ' ' GLY . 41.2 t -94.96 165.29 12.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.422 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 576' ' ' GLY . . . . . 0.578 ' HA2' ' O ' ' A' ' 580' ' ' ASP . . . 76.64 39.07 30.53 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.718 -0.753 . . . . 10.0 111.281 -179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -111.07 136.71 49.69 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.56 0.219 . . . . 10.0 110.488 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 59.93 21.65 10.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.905 -0.589 . . . . 10.0 112.423 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 105.31 1.75 41.17 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.404 -0.903 . . . . 10.0 113.338 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 580' ' ' ASP . . . . . 0.578 ' O ' ' HA2' ' A' ' 576' ' ' GLY . 2.8 t70 -66.06 148.01 52.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.726 0.298 . . . . 10.0 110.316 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 581' ' ' ALA . . . . . 0.558 ' O ' ' HA ' ' A' ' 420' ' ' ARG . . . -84.3 -85.54 0.13 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.79 -0.819 . . . . 10.0 108.79 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . 0.593 ' HA3' ' OG ' ' A' ' 575' ' ' SER . . . 83.77 174.71 50.54 Favored Glycine 0 N--CA 1.439 -1.133 0 C-N-CA 120.59 -0.814 . . . . 10.0 113.396 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 421' ' ' LYS . 0.1 OUTLIER -153.64 121.44 6.0 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 -179.68 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -97.97 110.34 22.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.872 0.367 . . . . 10.0 110.985 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 585' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 3.3 tpm_? -119.36 112.96 20.08 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.714 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -106.9 137.68 44.49 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.975 0.417 . . . . 10.0 111.012 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -124.75 141.93 51.76 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 588' ' ' LEU . . . . . 0.448 ' HB2' HG22 ' A' ' 427' ' ' VAL . 8.6 mt -142.71 171.32 14.21 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.923 0.392 . . . . 10.0 110.863 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.39 155.56 48.23 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.988 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 590' ' ' MET . . . . . 0.499 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 90.7 mmm -71.18 -5.37 31.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.771 0.32 . . . . 10.0 111.131 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -99.33 -4.39 31.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.408 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -73.13 149.73 42.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.369 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -60.25 -17.25 40.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.525 -0.761 . . . . 10.0 112.224 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 594' ' ' LEU . . . . . 0.518 ' O ' HG12 ' A' ' 597' ' ' ILE . 20.4 tp -64.2 -28.35 69.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.831 0.348 . . . . 10.0 110.842 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.464 ' SD ' ' HB3' ' A' ' 604' ' ' SER . 14.8 mmt -81.75 5.37 18.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.984 0.421 . . . . 10.0 111.297 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -97.9 -15.92 19.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.439 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 597' ' ' ILE . . . . . 0.518 HG12 ' O ' ' A' ' 594' ' ' LEU . 42.6 pt -86.41 11.34 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.188 0.518 . . . . 10.0 110.764 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -90.25 22.56 3.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.799 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.1 -58.42 0.57 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.684 0.794 . . . . 10.0 111.842 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.2 m -127.53 136.62 51.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.746 0.307 . . . . 10.0 110.567 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.11 -20.3 63.9 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.249 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 602' ' ' ARG . . . . . 0.423 ' O ' ' HD3' ' A' ' 602' ' ' ARG . 0.9 OUTLIER -64.64 -33.7 76.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.75 -179.793 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 16.2 t -67.57 -50.19 63.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.177 0.513 . . . . 10.0 109.752 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 604' ' ' SER . . . . . 0.464 ' HB3' ' SD ' ' A' ' 595' ' ' MET . 0.0 OUTLIER -65.93 -35.8 81.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.08 179.173 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -61.25 -28.73 69.68 Favored Glycine 0 N--CA 1.45 -0.433 0 CA-C-N 115.788 -0.642 . . . . 10.0 112.637 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 14.9 tpt -66.6 -32.21 73.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.191 0.52 . . . . 10.0 110.253 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 67.5 mtt -74.12 -11.27 60.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.698 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -77.39 -0.61 26.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.08 0.467 . . . . 10.0 110.686 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -108.31 22.7 15.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.527 179.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.68 -12.29 57.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.436 -0.802 . . . . 10.0 111.235 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 93.67 -57.16 2.27 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.949 -0.643 . . . . 10.0 112.339 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 66.85 -79.34 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.27 0.628 . . . . 10.0 112.219 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? 67.62 95.4 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.34 0 O-C-N 123.67 0.606 . . . . 10.0 110.172 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 614' ' ' PRO . . . . . 0.443 ' HG3' ' HG2' ' A' ' 433' ' ' GLU . 53.6 Cg_exo -51.79 110.62 0.45 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.211 2.607 . . . . 10.0 113.412 -178.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 117.98 -22.21 9.92 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.012 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -92.79 98.44 11.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.189 0.518 . . . . 10.0 110.449 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -95.06 88.11 5.12 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.489 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -86.45 -12.2 11.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.777 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 69.62 142.41 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.66 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -144.13 93.25 6.04 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.337 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -62.73 -29.92 77.76 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.15 2.567 . . . . 10.0 113.805 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 64.8 p-90 -68.82 -17.72 64.05 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.055 0.391 . . . . 10.0 112.055 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.534 HG11 HG23 ' A' ' 427' ' ' VAL . 44.2 t -66.07 -51.25 62.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.779 0.323 . . . . 10.0 110.3 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 27.9 m -59.03 -34.65 72.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.233 0.54 . . . . 10.0 110.437 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -68.04 -41.93 81.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.988 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -65.45 -43.65 89.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.523 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 92.1 mt -63.34 -45.11 99.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.686 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -59.49 -42.68 92.71 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.914 0.388 . . . . 10.0 110.721 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -68.5 -39.41 81.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.351 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -62.11 -39.68 93.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.969 0.414 . . . . 10.0 110.154 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -61.46 -46.39 90.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.626 178.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.7 -34.09 69.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.432 -0.803 . . . . 10.0 110.915 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -62.75 -48.15 80.45 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.95 0.405 . . . . 10.0 110.519 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 48.1 t -62.97 -43.29 98.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.477 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -64.54 -43.23 94.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.676 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 49.9 m -62.91 -32.89 74.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.991 0.424 . . . . 10.0 110.161 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -67.89 -42.81 80.62 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -65.59 -40.29 92.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.302 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -59.38 -40.57 86.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.255 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 640' ' ' ASP . . . . . 0.566 ' O ' ' HG2' ' A' ' 644' ' ' GLN . 33.1 t70 -60.11 -43.59 95.48 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 179.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 58.2 mt -66.11 -43.03 92.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.159 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 642' ' ' ARG . . . . . 0.431 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 7.6 mtm-85 -59.77 -40.71 89.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.731 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 19.7 ttpp -60.85 -41.98 96.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.494 -0.776 . . . . 10.0 110.599 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 644' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 9.8 mm100 -64.07 -43.33 95.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.577 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 87.3 mt -63.97 -44.14 93.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.198 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 646' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 97.1 mt -66.09 -30.24 70.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.277 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.07 -27.79 68.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.24 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -100.61 -32.41 10.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.888 0.375 . . . . 10.0 110.731 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -35.69 80.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.234 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -69.73 -22.98 63.34 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.988 0.423 . . . . 10.0 110.897 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 651' ' ' VAL . . . . . 0.432 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 48.5 t -64.71 -47.18 89.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.163 -0.68 . . . . 10.0 109.163 178.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -70.7 -28.49 64.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.517 -0.765 . . . . 10.0 109.503 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -60.79 -52.31 65.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.617 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -60.04 -45.95 91.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.937 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 655' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 35.5 mt-30 -62.2 -41.73 98.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.626 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 11.4 ttp-105 -63.8 -48.53 76.52 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 52.0 ttp180 -57.54 -44.92 85.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.91 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.19 -53.55 51.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.902 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 8.5 tp -66.21 -33.31 62.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 121.028 -0.269 . . . . 10.0 111.356 -178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -69.86 -33.49 72.33 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 110.257 -0.275 . . . . 10.0 110.257 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 57.1 m -65.08 -39.13 92.78 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.78 -44.22 74.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.712 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 44.5 ttt-85 -62.97 -37.84 88.71 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.238 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -68.6 -35.71 77.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.325 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.62 -51.51 64.9 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 52.0 mt -65.91 -18.25 65.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.601 -0.727 . . . . 10.0 110.472 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 47.6 tp -80.42 -44.43 19.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.457 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.49 -43.15 60.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.991 -0.549 . . . . 10.0 112.351 -178.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 34.3 m -67.68 149.31 11.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.203 0.525 . . . . 10.0 111.73 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.47 -31.71 11.85 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.672 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -101.61 146.47 27.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.125 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 672' ' ' VAL . . . . . 0.443 ' O ' HG12 ' A' ' 676' ' ' ILE . 9.5 p -143.47 10.75 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.958 0.409 . . . . 10.0 110.69 -179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.85 -43.61 86.01 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.036 0.446 . . . . 10.0 110.942 -179.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -62.33 -50.34 72.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.84 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 675' ' ' THR . . . . . 0.404 ' O ' HG12 ' A' ' 679' ' ' ILE . 1.8 m -56.95 -46.41 82.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.022 -0.536 . . . . 10.0 111.33 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 676' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 672' ' ' VAL . 46.4 mm -61.73 -44.23 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.942 0.401 . . . . 10.0 110.932 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -67.27 -41.41 85.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.459 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 40.2 m -62.35 -44.98 95.21 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 679' ' ' ILE . . . . . 0.459 ' O ' HG23 ' A' ' 683' ' ' VAL . 47.2 pt -74.79 -26.38 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 C-N-CA 120.535 -0.466 . . . . 10.0 110.669 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -59.63 -42.04 91.82 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.209 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -60.88 -47.13 87.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.657 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.75 -47.7 77.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.152 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 683' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 679' ' ' ILE . 81.0 t -58.66 -51.91 66.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.314 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -60.57 -42.84 97.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.126 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.1 tttm -63.39 -49.77 72.49 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 121.16 -0.216 . . . . 10.0 110.554 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.92 -41.85 88.3 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.44 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 23.9 m -65.41 -40.77 93.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.022 0.439 . . . . 10.0 110.597 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 84.1 mt -67.43 -42.2 86.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.487 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -57.23 -24.96 58.14 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 122.755 0.422 . . . . 10.0 111.946 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -75.63 -28.45 58.82 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -108.21 -24.64 11.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.096 0.474 . . . . 10.0 111.161 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 692' ' ' ILE . . . . . 0.5 HG23 ' CD1' ' A' ' 701' ' ' TRP . 84.6 mt -132.91 99.89 14.87 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.41 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -62.14 139.91 80.89 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.427 2.085 . . . . 10.0 111.571 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.82 113.88 1.59 Allowed 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.813 2.342 . . . . 10.0 112.855 -179.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 58.13 67.37 0.96 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.215 -0.902 . . . . 10.0 111.942 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 14.3 p -127.35 177.81 6.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.199 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 18.6 mt -75.88 154.54 35.99 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.18 -26.98 65.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.378 . . . . 10.0 111.598 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -67.06 -14.23 62.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.554 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -104.96 7.43 34.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.626 -0.261 . . . . 10.0 111.041 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 701' ' ' TRP . . . . . 0.5 ' CD1' HG23 ' A' ' 692' ' ' ILE . 41.7 m0 -101.23 106.3 17.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.742 0.306 . . . . 10.0 111.099 -179.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 58.7 t0 -82.51 77.58 9.26 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 703' ' ' ILE . . . . . 0.511 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 24.2 mm -57.76 -49.9 91.17 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.652 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 704' ' ' PRO . . . . . 0.511 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 32.2 Cg_exo -60.14 -42.0 46.9 Favored 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 121.894 1.729 . . . . 10.0 111.718 179.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -63.81 -44.8 95.67 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.622 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 55.6 tp -65.06 -40.99 95.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.189 -0.301 . . . . 10.0 110.189 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -62.04 -48.11 81.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.512 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -59.42 -42.23 91.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.02 -0.537 . . . . 10.0 110.235 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -63.46 -43.44 97.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.548 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 49.6 mt -64.07 -42.62 96.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.297 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 14.3 mtpp -76.1 -6.05 49.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.881 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -111.84 -56.54 2.37 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.484 0.55 . . . . 10.0 112.484 -178.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -83.73 -19.22 35.56 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.879 0.696 . . . . 10.0 112.879 -177.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -123.02 -8.92 8.27 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.465 -0.494 . . . . 10.0 112.123 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.98 21.79 12.59 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.019 0.438 . . . . 10.0 110.758 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 12.8 tp -97.65 109.88 22.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.407 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -91.47 92.32 8.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.918 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 40.0 mt -123.4 122.7 26.65 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.399 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -82.36 77.99 3.57 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.8 2.334 . . . . 10.0 112.186 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 44.7 mt -61.43 -37.24 77.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.197 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.45 4.35 4.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.883 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -109.18 -0.88 19.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.865 0.364 . . . . 10.0 110.211 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 15.9 m0 -114.44 -44.92 3.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.676 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 11.1 tp -60.33 -16.51 35.47 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.358 0.873 . . . . 10.0 113.358 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -90.27 -32.67 16.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.994 0.426 . . . . 10.0 111.075 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 726' ' ' LYS . . . . . 0.519 ' O ' ' HD3' ' A' ' 728' ' ' PRO . 40.3 mttp -93.34 -23.19 18.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.925 -178.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -109.36 94.74 16.54 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-O 120.752 0.311 . . . . 10.0 110.725 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . 0.519 ' HD3' ' O ' ' A' ' 726' ' ' LYS . 11.7 Cg_exo -71.66 -16.81 30.06 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.939 2.426 . . . . 10.0 112.41 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.28 21.42 17.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.111 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.73 -28.35 66.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.71 -134.58 0.57 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.44 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.35 -56.25 1.24 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.066 0.46 . . . . 10.0 110.564 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 733' ' ' GLU . . . . . 0.489 ' HG2' ' N ' ' A' ' 734' ' ' THR . 20.2 pm0 -60.67 -38.95 86.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.758 -0.655 . . . . 10.0 111.8 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . 0.489 ' N ' ' HG2' ' A' ' 733' ' ' GLU . 0.1 OUTLIER -65.68 -27.59 68.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.974 0.416 . . . . 10.0 110.794 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 50.2 tp -69.04 -40.41 78.6 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 -64.38 -41.15 96.84 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.858 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -60.21 -40.82 91.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.701 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 21.6 mmm-85 -61.15 -50.64 72.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.795 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 55.4 mt -60.38 -43.6 94.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.652 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 740' ' ' LEU . . . . . 0.428 ' O ' HG13 ' A' ' 744' ' ' ILE . 16.5 tp -63.93 -50.95 66.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.001 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.83 86.54 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.24 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 742' ' ' GLN . . . . . 0.405 ' O ' HG23 ' A' ' 746' ' ' VAL . 16.6 tp60 -64.95 -39.51 93.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.744 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 24.5 p -63.44 -33.54 75.77 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.062 0.458 . . . . 10.0 110.033 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 744' ' ' ILE . . . . . 0.522 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 66.7 mt -70.41 -43.98 77.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -48.93 79.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.34 -0.846 . . . . 10.0 111.114 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 742' ' ' GLN . 57.9 t -64.32 -36.66 77.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.065 0.46 . . . . 10.0 110.261 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.48 -43.22 99.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.332 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 748' ' ' GLN . . . . . 0.522 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 23.4 mt-30 -58.75 -37.93 77.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.748 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 749' ' ' ARG . . . . . 0.447 ' O ' HG23 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -62.58 -46.01 90.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.477 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -65.5 -37.56 87.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.08 0.467 . . . . 10.0 109.888 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -64.1 -41.89 97.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.222 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -64.52 -29.82 70.85 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 749' ' ' ARG . 54.9 t -78.74 -48.96 21.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.824 0.345 . . . . 10.0 111.37 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 38.9 t -74.07 -52.04 21.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.961 0.41 . . . . 10.0 111.637 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 139.77 141.61 4.09 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.301 -0.719 . . . . 10.0 111.301 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 756' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -60.94 -63.2 1.38 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.783 0.291 . . . . 10.0 111.458 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -60.19 -37.87 81.54 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.729 0.299 . . . . 10.0 110.701 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 14.6 tpt -61.19 -45.21 95.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.27 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 45.0 mmm -65.23 -41.34 94.48 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.49 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.4 mmp_? -59.35 -41.4 89.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.255 0.55 . . . . 10.0 109.997 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -70.48 -33.86 71.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.829 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -65.24 -52.41 54.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.542 -0.754 . . . . 10.0 109.772 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -58.91 -45.31 90.64 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.175 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 764' ' ' LYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 768' ' ' LEU . 50.9 tttp -56.11 -47.7 77.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.163 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -68.64 -38.88 86.53 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 121.003 -0.617 . . . . 10.0 112.079 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 30.2 t -61.89 -45.41 98.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 110.523 -0.177 . . . . 10.0 110.523 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 37.8 mtp -59.2 -46.13 89.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.73 -0.213 . . . . 10.0 110.516 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 768' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 764' ' ' LYS . 85.1 mt -64.46 -47.92 77.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.494 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -58.42 -46.58 86.19 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.94 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 19.3 m -63.7 -38.77 92.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.925 0.393 . . . . 10.0 110.563 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.65 -50.56 72.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.788 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.46 -29.95 71.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.702 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 69.1 m -68.05 -43.86 77.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.911 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.16 -25.44 34.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.731 0.301 . . . . 10.0 111.109 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 27.2 t-105 -63.68 -49.45 73.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.565 -0.289 . . . . 10.0 111.3 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -59.58 -39.26 83.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.81 0.338 . . . . 10.0 110.547 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -68.42 -39.93 81.4 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.204 0.526 . . . . 10.0 109.985 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 68.0 t60 -62.24 -38.17 88.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.274 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 80.7 mt -65.41 -47.16 77.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.488 179.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -63.81 -46.16 86.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.759 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -60.56 -41.62 94.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.128 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 51.1 mmm -63.16 -42.33 99.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.734 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -68.31 -36.64 79.62 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.099 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -69.69 -32.99 71.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.43 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.55 -37.29 60.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.962 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -60.96 -50.79 71.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.35 -0.841 . . . . 10.0 111.075 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 . . . . . 0 C--N 1.329 -0.285 0 CA-C-O 120.944 0.402 . . . . 10.0 110.986 -179.814 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 CA--C 1.529 0.242 0 CA-C-O 121.04 0.35 . . . . 10.0 112.0 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -81.46 155.39 25.86 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 73.09 -49.43 0.7 Allowed 'General case' 0 N--CA 1.468 0.448 0 O-C-N 123.578 0.549 . . . . 10.0 111.166 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 802' ' ' GLU . . . . . 0.46 ' OE2' ' HD3' ' A' ' 805' ' ' ARG . 3.1 tp10 -65.16 -47.65 76.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.069 0.461 . . . . 10.0 109.83 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -61.8 -34.73 76.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.87 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -63.63 -36.24 83.17 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.922 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 805' ' ' ARG . . . . . 0.46 ' HD3' ' OE2' ' A' ' 802' ' ' GLU . 44.8 mtp180 -58.5 -43.59 89.1 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.153 0.502 . . . . 10.0 109.718 178.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -62.6 -44.79 95.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.964 179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 6.2 m -61.02 -39.82 91.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.713 -0.676 . . . . 10.0 110.966 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -71.99 -38.01 69.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.865 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 40.2 m -62.94 -39.66 95.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.06 0.457 . . . . 10.0 109.946 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 18.9 ttm -66.74 -37.21 84.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.086 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 811' ' ' PHE . . . . . 0.43 ' O ' ' HG ' ' A' ' 815' ' ' LEU . 27.4 t80 -65.7 -41.98 91.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.348 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.29 -45.88 92.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.654 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.72 -37.27 85.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.13 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 22.9 ttt -62.83 -44.31 96.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.597 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 815' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 811' ' ' PHE . 94.1 mt -62.06 -41.53 98.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.846 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -64.21 -45.95 86.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.241 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 11.7 m -65.02 -35.8 82.34 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.992 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 63.6 tp -56.07 -51.01 69.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.639 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -62.49 -42.09 99.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.225 0.536 . . . . 10.0 110.399 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -58.88 -57.45 12.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.196 -0.911 . . . . 10.0 111.629 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -59.97 -42.95 95.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.076 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 30.4 t -58.44 -52.55 57.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.561 0.219 . . . . 10.0 110.614 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 35.4 mm -63.77 -41.24 91.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.695 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 37.1 t -56.83 -49.42 75.47 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.736 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 16.7 m -63.16 -37.96 89.28 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.323 -0.398 . . . . 10.0 111.75 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 93.5 mt -75.56 -17.03 60.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.553 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 16.3 m -95.94 -41.75 8.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.997 0.427 . . . . 10.0 110.627 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -77.34 -1.01 27.78 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.867 -0.606 . . . . 10.0 112.453 -178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.0 p -64.59 118.37 6.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.439 0.638 . . . . 10.0 110.065 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -80.44 106.16 12.25 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.237 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 C--N 1.319 -0.726 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.148 179.526 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 . . . . . 0 C--O 1.235 0.317 0 CA-C-O 120.821 0.343 . . . . 10.0 110.864 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 142.58 165.16 10.46 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.842 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.44 ' H ' ' HD3' ' A' ' 16' ' ' ARG . 0.7 OUTLIER -57.28 133.45 55.11 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 122.413 0.285 . . . . 10.0 110.566 179.661 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.517 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 5.1 mmp_? -58.52 137.72 57.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.739 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 68.17 -83.67 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.328 -0.851 . . . . 10.0 112.543 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -41.08 -68.13 0.2 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.497 1.295 . . . . 10.0 114.497 -177.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.44 ' HD3' ' H ' ' A' ' 12' ' ' SER . 44.0 ttt180 -64.32 -43.01 96.01 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.48 0.548 . . . . 10.0 112.48 -177.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.89 -39.34 88.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.15 0.426 . . . . 10.0 112.15 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.5 mt -61.17 -53.94 50.66 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.08 0.4 . . . . 10.0 112.08 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -66.66 -24.22 66.25 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.57 -0.452 . . . . 10.0 110.953 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.07 -42.44 56.89 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 60.5 mtt -68.5 -32.3 72.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.817 -0.628 . . . . 10.0 109.667 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -57.5 -32.96 67.54 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.453 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -63.36 -43.72 96.85 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.182 0.515 . . . . 10.0 109.843 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.64 -41.94 91.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.391 -0.822 . . . . 10.0 109.943 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.455 ' HA ' HD12 ' A' ' 28' ' ' ILE . 97.5 t -60.72 -37.07 74.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.681 -0.69 . . . . 10.0 110.117 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -63.24 -43.12 98.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.66 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 82.3 mt -61.95 -45.57 98.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.986 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.455 HD12 ' HA ' ' A' ' 25' ' ' VAL . 55.8 mt -59.66 -40.29 81.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.346 179.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -63.84 -33.55 75.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.862 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.439 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -82.56 -26.94 31.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.479 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 13.4 ttt -83.3 -16.42 46.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.69 0.281 . . . . 10.0 110.814 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.477 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 27.5 tt0 -59.49 -51.93 77.77 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 116.352 -0.385 . . . . 10.0 111.728 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.477 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 51.8 Cg_exo -56.28 -28.3 70.98 Favored 'Trans proline' 0 C--N 1.361 1.214 0 C-N-CA 121.844 1.696 . . . . 10.0 111.949 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -73.1 -42.09 63.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.835 -0.62 . . . . 10.0 109.908 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 25.4 mmt -66.31 -27.83 68.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.435 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 83.7 mt-10 -62.48 -23.48 66.94 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.839 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 mtpt -86.17 -14.32 44.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.069 0.461 . . . . 10.0 110.589 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 7.8 mp -87.48 140.51 29.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.321 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.6 p -76.28 171.67 14.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.649 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.04 -38.24 82.18 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.894 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -70.55 -32.01 69.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.554 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -66.94 -34.74 78.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.276 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.2 mt -62.93 -44.79 95.12 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.896 -0.779 . . . . 10.0 108.896 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -63.4 -28.05 69.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.926 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.65 -34.3 72.65 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 115.421 -0.808 . . . . 10.0 111.449 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -68.89 -39.34 79.82 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.6 m -60.21 -44.24 95.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.103 0.478 . . . . 10.0 109.915 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -38.32 88.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.653 -0.703 . . . . 10.0 110.055 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -60.5 -40.07 90.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.375 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -62.77 -43.42 98.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.321 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -58.48 -46.83 85.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.357 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.571 ' O ' ' HG3' ' A' ' 56' ' ' LYS . . . -68.83 -44.39 73.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.302 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 33.5 mtp180 -58.23 -40.27 81.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.786 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 72.6 mt -62.76 -38.5 90.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 10.0 110.626 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -72.45 -23.93 61.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.301 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 52' ' ' ALA . 20.5 mtpp -83.22 -66.96 0.83 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.77 0.319 . . . . 10.0 110.422 179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 178.22 67.07 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 121.071 -0.585 . . . . 10.0 111.918 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -133.39 150.6 51.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.809 0.338 . . . . 10.0 110.203 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.1 t -100.15 133.66 42.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.892 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.563 HD11 ' O ' ' A' ' 118' ' ' LEU . 17.1 tp -60.35 -41.41 93.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.096 0.474 . . . . 10.0 110.608 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.7 mp0 -68.04 -8.99 42.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.255 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -100.15 -15.18 18.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.38 0.61 . . . . 10.0 109.963 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 55.4 mt -89.1 -5.49 57.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.516 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.498 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 66.6 mt -49.54 -51.01 62.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 113.256 0.835 . . . . 10.0 113.256 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.498 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 32.1 Cg_exo -57.3 -48.19 18.83 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.829 1.686 . . . . 10.0 112.957 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.451 ' O ' HG23 ' A' ' 70' ' ' VAL . 39.4 mt-10 -71.01 -43.47 67.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.719 -178.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.497 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -61.88 -51.44 68.19 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.061 0.393 . . . . 10.0 112.061 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -61.92 -34.17 75.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.325 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.44 -45.01 92.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.415 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 66' ' ' GLU . 85.6 t -60.86 -46.39 96.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.334 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 67' ' ' ALA . 29.1 t -60.87 -46.08 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.677 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.415 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 2.7 ttt180 -59.82 -43.02 94.76 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.682 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.3 tp10 -64.49 -47.56 78.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.83 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.41 72.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.572 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.5 m -58.45 -40.94 83.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.301 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -71.14 -21.21 62.22 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -96.21 -44.38 7.3 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.731 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 67.1 t -74.1 -53.13 18.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.647 0.261 . . . . 10.0 111.628 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -98.87 -47.47 5.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.131 0.491 . . . . 10.0 111.213 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 119.54 -34.24 4.33 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.217 -0.753 . . . . 10.0 111.217 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.6 mpt? -77.99 139.62 39.15 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.01 -0.367 . . . . 10.0 110.01 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -91.13 139.04 31.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.583 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.89 114.96 3.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.079 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -61.31 152.48 29.16 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.056 0.455 . . . . 10.0 111.822 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -41.83 94.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.511 -0.768 . . . . 10.0 111.77 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -63.65 -31.61 53.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.116 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.532 HE22 HD23 ' A' ' 110' ' ' LEU . 97.9 mt-30 -70.19 -31.34 68.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.253 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.22 -31.75 73.07 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.465 ' O ' HG23 ' A' ' 93' ' ' VAL . 39.1 mt -73.77 -48.82 28.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.806 -0.634 . . . . 10.0 109.438 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.88 -40.84 99.38 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.779 -0.646 . . . . 10.0 112.508 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.32 -28.66 73.34 Favored Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 112.026 -0.43 . . . . 10.0 112.026 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 16.4 ttm -74.34 -37.6 63.5 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 89' ' ' LEU . 58.8 t -66.82 -33.78 65.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.03 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.1 mt -74.29 -2.69 26.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.562 -0.745 . . . . 10.0 112.141 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -83.13 -35.05 25.9 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 178.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -96.35 178.02 5.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.194 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -79.07 71.33 5.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.066 0.46 . . . . 10.0 110.443 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 56.2 m -143.74 154.35 43.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.445 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.553 HD12 HG11 ' A' ' 211' ' ' VAL . 41.1 mm -103.29 136.48 35.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -116.18 126.99 54.42 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 111.929 0.344 . . . . 10.0 111.929 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -87.54 121.04 29.46 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.42 ' SD ' ' HG2' ' A' ' 108' ' ' LYS . 45.5 ttm -112.63 158.58 19.82 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.974 0.416 . . . . 10.0 111.271 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 103' ' ' ARG . 9.9 mmm180 -95.02 157.38 15.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.25 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.43 108.04 7.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.39 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 132.31 -28.36 3.47 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.485 -0.864 . . . . 10.0 112.926 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.601 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 4.4 mm-40 -60.47 -51.02 71.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.018 0.437 . . . . 10.0 110.542 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 114.71 99.52 2.28 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.806 -0.711 . . . . 10.0 112.469 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.42 ' HG2' ' SD ' ' A' ' 102' ' ' MET . 40.2 mtmt -69.8 -45.5 67.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.657 0.265 . . . . 10.0 111.054 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 73.4 m -62.07 -34.16 75.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.269 0.556 . . . . 10.0 110.68 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.532 HD23 HE22 ' A' ' 87' ' ' GLN . 13.3 tp -81.14 -1.99 46.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.998 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 42.2 m -110.81 -42.71 3.95 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.895 0.378 . . . . 10.0 110.464 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.52 -13.56 59.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.975 -0.557 . . . . 10.0 112.155 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -24.98 63.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.462 -0.335 . . . . 10.0 111.799 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.416 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 55.5 mt -73.63 -57.16 2.68 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 31.6 Cg_endo -62.11 -32.34 83.31 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.108 1.872 . . . . 10.0 112.118 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.29 77.16 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.385 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.415 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 57.1 t80 -63.47 -46.97 83.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.488 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.563 ' O ' HD11 ' A' ' 60' ' ' LEU . 52.1 tp -58.85 -51.1 71.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.706 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -72.26 -21.78 61.32 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.693 0.257 . . . . 10.0 111.693 -178.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.472 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -70.22 -26.64 63.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.877 0.37 . . . . 10.0 110.861 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 58.8 mt -58.72 -32.32 69.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.218 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 69.0 p -64.23 -35.56 81.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.244 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.06 19.26 59.51 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.914 -0.66 . . . . 10.0 112.303 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 64.1 mmtt -87.36 -26.77 23.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.938 0.399 . . . . 10.0 110.881 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 109.1 105.77 2.99 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.771 -0.728 . . . . 10.0 112.922 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 78.4 t -79.35 115.66 22.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -93.56 99.05 11.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.741 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 40.5 t -92.21 118.9 38.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.957 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 52.4 t -104.8 119.71 54.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.854 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.11 155.7 19.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.275 -0.42 . . . . 10.0 110.764 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 5.1 m -64.71 -36.94 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.899 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -139.0 162.66 34.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.766 0.317 . . . . 10.0 110.631 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.88 -24.12 63.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.406 -178.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -62.68 -55.24 28.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.82 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 83.2 mt -68.71 -33.08 73.34 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.595 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.75 -50.8 69.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.976 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -72.55 -35.63 68.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.725 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -58.92 -57.33 13.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.724 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.76 -32.63 74.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.001 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.7 -49.15 77.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.997 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . 0.415 ' O ' ' HD3' ' A' ' 145' ' ' PRO . 54.4 mm-40 -78.53 -28.26 46.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.472 -179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -71.38 -43.0 67.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.015 0.436 . . . . 10.0 111.08 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -88.77 -1.66 58.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.119 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.499 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 60.6 ttm-85 -64.87 -50.16 64.68 Favored Pre-proline 0 CA--C 1.535 0.404 0 N-CA-C 112.484 0.55 . . . . 10.0 112.484 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' PRO . . . . . 0.499 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 32.4 Cg_exo -60.69 -14.39 31.28 Favored 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 122.102 1.868 . . . . 10.0 112.62 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 14.3 tp -89.07 -56.49 3.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.405 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -65.87 -46.74 77.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 10.0 112.186 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -64.95 -25.57 67.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.781 0.324 . . . . 10.0 111.591 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -77.45 -22.93 50.68 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.071 0.462 . . . . 10.0 110.306 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 81.8 mt -93.17 -6.73 47.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.659 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 103.74 8.16 40.45 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.515 -0.85 . . . . 10.0 113.585 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 91.8 mt -96.91 138.7 34.06 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.1 0.45 . . . . 10.0 110.592 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.35 130.65 34.44 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.279 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.426 HG21 ' HA ' ' A' ' 144' ' ' ARG . 47.2 t -111.45 123.03 66.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.941 0.4 . . . . 10.0 110.689 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -120.57 150.46 17.37 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.993 -0.622 . . . . 10.0 112.278 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 4.3 tp -123.81 133.2 69.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -118.98 116.48 26.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.407 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.505 ' O ' ' HB2' ' A' ' 161' ' ' MET . 94.7 mt -109.06 146.07 33.08 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.482 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' PRO . . . . . 0.567 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 15.2 Cg_endo -58.46 115.08 2.28 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 122.655 2.236 . . . . 10.0 112.22 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.85 5.24 56.6 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.785 -0.722 . . . . 10.0 112.746 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . 0.505 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.3 OUTLIER -65.87 151.96 94.15 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.555 0.177 . . . . 10.0 110.809 179.496 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -61.33 147.0 96.69 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.496 2.131 . . . . 10.0 111.866 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . 0.487 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.82 -49.71 87.79 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 112.384 0.513 . . . . 10.0 112.384 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.487 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 52.2 Cg_exo -56.59 -44.87 41.45 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 121.819 1.68 . . . . 10.0 112.205 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.69 98.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.67 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -62.25 -44.47 96.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.456 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' ARG . . . . . 0.438 ' CG ' ' HA ' ' A' ' 199' ' ' VAL . 74.9 mtt180 -59.68 -40.52 88.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.005 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.99 -35.07 74.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.882 0.373 . . . . 10.0 110.437 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -68.62 -39.11 80.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.746 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -80.94 -12.84 59.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.59 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -85.66 -9.6 56.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.32 0.581 . . . . 10.0 109.463 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -80.13 165.03 22.87 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.285 -0.87 . . . . 10.0 109.895 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . 0.472 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 17.2 m-20 -70.54 -37.05 74.0 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.805 0.336 . . . . 10.0 110.76 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.3 mp -126.52 122.59 61.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.061 179.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 5.8 m -115.7 121.01 41.24 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.886 0.374 . . . . 10.0 111.18 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -99.74 141.67 32.23 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -177.83 172.62 45.26 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.34 -0.933 . . . . 10.0 112.895 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.87 153.45 21.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.805 0.336 . . . . 10.0 111.15 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -63.31 -35.92 81.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.899 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -59.49 -52.19 66.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.169 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.567 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.8 tp10 -69.79 -37.53 76.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.102 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -56.8 -36.04 69.43 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.974 0.416 . . . . 10.0 110.834 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -77.88 -40.03 22.66 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.804 -0.713 . . . . 10.0 111.694 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -64.3 -40.03 95.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.581 0.229 . . . . 10.0 110.58 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -60.43 -41.43 93.99 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.104 0.478 . . . . 10.0 109.973 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . 0.434 ' HA ' HE22 ' A' ' 200' ' ' GLN . 43.7 t80 -62.25 -39.54 93.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.518 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 187' ' ' LEU . . . . . 0.4 HD22 ' HB1' ' A' ' 373' ' ' ALA . 87.1 mt -67.4 -44.02 79.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.989 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 64.1 mtm-85 -65.48 -43.56 89.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.953 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 189' ' ' ASP . . . . . 0.411 ' OD1' ' HA ' ' A' ' 198' ' ' ARG . 16.3 m-20 -62.93 -32.91 74.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.79 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -85.27 -0.61 55.24 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.484 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 24.8 ttp -121.58 10.6 10.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.819 0.343 . . . . 10.0 110.848 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -69.74 172.18 7.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.07 -0.513 . . . . 10.0 111.111 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -107.09 -30.02 9.04 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.167 0.508 . . . . 10.0 110.394 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 194' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 197' ' ' GLU . 0.1 OUTLIER -115.42 140.07 25.4 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.734 -0.667 . . . . 10.0 109.577 179.136 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.15 -28.61 87.33 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.696 2.264 . . . . 10.0 113.031 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.02 0.63 52.87 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 121.151 -0.219 . . . . 10.0 111.417 -179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 194' ' ' SER . 32.9 mt-10 -80.06 -11.32 59.78 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 121.234 -0.186 . . . . 10.0 110.71 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 198' ' ' ARG . . . . . 0.411 ' HA ' ' OD1' ' A' ' 189' ' ' ASP . 66.2 mtt180 -58.17 142.42 47.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.622 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 199' ' ' VAL . . . . . 0.438 ' HA ' ' CG ' ' A' ' 167' ' ' ARG . 28.9 m -94.77 -26.7 4.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.482 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 200' ' ' GLN . . . . . 0.434 HE22 ' HA ' ' A' ' 186' ' ' TYR . 4.1 pt20 -107.63 159.73 16.23 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.889 0.376 . . . . 10.0 110.705 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 55.3 mtm180 -82.4 -66.18 0.92 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.75 172.82 7.61 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.497 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . 0.436 HD22 ' CZ ' ' A' ' 384' ' ' TYR . 19.5 mt -102.68 124.97 49.21 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -140.59 -56.5 0.52 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.916 0.388 . . . . 10.0 110.325 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -127.12 136.37 52.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.64 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.493 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -132.05 127.29 35.84 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.084 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 47.5 tp -125.65 109.89 13.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.702 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.16 132.26 46.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.214 0.53 . . . . 10.0 111.109 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -49.54 77.38 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.237 -0.892 . . . . 10.0 112.243 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.52 103.97 6.44 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.927 0.394 . . . . 10.0 110.362 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.553 HG11 HD12 ' A' ' 99' ' ' ILE . 30.9 m -74.05 -18.35 17.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.754 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 212' ' ' ASP . . . . . 0.437 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.3 m-20 -46.11 -74.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.561 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 66.0 m -86.84 -19.86 28.34 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.78 0.659 . . . . 10.0 112.78 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 50.3 mt -77.7 -38.98 26.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.316 0.488 . . . . 10.0 112.316 -178.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 215' ' ' LEU . . . . . 0.409 ' O ' ' HB2' ' A' ' 219' ' ' ALA . 18.4 mt -98.44 -42.35 7.37 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -178.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 216' ' ' ILE . . . . . 0.437 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 49.5 mm -81.83 -59.04 3.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 112.575 0.583 . . . . 10.0 112.575 -178.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.6 -34.36 76.85 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.05 0.759 . . . . 10.0 113.05 -177.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 218' ' ' GLU . . . . . 0.436 ' O ' ' HB2' ' A' ' 377' ' ' PHE . 7.5 mm-40 -97.69 15.8 22.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.66 0.267 . . . . 10.0 111.718 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 215' ' ' LEU . . . -60.14 -49.54 77.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.936 0.398 . . . . 10.0 111.84 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 220' ' ' ARG . . . . . 0.562 ' O ' ' HD3' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -97.59 32.8 2.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.1 0.476 . . . . 10.0 111.511 -178.436 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 10.0 m -105.25 106.69 56.79 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -91.52 125.65 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.918 2.412 . . . . 10.0 113.318 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 223' ' ' LEU . . . . . 0.538 ' O ' ' HA ' ' A' ' 374' ' ' SER . 88.0 mt -79.8 110.43 15.15 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 178.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 55.7 mt -108.48 130.64 60.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.035 0.445 . . . . 10.0 111.715 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 9.4 mt . . . . . 0 C--N 1.327 -0.376 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.537 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 373' ' ' ALA . . . . . 0.4 ' HB1' HD22 ' A' ' 187' ' ' LEU . . . . . . . . 0 C--O 1.234 0.238 0 N-CA-C 109.858 -0.423 . . . . 10.0 109.858 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 374' ' ' SER . . . . . 0.538 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 16.4 m -152.04 136.53 16.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.655 0.264 . . . . 10.0 111.161 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 17.2 tt -155.83 137.17 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.337 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.38 145.64 27.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.398 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 377' ' ' PHE . . . . . 0.436 ' HB2' ' O ' ' A' ' 218' ' ' GLU . 36.2 m-85 -57.53 -37.65 73.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.654 0.264 . . . . 10.0 110.657 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -57.32 -39.94 76.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.404 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -74.38 -39.16 62.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.024 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -63.68 -46.43 85.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.378 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -74.65 -16.78 60.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.831 0.308 . . . . 10.0 111.831 -179.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -80.7 -3.29 50.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.856 0.36 . . . . 10.0 110.539 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 60.7 mt -99.37 4.76 46.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.385 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . 0.493 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 21.1 m-85 -99.79 143.68 29.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.147 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -79.27 -70.8 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.928 0.394 . . . . 10.0 110.526 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -89.13 91.92 8.99 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.627 -0.508 . . . . 10.0 109.627 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 54.5 tp -103.27 110.03 21.86 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.012 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -128.96 161.68 29.33 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.18 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.83 165.26 37.01 Favored Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.255 -0.974 . . . . 10.0 112.158 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 46.0 mtm -107.65 143.32 36.28 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.119 -0.326 . . . . 10.0 110.119 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 391' ' ' THR . . . . . 0.452 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 7.1 t -129.51 155.57 45.54 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -80.66 163.57 46.23 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.501 -0.856 . . . . 10.0 112.044 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.63 91.58 0.43 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.166 -0.309 . . . . 10.0 110.166 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . 0.602 ' HA ' HD22 ' A' ' 569' ' ' ASN . . . -151.58 -28.72 0.18 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.229 0.455 . . . . 10.0 112.229 -178.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 31.9 t70 58.83 -108.94 0.43 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 109.205 -0.665 . . . . 10.0 109.205 -178.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 6.7 m 58.81 -89.8 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.239 0.829 . . . . 10.0 113.239 177.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -88.76 22.75 2.53 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.003 0.371 . . . . 10.0 112.003 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -60.84 -35.19 75.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.044 0.449 . . . . 10.0 110.946 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -66.51 -20.05 65.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.487 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.64 -22.36 46.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.712 -0.222 . . . . 10.0 110.847 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -63.64 -46.69 84.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 10.0 110.556 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.36 -20.74 58.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.599 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 41.7 m -87.6 -42.5 12.66 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.328 0.492 . . . . 10.0 112.328 -178.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 56.4 mt -91.44 -61.56 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 N-CA-C 112.763 0.653 . . . . 10.0 112.763 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -88.11 -4.76 58.72 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt 60.48 44.42 11.95 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.788 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 407' ' ' LEU . . . . . 0.502 HD13 HD11 ' A' ' 99' ' ' ILE . 20.7 mt -109.8 141.4 42.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.828 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 408' ' ' ASP . . . . . 0.517 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 47.7 t0 -76.87 166.87 22.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 6.9 m -134.35 101.49 5.01 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.057 0.456 . . . . 10.0 111.149 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 62.0 t -106.84 133.53 51.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.068 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 23.6 t -87.15 126.08 40.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.509 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 54.2 t -86.69 128.46 56.43 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.385 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.96 146.35 82.38 Favored 'Trans proline' 0 N--CA 1.463 -0.292 0 C-N-CA 122.436 2.091 . . . . 10.0 112.095 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.75 145.4 45.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.873 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 415' ' ' ASN . . . . . 0.424 ' HB3' ' HG2' ' A' ' 578' ' ' GLN . 62.8 t30 -56.89 -38.03 72.21 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.268 0.556 . . . . 10.0 110.514 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 416' ' ' ARG . . . . . 0.437 ' HB2' ' O ' ' A' ' 578' ' ' GLN . 71.1 mtm180 -129.66 151.32 77.86 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.451 179.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -61.77 116.26 3.33 Favored 'Trans proline' 0 N--CA 1.465 -0.167 0 C-N-CA 122.6 2.2 . . . . 10.0 111.84 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 48.8 mtm -64.32 118.53 8.81 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.969 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 419' ' ' ILE . . . . . 0.437 HG13 ' HA ' ' A' ' 581' ' ' ALA . 6.4 pt -108.29 30.9 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.359 0.6 . . . . 10.0 110.348 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 420' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 420' ' ' ARG . 36.1 ttp180 -77.2 122.66 25.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.279 -0.873 . . . . 10.0 109.45 179.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 27.0 mmtp -88.76 101.47 14.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.996 0.427 . . . . 10.0 111.104 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -88.4 114.99 25.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.01 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 74.5 mt -94.32 156.09 39.14 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.493 -0.322 . . . . 10.0 110.542 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -65.94 170.28 11.88 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.694 2.263 . . . . 10.0 113.006 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -85.67 129.15 34.9 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.461 -0.791 . . . . 10.0 110.596 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.28 92.08 4.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.353 0.596 . . . . 10.0 110.189 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 427' ' ' VAL . . . . . 0.628 HG22 ' HB2' ' A' ' 588' ' ' LEU . 25.6 t -87.75 122.04 38.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.545 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 428' ' ' TYR . . . . . 0.424 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 2.5 m-85 -105.36 -176.71 3.16 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . 0.426 ' HB2' ' OE2' ' A' ' 433' ' ' GLU . 12.8 mmt -78.09 -74.16 0.28 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.94 0.4 . . . . 10.0 111.342 -178.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 73.2 p -89.53 174.01 8.01 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.869 -178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -71.91 -36.04 69.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.39 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.63 -41.12 85.23 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.571 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 433' ' ' GLU . . . . . 0.426 ' OE2' ' HB2' ' A' ' 429' ' ' MET . 33.1 mt-10 -62.51 -45.38 93.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.143 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 434' ' ' LYS . . . . . 0.539 ' O ' HG13 ' A' ' 438' ' ' ILE . 38.7 ttpt -58.67 -50.46 73.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.706 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 435' ' ' ILE . . . . . 0.479 ' O ' HG12 ' A' ' 439' ' ' ILE . 49.7 mm -62.33 -43.48 98.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.905 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -59.6 -39.92 85.78 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.615 0.245 . . . . 10.0 110.886 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.35 87.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.338 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 438' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 434' ' ' LYS . 70.1 mt -65.53 -45.88 91.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.952 179.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 439' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 435' ' ' ILE . 50.2 mm -58.31 -40.48 78.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.893 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -63.96 -50.42 68.66 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.389 -0.368 . . . . 10.0 110.707 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -58.36 -42.06 86.1 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.127 0.489 . . . . 10.0 110.557 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.442 HG12 HG11 ' A' ' 452' ' ' VAL . 79.2 mt -67.26 -50.7 60.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.637 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -50.01 -49.31 51.21 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.372 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 444' ' ' GLU . . . . . 0.431 ' O ' ' HD3' ' A' ' 448' ' ' LYS . 0.0 OUTLIER -56.74 -47.22 80.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.528 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 47.8 mtt-85 -74.34 -22.24 59.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.016 -0.538 . . . . 10.0 112.19 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 27.4 m -69.4 -39.46 77.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.175 0.512 . . . . 10.0 109.917 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -74.06 -34.17 63.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.943 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 448' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 444' ' ' GLU . 14.0 mptt -70.13 -58.57 3.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.143 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 127.88 35.9 0.5 Allowed Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.667 -0.778 . . . . 10.0 112.267 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -113.43 126.53 28.02 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 110.158 -0.312 . . . . 10.0 110.158 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.44 140.6 58.31 Favored 'Trans proline' 0 C--O 1.237 0.455 0 C-N-CA 122.524 2.149 . . . . 10.0 111.503 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 452' ' ' VAL . . . . . 0.442 HG11 HG12 ' A' ' 442' ' ' ILE . 85.4 t -125.28 126.62 71.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.246 -178.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 37.6 tp -112.99 107.75 16.41 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.781 -0.645 . . . . 10.0 109.352 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 20.8 t -93.72 126.0 46.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.266 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -106.56 109.48 3.11 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.7 -0.762 . . . . 10.0 111.996 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 2.7 p -97.66 142.15 29.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.733 0.302 . . . . 10.0 110.72 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 30.3 pt -84.39 -20.76 8.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.789 0.328 . . . . 10.0 111.229 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 458' ' ' SER . . . . . 0.487 ' HB3' ' OE2' ' A' ' 460' ' ' GLU . 57.7 m -134.38 145.43 48.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.962 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 459' ' ' ILE . . . . . 0.407 HG12 HG21 ' A' ' 504' ' ' THR . 16.8 mt -62.93 -33.86 62.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.249 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.487 ' OE2' ' HB3' ' A' ' 458' ' ' SER . 2.7 mp0 -59.03 -35.73 73.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.343 -0.844 . . . . 10.0 111.143 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.61 -29.11 51.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.751 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 9.8 m -63.45 -41.21 98.63 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.342 0.591 . . . . 10.0 110.067 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -68.46 -30.58 69.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.488 -0.778 . . . . 10.0 110.656 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 57.0 tp -70.64 -53.81 14.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.828 -0.624 . . . . 10.0 111.144 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 14.6 p -63.51 -31.4 52.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 120.884 0.374 . . . . 10.0 110.836 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.9 t -66.3 -38.35 87.53 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.881 0.372 . . . . 10.0 110.021 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -61.67 -49.19 77.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.764 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -65.12 -40.49 94.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.329 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 27.0 mt -61.69 -34.94 76.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.939 0.399 . . . . 10.0 110.329 179.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 23.4 m -72.26 -33.55 67.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.162 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -67.39 -37.37 83.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.455 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -77.62 -23.73 49.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.141 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 87.41 33.78 11.26 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.948 -0.644 . . . . 10.0 111.844 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 78.3 mt -100.68 131.19 48.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.669 0.271 . . . . 10.0 110.828 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -63.05 124.64 21.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.116 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 50.2 p-80 -154.85 159.42 40.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.802 0.334 . . . . 10.0 111.216 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . 0.462 ' ND2' HG21 ' A' ' 490' ' ' ILE . 8.5 t30 -141.37 132.77 26.73 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.166 178.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . 0.455 HG22 HD12 ' A' ' 502' ' ' ILE . 40.0 t -97.81 123.69 50.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.751 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.514 HD22 ' HG3' ' A' ' 487' ' ' GLU . 55.5 mt -81.36 146.48 30.31 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.419 -0.585 . . . . 10.0 109.419 179.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -157.78 135.78 10.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.124 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -60.04 -25.87 65.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.352 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -62.32 -33.44 74.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.231 0.539 . . . . 10.0 110.305 179.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -116.64 35.27 4.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.629 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -58.0 -24.86 59.94 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.289 -178.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -62.92 -42.97 99.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.928 0.395 . . . . 10.0 110.84 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -86.03 -28.24 24.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.956 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.514 ' HG3' HD22 ' A' ' 479' ' ' LEU . 19.0 tt0 -55.42 -40.32 71.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.22 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -57.92 -29.11 64.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.942 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -84.03 -36.54 23.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.128 0.49 . . . . 10.0 110.418 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' ILE . . . . . 0.462 HG21 ' ND2' ' A' ' 477' ' ' ASN . 53.9 mt -69.17 -45.93 78.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.095 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 71.9 t -61.09 -34.21 59.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.085 0.469 . . . . 10.0 110.946 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -65.91 -24.28 66.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.48 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' GLN . . . . . 0.474 ' NE2' ' H ' ' A' ' 518' ' ' SER . 53.7 mm-40 -115.44 16.84 16.63 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.826 0.346 . . . . 10.0 110.753 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.87 -12.97 61.85 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.402 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -89.19 7.69 81.53 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.781 -0.723 . . . . 10.0 112.211 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -69.84 141.53 89.91 Favored Pre-proline 0 C--N 1.328 -0.364 0 C-N-CA 122.319 0.248 . . . . 10.0 110.515 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -52.54 126.22 20.21 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.718 2.279 . . . . 10.0 113.04 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 67.92 24.92 7.88 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.487 -0.778 . . . . 10.0 112.57 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -94.88 110.28 22.18 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 10.0 110.261 178.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 38.6 t -92.16 109.71 21.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.106 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 1.2 m -116.4 130.16 56.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.799 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 502' ' ' ILE . . . . . 0.455 HD12 HG22 ' A' ' 478' ' ' VAL . 28.9 mt -105.6 115.26 47.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.042 -0.526 . . . . 10.0 109.734 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -103.67 111.3 23.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.907 0.384 . . . . 10.0 111.191 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 504' ' ' THR . . . . . 0.407 HG21 HG12 ' A' ' 459' ' ' ILE . 13.1 m -82.32 110.94 17.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.411 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 13.3 t30 62.79 91.61 0.07 Allowed 'General case' 0 N--CA 1.465 0.275 0 O-C-N 123.686 0.616 . . . . 10.0 111.0 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 1.3 mmt -75.05 113.8 12.8 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.762 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -64.95 168.71 6.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.98 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -58.98 142.11 46.63 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 121.165 -0.541 . . . . 10.0 113.026 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 69.26 -80.1 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.354 0.662 . . . . 10.0 111.502 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.17 143.42 11.4 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.732 -0.747 . . . . 10.0 112.165 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.81 147.02 35.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.905 0.383 . . . . 10.0 111.349 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -76.23 93.92 3.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.528 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 55.0 mt -69.55 121.85 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.482 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 7.4 t -90.27 133.52 31.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.671 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 61.2 mt -70.45 135.54 48.76 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.412 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 85.85 0.34 87.57 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.085 -0.579 . . . . 10.0 111.773 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 106.6 -170.0 15.83 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 110.784 -0.927 . . . . 10.0 110.784 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 518' ' ' SER . . . . . 0.474 ' H ' ' NE2' ' A' ' 493' ' ' GLN . 2.8 p -128.07 98.99 5.3 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 117.235 0.517 . . . . 10.0 110.918 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 33.2 p-90 -59.55 -28.47 67.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.076 0.465 . . . . 10.0 110.206 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -62.57 -32.26 73.22 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.646 -0.707 . . . . 10.0 110.681 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -85.12 -35.91 21.46 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.225 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -63.6 -45.56 89.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.899 -0.591 . . . . 10.0 111.013 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 33.8 m -70.74 -22.35 23.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.99 0.424 . . . . 10.0 110.806 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -81.13 -23.26 38.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.64 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -73.32 -21.83 60.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.532 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 91.7 mt -79.44 127.02 31.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.176 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -63.55 -33.76 76.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.299 0.571 . . . . 10.0 109.462 179.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -120.46 93.92 48.54 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 115.307 -0.861 . . . . 10.0 109.258 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -80.72 75.09 5.22 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.114 2.542 . . . . 10.0 111.956 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.97 144.6 55.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.598 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.97 -43.49 60.48 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.328 0.492 . . . . 10.0 112.328 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -59.8 -44.4 94.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.989 0.423 . . . . 10.0 110.949 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.08 -40.77 91.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.717 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 91.4 mt -60.92 -43.55 96.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -66.6 -41.86 87.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.319 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -62.04 -47.37 85.02 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.275 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 85.2 mt -66.29 -33.8 65.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.787 0.327 . . . . 10.0 110.544 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 31.4 ttmt -63.66 -49.81 71.73 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -66.37 -36.14 82.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.317 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . 0.6 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 19.7 t70 -62.9 -52.06 64.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.718 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 47.8 t90 -61.87 -37.96 86.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.866 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -50.98 -49.86 59.36 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.297 -0.41 . . . . 10.0 111.107 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 47.4 t -64.58 -45.1 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.994 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 544' ' ' ARG . . . . . 0.6 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 5.8 mtm180 -64.23 -35.79 81.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.936 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -68.94 -48.4 63.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.741 -0.663 . . . . 10.0 111.178 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -69.11 -26.01 64.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.626 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -65.46 -36.79 84.94 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.266 0.555 . . . . 10.0 109.576 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.2 -32.75 55.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.709 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 85.4 mt -61.84 -47.19 86.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.904 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -76.49 -18.9 58.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.737 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -75.4 -33.68 61.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.641 179.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 134.55 10.36 1.65 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.444 -0.884 . . . . 10.0 113.21 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 73.07 -168.28 53.74 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.859 -0.686 . . . . 10.0 112.672 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 40.9 tp -72.78 117.11 14.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.958 0.408 . . . . 10.0 110.078 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -92.7 113.79 26.16 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.011 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 10.9 mm -94.87 137.63 22.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.31 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 557' ' ' ILE . . . . . 0.486 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 23.7 mt -127.74 128.87 69.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.64 0.257 . . . . 10.0 110.343 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -106.8 120.25 6.18 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 111.404 -0.678 . . . . 10.0 111.404 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 17.3 p -74.71 -37.38 62.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.126 0.489 . . . . 10.0 110.907 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -138.61 140.76 39.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.081 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 561' ' ' ARG . . . . . 0.461 ' H ' HD21 ' A' ' 588' ' ' LEU . 23.4 mmt180 -82.81 141.39 32.34 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.74 151.15 23.64 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.9 -0.32 . . . . 10.0 110.377 -179.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -41.99 68.21 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 179.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 36.3 t -81.18 115.65 20.7 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.398 -0.819 . . . . 10.0 109.064 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -66.33 -27.87 68.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.657 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 566' ' ' ARG . . . . . 0.494 ' HA ' ' HB1' ' A' ' 394' ' ' ALA . 8.3 ttm180 -62.03 -37.09 83.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.064 0.459 . . . . 10.0 110.37 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 44.1 mt -88.71 -31.23 5.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.324 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -66.02 -44.77 83.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.185 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 569' ' ' ASN . . . . . 0.602 HD22 ' HA ' ' A' ' 394' ' ' ALA . 46.3 t30 -71.25 -23.64 62.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.885 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -63.2 -29.15 70.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.84 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 29.2 tp -72.1 -35.98 69.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.072 0.463 . . . . 10.0 110.167 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 572' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 572' ' ' ARG . 12.7 ttp180 -75.36 -31.09 60.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.256 0.55 . . . . 10.0 110.031 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -76.26 0.68 62.84 Favored Glycine 0 CA--C 1.519 0.303 0 CA-C-N 115.659 -0.701 . . . . 10.0 113.188 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.52 -33.35 72.68 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.794 0.33 . . . . 10.0 110.397 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 2.6 t -98.68 169.93 9.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.165 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 63.96 50.87 57.87 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.693 -0.765 . . . . 10.0 111.47 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 577' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' A' ' 580' ' ' ASP . 27.6 mtt180 -79.6 126.24 30.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.751 0.31 . . . . 10.0 110.996 -179.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 578' ' ' GLN . . . . . 0.601 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 7.4 tt0 56.76 32.6 21.51 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.626 -0.715 . . . . 10.0 110.746 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 78.18 43.08 14.06 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.797 -0.638 . . . . 10.0 112.651 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 580' ' ' ASP . . . . . 0.468 ' HB2' ' O ' ' A' ' 577' ' ' ARG . 0.9 OUTLIER -100.11 -170.3 1.86 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.714 0.292 . . . . 10.0 110.841 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 581' ' ' ALA . . . . . 0.437 ' HA ' HG13 ' A' ' 419' ' ' ILE . . . -83.89 172.37 12.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.114 -179.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 146.94 174.13 18.76 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.783 -0.723 . . . . 10.0 112.107 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 2.0 p -157.69 155.48 30.05 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.872 -0.418 . . . . 10.0 109.872 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 79.9 p -131.15 135.85 47.82 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.052 0.453 . . . . 10.0 110.578 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 585' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 1.6 tpm_? -139.29 116.97 11.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -108.47 148.02 30.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.99 0.424 . . . . 10.0 111.147 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 587' ' ' TYR . . . . . 0.535 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 84.4 m-85 -129.16 158.98 37.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.486 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 588' ' ' LEU . . . . . 0.628 ' HB2' HG22 ' A' ' 427' ' ' VAL . 13.2 mt -157.62 169.29 24.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.857 0.361 . . . . 10.0 110.922 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 589' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.7 OUTLIER -123.85 155.92 37.14 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.328 178.703 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 60.9 mmm -72.59 -15.22 61.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.292 0.568 . . . . 10.0 110.73 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 591' ' ' GLU . . . . . 0.41 ' H ' ' HG2' ' A' ' 591' ' ' GLU . 4.1 pt-20 -118.79 29.86 7.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.243 -0.89 . . . . 10.0 109.017 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 592' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 589' ' ' SER . 1.0 OUTLIER -82.25 176.96 9.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.188 -0.914 . . . . 10.0 111.798 -178.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.03 77.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.525 -0.761 . . . . 10.0 111.606 -179.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 594' ' ' LEU . . . . . 0.556 ' O ' HG12 ' A' ' 597' ' ' ILE . 5.2 tp -68.69 -21.74 64.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.859 0.361 . . . . 10.0 110.945 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 13.1 mmt -77.27 9.58 3.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.416 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -106.16 -12.69 15.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.642 0.258 . . . . 10.0 110.542 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 597' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 594' ' ' LEU . 18.8 pt -88.33 -1.71 8.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.855 0.36 . . . . 10.0 111.375 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -82.29 -9.15 59.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.964 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 69.84 -59.63 0.5 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.99 0.806 . . . . 10.0 111.908 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.5 m -88.79 115.03 26.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.713 0.292 . . . . 10.0 110.864 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -64.06 -23.3 67.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.197 0.522 . . . . 10.0 110.538 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 3.0 mmt180 -59.01 -24.48 62.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.481 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 76.4 t -68.17 -49.68 65.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 1.4 m -65.27 -36.94 85.66 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.551 -0.75 . . . . 10.0 110.0 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -63.47 -39.11 97.34 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.01 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 61.1 tpp -74.52 -27.92 60.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.121 0.486 . . . . 10.0 110.619 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 39.7 mtt -74.29 -18.94 60.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.347 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 74.5 mtt-85 -77.5 6.11 7.68 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.053 0.454 . . . . 10.0 110.704 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -94.76 2.58 55.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.859 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 77.1 mt -80.93 -9.79 59.79 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.343 -0.389 . . . . 10.0 111.037 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 611' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 83.85 -50.84 4.47 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.914 -0.66 . . . . 10.0 111.934 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 612' ' ' MET . . . . . 0.442 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.7 OUTLIER 73.66 -61.07 0.51 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.834 0.853 . . . . 10.0 111.847 179.145 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? 62.85 93.17 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.301 0 O-C-N 123.536 0.523 . . . . 10.0 110.603 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 614' ' ' PRO . . . . . 0.424 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 38.2 Cg_exo -57.09 94.94 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.136 2.558 . . . . 10.0 112.269 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 142.85 -29.47 2.1 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.831 -0.699 . . . . 10.0 111.916 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.59 140.66 37.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.943 0.402 . . . . 10.0 110.981 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -95.72 114.15 25.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.071 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.08 -37.62 78.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.795 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 51.78 74.67 0.25 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.763 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.97 105.23 20.39 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 120.86 0.362 . . . . 10.0 110.726 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.91 -21.27 25.67 Favored 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.659 2.906 . . . . 10.0 114.585 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 9.5 p-90 -60.43 -29.3 68.91 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 120.662 -0.415 . . . . 10.0 110.493 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 60.3 t -65.54 -48.85 81.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 85.1 m -61.36 -37.97 85.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.408 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -64.67 -42.47 95.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.122 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.09 94.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.641 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.1 -50.44 76.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.447 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -62.76 -35.73 80.76 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.116 0.484 . . . . 10.0 110.797 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 629' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' A' ' 633' ' ' LYS . 63.2 t30 -65.85 -44.56 85.12 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.849 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -67.15 -42.11 84.91 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.08 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -58.64 -40.54 83.68 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.379 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -61.57 -38.45 87.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.377 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 633' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 629' ' ' ASN . 26.1 mmtp -65.37 -37.79 88.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.166 -179.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 53.7 t -62.34 -47.1 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.081 0.467 . . . . 10.0 110.36 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -69.24 -35.78 76.48 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.67 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 49.1 m -64.63 -36.51 84.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.019 0.438 . . . . 10.0 110.04 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -67.89 -31.92 72.05 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -66.95 -38.14 85.58 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -65.02 -37.14 86.67 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.006 -0.543 . . . . 10.0 109.735 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 640' ' ' ASP . . . . . 0.633 ' O ' ' HG2' ' A' ' 644' ' ' GLN . 25.6 t0 -60.54 -35.84 76.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.636 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 59.1 mt -80.02 -38.57 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.325 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 642' ' ' ARG . . . . . 0.474 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 14.0 mtm-85 -61.71 -43.14 99.42 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.648 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 12.1 pttm -66.0 -26.88 67.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.868 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 644' ' ' GLN . . . . . 0.633 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 16.2 mm100 -65.03 -45.75 84.18 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 48.5 mt -65.63 -41.7 92.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.039 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 646' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 90.7 mt -63.5 -29.63 70.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.372 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.69 -28.32 69.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.078 0.465 . . . . 10.0 110.738 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -96.84 -28.28 14.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.621 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -75.38 -34.64 61.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.184 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 650' ' ' ASP . . . . . 0.505 ' O ' ' HB3' ' A' ' 653' ' ' ASN . 2.6 t0 -66.36 -23.51 66.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.13 0.49 . . . . 10.0 110.512 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 36.2 t -67.2 -42.01 87.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.319 0.58 . . . . 10.0 109.466 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -73.71 -22.5 59.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.473 -0.785 . . . . 10.0 109.912 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 653' ' ' ASN . . . . . 0.505 ' HB3' ' O ' ' A' ' 650' ' ' ASP . 18.1 t30 -61.39 -48.95 78.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.441 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -62.09 -46.85 87.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.62 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -62.67 -45.48 92.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.781 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 656' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 656' ' ' ARG . 11.2 ttp-105 -63.57 -40.76 97.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.332 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 30.9 ttp85 -61.74 -50.49 72.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.64 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -62.02 -49.08 77.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.732 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 659' ' ' ILE . . . . . 0.444 ' O ' ' HB2' ' A' ' 663' ' ' ARG . 8.7 tp -66.1 -34.52 70.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 116.628 -0.26 . . . . 10.0 111.6 -178.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -69.84 -34.21 73.33 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.731 0.301 . . . . 10.0 110.266 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.3 m -63.0 -54.26 41.05 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.112 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 662' ' ' GLN . . . . . 0.406 HE21 ' HB2' ' A' ' 662' ' ' GLN . 5.8 tt0 -62.12 -39.2 91.74 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.688 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 659' ' ' ILE . 2.2 tmt_? -60.44 -34.07 73.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.621 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -83.36 -37.75 22.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.714 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 665' ' ' GLU . . . . . 0.443 ' O ' HG22 ' A' ' 669' ' ' VAL . 35.3 mt-10 -57.86 -48.44 79.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.418 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 45.7 mt -72.21 -14.72 61.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.21 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 34.9 tp -86.16 -44.38 12.25 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.492 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -68.1 -53.94 21.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.898 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 665' ' ' GLU . 29.4 m -59.99 150.9 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 112.26 0.467 . . . . 10.0 112.26 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.57 -50.6 5.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.482 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -83.48 150.37 26.05 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.238 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 672' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 676' ' ' ILE . 6.6 p -141.07 8.74 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.051 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 15.4 m -49.84 -49.28 49.62 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.681 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.94 -51.85 67.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.767 -178.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 675' ' ' THR . . . . . 0.488 ' O ' HG12 ' A' ' 679' ' ' ILE . 2.0 m -60.48 -50.49 73.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.158 -0.474 . . . . 10.0 112.084 -179.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 676' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 672' ' ' VAL . 14.1 mm -62.13 -38.59 81.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 121.152 -0.219 . . . . 10.0 111.518 -178.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -68.36 -42.77 78.72 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.167 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 45.0 m -58.09 -44.03 87.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.911 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 679' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 675' ' ' THR . 24.3 pt -79.6 -24.71 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.953 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 18.8 mtm-85 -61.32 -50.45 72.91 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.147 0.499 . . . . 10.0 110.059 178.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.98 -35.4 74.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.377 -0.829 . . . . 10.0 110.692 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -66.03 -47.21 75.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.639 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 44.5 t -61.9 -45.75 98.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.189 -0.459 . . . . 10.0 111.444 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -59.78 -42.68 93.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.585 -0.28 . . . . 10.0 110.618 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -62.47 -46.01 90.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.09 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.59 99.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.472 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 21.0 m -65.22 -45.92 82.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.695 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.98 -39.32 85.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 10.0 110.253 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.31 -28.1 62.76 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.788 -0.642 . . . . 10.0 112.111 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -70.26 -22.9 62.83 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.479 0.548 . . . . 10.0 112.479 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -119.86 -19.33 7.97 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.704 0.288 . . . . 10.0 111.544 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 692' ' ' ILE . . . . . 0.425 HG23 ' CD1' ' A' ' 701' ' ' TRP . 42.8 mt -128.82 103.67 19.0 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.908 179.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -67.45 139.39 49.16 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.675 2.25 . . . . 10.0 111.745 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -50.23 106.27 0.12 Allowed 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.05 2.5 . . . . 10.0 113.215 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 61.7 86.99 0.1 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.478 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 2.3 p -142.9 -165.86 2.16 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.193 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 62.4 mt -99.17 161.79 13.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.465 0.174 . . . . 10.0 110.945 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . 0.543 ' HA ' ' CE3' ' A' ' 701' ' ' TRP . 15.0 tt0 -58.07 -31.27 66.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.314 -179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -66.13 -24.14 66.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.179 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 54.9 mtp -95.57 4.57 53.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.389 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 701' ' ' TRP . . . . . 0.543 ' CE3' ' HA ' ' A' ' 698' ' ' GLU . 50.2 m0 -103.2 111.88 24.48 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.733 0.301 . . . . 10.0 111.297 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -81.91 78.59 8.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.75 -0.833 . . . . 10.0 108.75 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 703' ' ' ILE . . . . . 0.557 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 44.5 mm -56.39 -51.9 77.35 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.243 -0.889 . . . . 10.0 111.951 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 704' ' ' PRO . . . . . 0.557 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 35.9 Cg_exo -60.65 -44.33 27.14 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.679 1.586 . . . . 10.0 111.836 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -61.1 -39.2 96.79 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.947 -0.644 . . . . 10.0 112.744 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 64.1 tp -78.1 -45.17 24.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.655 0.264 . . . . 10.0 111.392 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -59.67 -49.68 76.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.277 -0.42 . . . . 10.0 111.017 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -65.98 -30.3 70.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.88 0.372 . . . . 10.0 110.291 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 709' ' ' ARG . 5.2 tpt180 -62.74 -49.69 74.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.164 179.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 710' ' ' LEU . . . . . 0.411 HD12 HD11 ' A' ' 720' ' ' ILE . 65.3 mt -67.23 -29.25 68.84 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.007 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . 0.408 ' HG2' ' HA ' ' A' ' 717' ' ' ASP . 20.1 mtpp -78.13 -18.15 56.0 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.402 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -108.09 -53.3 2.65 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.1 -35.96 69.34 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.665 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -105.87 -12.57 15.8 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 121.061 -0.256 . . . . 10.0 111.348 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.43 24.08 13.98 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.887 -0.597 . . . . 10.0 112.261 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 23.7 tp -113.7 126.95 55.81 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.689 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 717' ' ' ASP . . . . . 0.408 ' HA ' ' HG2' ' A' ' 711' ' ' LYS . 1.5 t0 -81.03 100.71 9.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.792 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.417 HD13 HG23 ' A' ' 739' ' ' ILE . 95.3 mt -113.57 114.15 47.58 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.432 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.69 66.57 8.05 Favored 'Trans proline' 0 CA--C 1.536 0.575 0 C-N-CA 122.93 2.42 . . . . 10.0 112.665 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 720' ' ' ILE . . . . . 0.411 HD11 HD12 ' A' ' 710' ' ' LEU . 68.0 mt -60.5 -46.83 94.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.65 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -64.0 -31.19 72.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.918 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -69.87 -40.88 75.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.566 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 45.0 m0 -66.86 -54.14 25.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.672 -0.694 . . . . 10.0 111.477 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 16.9 tp -63.01 -18.57 63.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 10.0 112.144 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -77.88 -37.39 48.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.48 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -102.21 -25.97 13.5 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.131 0.419 . . . . 10.0 112.131 -178.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -122.11 78.58 42.73 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 121.01 0.433 . . . . 10.0 110.222 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -72.49 -9.05 23.61 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.845 2.363 . . . . 10.0 112.564 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -78.55 -10.84 59.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.836 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 93.4 mt -69.64 -29.37 66.83 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.222 0.534 . . . . 10.0 109.829 178.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 51.53 -95.64 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.624 -1.171 . . . . 10.0 112.147 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -56.01 0.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.611 0.243 . . . . 10.0 111.526 -178.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -56.38 -54.34 46.78 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.797 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.46 -27.22 68.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.027 0.441 . . . . 10.0 110.756 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 25.3 tp -67.39 -43.49 81.19 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 33.7 mtt180 -61.65 -40.23 94.16 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.996 -0.547 . . . . 10.0 109.642 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -60.28 -45.51 93.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.379 -0.828 . . . . 10.0 110.687 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 23.1 mmm-85 -61.08 -45.43 94.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.807 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 739' ' ' ILE . . . . . 0.417 HG23 HD13 ' A' ' 718' ' ' LEU . 97.0 mt -60.99 -52.78 57.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.707 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 21.1 tp -58.25 -46.33 86.16 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.789 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.61 99.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.376 -0.374 . . . . 10.0 111.181 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -62.98 -42.2 99.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.314 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.14 -41.71 98.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.701 0.286 . . . . 10.0 110.797 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 82.3 mt -67.05 -43.18 89.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.84 0.352 . . . . 10.0 110.232 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.97 -44.9 83.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.868 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 85.0 t -70.4 -40.22 77.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.716 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -59.19 -41.45 88.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.795 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -60.48 -31.54 70.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.439 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 749' ' ' ARG . . . . . 0.479 ' O ' HG23 ' A' ' 753' ' ' VAL . 0.1 OUTLIER -66.23 -45.8 79.41 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 179.16 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -64.77 -37.79 88.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.719 -0.673 . . . . 10.0 109.516 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.516 ' HA ' ' HG3' ' A' ' 759' ' ' MET . 27.1 tt0 -62.57 -41.78 99.15 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.17 -0.923 . . . . 10.0 110.963 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -63.22 -41.08 99.08 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.511 -0.313 . . . . 10.0 111.4 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 749' ' ' ARG . 39.6 t -67.22 -47.17 82.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.272 -0.422 . . . . 10.0 112.021 -179.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 39.7 t -77.26 -42.06 30.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.207 0.527 . . . . 10.0 111.106 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 120.51 122.55 2.96 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 110.527 -1.029 . . . . 10.0 110.527 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 756' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -51.01 -46.03 61.39 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.163 0.431 . . . . 10.0 112.163 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.61 -46.15 91.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.984 0.421 . . . . 10.0 110.949 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 15.6 tpt -66.62 -39.66 88.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.283 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 759' ' ' MET . . . . . 0.516 ' HG3' ' HA ' ' A' ' 751' ' ' GLU . 80.9 mmm -61.79 -41.24 97.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.211 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.9 mmp_? -60.29 -39.0 85.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.236 0.541 . . . . 10.0 110.119 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -73.2 -34.83 66.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.802 -0.635 . . . . 10.0 109.644 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 762' ' ' PHE . . . . . 0.415 ' O ' HG23 ' A' ' 766' ' ' VAL . 45.5 t80 -66.86 -48.21 69.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.318 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -57.19 -46.06 83.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.082 0.467 . . . . 10.0 110.294 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -60.73 -42.57 97.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.082 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -64.72 -43.3 96.5 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 111.408 -0.677 . . . . 10.0 111.408 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 766' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 762' ' ' PHE . 63.8 t -60.74 -43.23 94.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 11.9 mtp -60.96 -48.2 82.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.085 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 80.9 mt -60.55 -46.64 89.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.704 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -60.88 -52.68 64.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.361 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 9.4 m -60.2 -44.26 95.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.847 0.356 . . . . 10.0 111.358 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -64.32 -42.62 96.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.238 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 772' ' ' ASP . . . . . 0.621 ' O ' ' HG2' ' A' ' 776' ' ' LYS . 15.7 t70 -61.97 -51.27 68.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.806 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 68.5 m -59.12 -44.48 92.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.079 -0.51 . . . . 10.0 112.371 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 23.5 mt -66.53 -35.02 79.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.712 0.291 . . . . 10.0 111.113 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -64.38 -37.6 88.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.991 0.424 . . . . 10.0 110.009 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.621 ' HG2' ' O ' ' A' ' 772' ' ' ASP . 26.6 mmtp -66.63 -41.32 88.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.398 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -63.02 -48.25 79.59 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 778' ' ' HIS . . . . . 0.608 ' O ' ' HG2' ' A' ' 782' ' ' MET . 72.0 t60 -58.78 -35.97 73.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.034 -0.984 . . . . 10.0 111.199 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 21.3 mt -59.55 -47.92 83.66 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.872 0.368 . . . . 10.0 110.306 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -69.51 -38.61 77.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.165 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.32 -36.03 74.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.412 -0.813 . . . . 10.0 111.192 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 782' ' ' MET . . . . . 0.608 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 98.6 mmm -60.56 -41.16 94.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.048 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.93 -41.67 70.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 10.0 110.096 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -62.15 -42.01 98.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.286 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 11.6 tp -67.94 -39.34 83.46 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.154 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -55.12 -36.53 65.83 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.721 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.535 179.585 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo . . . . . 0 CA--C 1.528 0.193 0 N-CA-C 113.131 0.396 . . . . 10.0 113.131 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 28.1 mtmm -66.26 -55.23 17.15 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -63.64 -38.6 91.74 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.677 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.7 -48.39 82.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.04 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -59.91 -40.64 89.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.406 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -62.83 -47.81 81.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.792 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 37.0 ttp85 -62.44 -44.55 96.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.68 0.276 . . . . 10.0 111.002 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -58.5 -52.78 64.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.261 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 11.5 p -65.28 -39.56 92.74 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.297 0.481 . . . . 10.0 112.297 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -65.99 -44.68 84.14 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 121.032 -0.267 . . . . 10.0 110.89 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 17.5 m -65.71 -38.26 88.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.167 0.508 . . . . 10.0 110.102 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 35.0 ttm -63.85 -35.32 80.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.197 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -65.97 -38.9 89.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.271 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.88 92.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.353 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.46 73.86 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.468 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 17.7 ttp -64.53 -42.87 95.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.823 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 815' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 818' ' ' LEU . 81.0 mt -66.07 -36.27 82.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.414 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -64.57 -38.05 89.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.227 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 13.0 m -73.51 -30.14 62.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.105 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 818' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 815' ' ' LEU . 14.1 tp -58.77 -61.64 2.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.134 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 819' ' ' LYS . . . . . 0.415 ' O ' HG12 ' A' ' 823' ' ' ILE . 44.0 pttt -60.01 -36.24 76.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.011 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -60.08 -57.41 12.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.196 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -63.74 -37.67 88.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.836 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 41.1 t -57.91 -51.85 65.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.891 0.377 . . . . 10.0 110.71 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 823' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 819' ' ' LYS . 30.4 mm -68.22 -37.92 78.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.647 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 46.4 t -60.01 -48.42 81.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.169 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 24.6 m -60.43 -40.61 91.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.494 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 96.0 mt -69.65 -23.03 63.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.275 -0.421 . . . . 10.0 111.812 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 7.5 m -93.4 -36.42 12.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.801 0.334 . . . . 10.0 110.481 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 51.2 mttm -67.5 -28.3 67.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.783 -0.644 . . . . 10.0 112.133 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 6.6 p -65.51 112.13 1.68 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 121.573 0.701 . . . . 10.0 109.842 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -94.97 117.59 30.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.188 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 12.1 t . . . . . 0 C--N 1.321 -0.644 0 CA-C-N 115.559 -0.746 . . . . 10.0 109.214 179.335 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.2 t80 . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.667 0.27 . . . . 10.0 110.569 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.41 176.0 14.22 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.899 -0.667 . . . . 10.0 112.541 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.5 127.72 32.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.946 0.403 . . . . 10.0 110.506 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.581 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 8.7 mmt180 -70.22 144.52 51.86 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.62 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.6 m120 73.35 -63.13 0.44 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.097 -0.956 . . . . 10.0 112.059 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.94 -54.47 21.67 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -178.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -86.31 -25.86 25.22 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.966 0.728 . . . . 10.0 112.966 -178.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.0 p -60.61 -46.68 89.37 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.72 -0.392 . . . . 10.0 110.685 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.2 mt -64.46 -31.79 73.15 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.784 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -67.62 -45.78 74.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.072 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -67.4 -44.17 79.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.51 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 39.6 mtt -63.55 -34.04 76.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.88 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.5 tpp180 -61.32 -35.7 78.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.944 0.402 . . . . 10.0 110.304 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -65.52 -39.8 92.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.808 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -69.04 -39.45 79.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.915 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.42 HG13 HD12 ' A' ' 88' ' ' LEU . 52.7 t -58.33 -37.51 63.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 121.277 0.56 . . . . 10.0 109.935 178.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -65.45 -38.74 90.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.334 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 72.1 mt -66.64 -45.02 89.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.075 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.5 mt -59.33 -41.76 85.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.642 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -67.55 -27.69 67.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.074 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.25 -26.66 30.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.064 0.459 . . . . 10.0 110.597 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 8.6 tpt -83.95 -18.72 36.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.629 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.493 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 37.2 tt0 -56.98 -52.01 77.32 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.304 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.493 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 71.5 Cg_exo -53.47 -33.41 67.37 Favored 'Trans proline' 0 C--N 1.36 1.159 0 C-N-CA 121.927 1.751 . . . . 10.0 112.178 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -70.52 -40.31 73.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.168 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.3 mmt -66.59 -29.83 69.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.579 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -66.14 -23.09 66.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.562 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.0 mtpt -83.32 -24.2 32.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.046 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp -76.92 142.19 40.2 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.542 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.7 p -82.48 171.12 14.48 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.041 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -57.03 -38.78 73.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.312 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -68.43 -36.33 78.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.904 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.9 -32.11 70.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.285 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.98 -45.4 94.93 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -67.44 -31.45 71.63 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.951 -1.022 . . . . 10.0 109.725 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.81 -37.59 95.11 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.56 -0.746 . . . . 10.0 111.736 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -67.28 -36.26 81.18 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.724 -0.472 . . . . 10.0 109.724 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 19.1 m -58.18 -48.16 81.16 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.162 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.54 -35.25 80.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.342 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.18 -43.2 99.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.553 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -58.79 -43.06 90.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.738 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.7 mtp180 -61.81 -44.23 97.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.656 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' A' ' 56' ' ' LYS . . . -66.67 -39.41 88.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.267 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 -62.83 -39.29 93.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.555 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 mt -58.09 -37.36 74.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.317 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.15 -37.14 72.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.321 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 52' ' ' ALA . 28.4 mtpp -72.72 -9.19 58.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.958 -0.565 . . . . 10.0 111.204 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.67 61.67 0.66 Allowed Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.757 -0.735 . . . . 10.0 111.983 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -116.91 146.1 43.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.718 -0.475 . . . . 10.0 109.718 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 38.2 t -85.84 133.18 30.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.182 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.417 HD11 ' O ' ' A' ' 118' ' ' LEU . 17.8 tp -61.09 -43.89 98.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.918 0.389 . . . . 10.0 110.464 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -65.83 -21.54 66.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.17 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -81.23 -17.36 49.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.243 0.544 . . . . 10.0 110.151 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.1 mt -84.65 -13.29 51.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.079 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.51 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 73.9 mt -50.23 -52.55 52.91 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 113.054 0.761 . . . . 10.0 113.054 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.51 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.0 Cg_exo -53.46 -34.77 73.35 Favored 'Trans proline' 0 C--N 1.36 1.151 0 C-N-CA 122.362 2.041 . . . . 10.0 113.444 -179.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.471 ' O ' HG23 ' A' ' 70' ' ' VAL . 38.4 mt-10 -89.58 -46.59 8.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.46 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.482 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -58.8 -47.92 83.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.996 -178.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -63.33 -32.34 73.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.675 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.91 -43.63 78.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.257 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 66' ' ' GLU . 58.3 t -61.08 -47.72 92.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.107 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 67' ' ' ALA . 46.7 t -59.5 -45.21 94.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.34 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.431 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 19.0 ttm180 -61.0 -44.86 96.8 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.604 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 29.1 tp10 -61.05 -48.4 81.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.376 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.99 -33.27 74.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.079 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 29.8 m -61.04 -35.89 78.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.746 0.307 . . . . 10.0 111.059 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -75.06 -16.89 60.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.296 -0.411 . . . . 10.0 112.028 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -104.24 -35.83 7.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.762 0.315 . . . . 10.0 111.518 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 92.8 t -81.41 -52.52 13.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.614 -0.266 . . . . 10.0 111.64 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -104.22 -14.05 15.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.656 0.265 . . . . 10.0 111.562 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.22 29.09 66.96 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.714 -0.755 . . . . 10.0 111.552 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.5 mtt -126.49 141.23 51.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.799 0.333 . . . . 10.0 110.791 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 37.0 ttt85 -85.59 122.67 30.03 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.95 111.06 1.52 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -47.23 141.12 4.76 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 124.139 0.9 . . . . 10.0 112.307 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -64.17 -34.42 78.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.338 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 m -69.58 -25.19 28.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.847 0.355 . . . . 10.0 110.839 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -71.67 -28.4 63.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.826 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.42 HD12 HG13 ' A' ' 25' ' ' VAL . 85.2 mt -62.03 -36.78 82.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.055 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 36.0 mt -66.15 -47.88 72.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.826 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -63.14 -36.45 93.46 Favored Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.712 -0.677 . . . . 10.0 112.164 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.76 -34.57 89.12 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.195 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.416 ' HG3' ' O ' ' A' ' 88' ' ' LEU . 38.4 mtt -74.21 -35.87 63.93 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.2 t -65.47 -43.05 94.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 10.0 110.02 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 84.3 mt -72.92 -5.35 37.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.268 -0.878 . . . . 10.0 111.966 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -83.29 -24.67 32.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.892 0.377 . . . . 10.0 110.383 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -103.37 -146.33 0.37 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.585 -179.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 97' ' ' ARG . 28.7 ttt85 -108.07 58.98 0.61 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.168 0.509 . . . . 10.0 110.189 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 408' ' ' ASP . 0.0 OUTLIER -137.57 150.19 47.28 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.335 0.588 . . . . 10.0 111.981 -178.862 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.552 HD12 HG11 ' A' ' 211' ' ' VAL . 50.7 mm -93.46 132.55 37.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.373 -0.831 . . . . 10.0 108.881 178.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -107.6 120.11 41.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.735 0.302 . . . . 10.0 111.703 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -85.47 125.68 33.22 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.4 mtm -122.48 140.6 52.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.076 0.465 . . . . 10.0 110.886 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.497 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 11.5 mmm180 -77.1 152.19 35.08 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.563 -0.744 . . . . 10.0 111.082 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.65 94.68 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.9 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.2 -33.48 1.23 Allowed Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.824 -0.703 . . . . 10.0 112.353 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.623 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 2.2 mm-40 -65.56 -49.42 68.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.013 0.435 . . . . 10.0 110.292 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 143.79 168.03 12.08 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.753 -0.737 . . . . 10.0 112.085 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.97 -82.63 0.65 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.93 0.395 . . . . 10.0 110.461 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.03 -20.86 66.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.166 0.508 . . . . 10.0 111.117 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 27.7 tp -70.02 -19.96 63.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.252 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 3.2 m -95.72 -36.6 11.13 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.194 0.521 . . . . 10.0 110.654 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.624 ' HB1' HD21 ' A' ' 207' ' ' LEU . . . -75.98 -4.66 42.35 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.863 0.69 . . . . 10.0 112.863 -178.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.06 -24.28 61.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.947 0.403 . . . . 10.0 111.27 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.409 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 17.7 mt -71.15 -57.13 4.95 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-N 116.11 -0.495 . . . . 10.0 111.795 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 29.4 Cg_endo -61.92 -30.62 83.98 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 122.17 1.914 . . . . 10.0 112.222 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.55 -47.16 73.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.635 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.434 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 65.4 t80 -61.25 -46.15 91.59 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.068 0.461 . . . . 10.0 110.477 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.417 ' O ' HD11 ' A' ' 60' ' ' LEU . 20.5 tp -61.86 -50.39 72.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.629 -0.714 . . . . 10.0 112.007 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -68.2 -28.42 67.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.24 -28.51 67.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.396 0.141 . . . . 10.0 111.34 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 85.9 mt -55.38 -29.24 58.08 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 76.7 p -66.29 -26.82 67.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.632 -0.258 . . . . 10.0 111.363 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.36 -1.33 87.41 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.389 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -76.53 -21.41 55.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.717 0.294 . . . . 10.0 110.953 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 101.12 138.04 10.05 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.708 -0.758 . . . . 10.0 113.778 178.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 68.4 t -107.04 121.39 59.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -98.41 102.7 14.52 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.67 0.271 . . . . 10.0 110.782 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 26.2 t -95.59 125.06 48.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.905 0.384 . . . . 10.0 110.447 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 79.3 t -110.48 117.59 55.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.453 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.87 160.76 14.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.955 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 13.2 m -67.24 -35.25 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -145.63 161.35 40.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.518 -0.31 . . . . 10.0 110.187 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -67.37 -28.83 68.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.697 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -55.3 -53.7 52.83 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.132 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.3 mt -74.23 -32.92 63.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.877 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -53.83 -49.98 67.19 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.833 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -72.1 -36.41 69.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.856 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 17.6 ttp180 -62.61 -59.64 4.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.966 -0.561 . . . . 10.0 112.13 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.63 -29.31 69.32 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.667 -178.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.45 88.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 10.0 110.55 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -75.8 -26.0 56.88 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.154 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . 0.435 ' O ' ' HD2' ' A' ' 145' ' ' PRO . 11.3 t30 -73.43 -40.82 63.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.021 0.439 . . . . 10.0 110.634 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -86.92 -6.81 58.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.367 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.512 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 61.7 ttm-85 -60.01 -49.46 91.06 Favored Pre-proline 0 CA--C 1.537 0.467 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' PRO . . . . . 0.512 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 34.1 Cg_exo -63.81 -10.37 22.25 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 122.155 1.903 . . . . 10.0 112.886 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 20.3 tp -96.07 -48.92 5.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.935 0.398 . . . . 10.0 110.424 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -71.54 -51.11 25.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.012 -0.54 . . . . 10.0 112.18 -178.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -65.27 -23.48 67.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.677 0.275 . . . . 10.0 111.438 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -67.17 -28.92 68.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.105 0.479 . . . . 10.0 110.037 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 43.9 mt -96.9 -2.41 43.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.006 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 98.82 22.8 12.81 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.598 -0.811 . . . . 10.0 113.502 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 43.2 mt -109.76 121.8 46.05 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.7 p -78.4 130.32 35.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.016 0.436 . . . . 10.0 112.024 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 48.3 t -104.74 127.88 58.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.933 -0.576 . . . . 10.0 109.971 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -123.02 142.72 14.73 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.613 -0.803 . . . . 10.0 112.264 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 6.6 tp -112.85 134.55 55.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -121.34 110.29 15.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.856 0.36 . . . . 10.0 110.247 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 161' ' ' MET . 94.1 mt -102.4 147.75 34.44 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.617 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' PRO . . . . . 0.519 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 16.7 Cg_endo -58.49 114.26 1.91 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.7 2.267 . . . . 10.0 112.232 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 99.63 6.96 54.36 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.771 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . 0.49 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.1 OUTLIER -67.27 144.8 98.36 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 110.529 -0.174 . . . . 10.0 110.529 179.57 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -57.3 149.56 64.0 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.635 2.223 . . . . 10.0 112.301 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . 0.507 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.09 -49.86 82.03 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 112.769 0.655 . . . . 10.0 112.769 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.507 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 53.0 Cg_exo -57.15 -41.39 74.66 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 121.774 1.65 . . . . 10.0 112.029 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -63.08 -44.42 95.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.661 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.459 ' HE2' ' O ' ' A' ' 161' ' ' MET . 59.6 mttm -60.86 -45.44 94.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.432 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -57.83 -42.69 84.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.821 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 164' ' ' PRO . 58.2 mt-10 -66.28 -39.12 89.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.784 0.326 . . . . 10.0 111.024 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -69.44 -42.56 74.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.584 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -74.7 -31.2 61.8 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.449 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.12 3.26 18.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.882 0.372 . . . . 10.0 110.832 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -84.59 -179.17 7.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.148 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -79.22 -42.59 25.62 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.1 mp -128.78 121.51 54.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.281 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.7 m -108.74 123.34 48.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.84 0.352 . . . . 10.0 111.353 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -102.71 131.26 49.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.747 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.62 176.74 44.05 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.568 -0.825 . . . . 10.0 112.202 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.79 155.79 16.63 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.77 0.319 . . . . 10.0 111.158 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -59.99 -35.4 74.95 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.237 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -55.63 -57.87 10.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.037 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.519 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.6 tp10 -69.53 -36.61 76.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.381 -178.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -58.1 -38.87 77.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.904 0.383 . . . . 10.0 111.308 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -78.23 -42.4 15.29 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.715 -0.755 . . . . 10.0 111.921 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -64.56 -38.17 90.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.767 0.318 . . . . 10.0 111.077 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 185' ' ' ASP . . . . . 0.412 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 10.9 m-20 -60.6 -41.55 94.98 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.47 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -64.51 -38.33 90.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.411 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 18.6 mt -63.85 -44.78 92.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.777 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 39.0 mtm-85 -72.03 -36.05 69.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.868 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -64.14 -47.29 80.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.287 0.565 . . . . 10.0 110.917 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.69 -8.91 57.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.804 -0.634 . . . . 10.0 112.258 -178.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 17.8 ttp -101.08 14.71 31.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.169 0.509 . . . . 10.0 110.75 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -76.42 160.13 29.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.843 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -102.69 -24.16 13.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.176 0.513 . . . . 10.0 110.029 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 67.7 m -129.0 140.84 39.8 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.716 -0.674 . . . . 10.0 109.625 178.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.0 -24.96 75.83 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.847 2.364 . . . . 10.0 112.846 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.83 -9.35 58.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.585 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -91.66 -6.93 51.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.854 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 198' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 198' ' ' ARG . 19.4 mtt85 -58.97 155.94 12.52 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.148 0.499 . . . . 10.0 111.875 -179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 16.1 m -137.43 -16.29 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.514 -0.766 . . . . 10.0 111.047 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -84.87 -178.5 6.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.324 0.583 . . . . 10.0 111.799 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -143.02 177.22 8.51 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.218 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 32.9 tttm -60.88 133.74 56.39 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.203 0.525 . . . . 10.0 111.201 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 17.4 mt -84.94 69.93 10.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.612 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . 0.409 ' HA ' ' OE2' ' A' ' 385' ' ' GLU . 18.3 t-80 -81.09 -64.66 1.14 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.905 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -124.69 133.76 53.1 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.935 0.397 . . . . 10.0 111.288 -178.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.582 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -119.99 123.3 43.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.626 179.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 207' ' ' LEU . . . . . 0.624 HD21 ' HB1' ' A' ' 112' ' ' ALA . 53.6 tp -117.09 100.36 7.68 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.073 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -94.04 128.59 45.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.052 0.454 . . . . 10.0 110.579 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -55.99 -72.15 0.08 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.324 -0.853 . . . . 10.0 111.905 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.39 105.45 13.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.638 0.256 . . . . 10.0 110.681 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.552 HG11 HD12 ' A' ' 99' ' ' ILE . 27.4 m -68.38 -22.32 27.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.537 -0.302 . . . . 10.0 111.178 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 212' ' ' ASP . . . . . 0.567 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.2 m-20 -45.04 -64.08 0.79 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.026 0.828 . . . . 10.0 111.878 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . 0.449 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 68.7 m -96.62 -37.08 10.5 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.801 0.667 . . . . 10.0 112.801 -178.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 73.4 mt -64.21 -38.62 82.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -178.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 12.7 mt -102.25 -50.82 3.52 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 216' ' ' ILE . . . . . 0.567 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 50.5 mm -73.62 -56.31 9.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.979 0.733 . . . . 10.0 112.979 -177.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 217' ' ' ASP . . . . . 0.449 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 79.0 m-20 -63.45 -45.74 89.47 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.133 0.42 . . . . 10.0 112.133 -178.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -93.26 28.91 2.05 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -66.97 -48.38 68.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.972 0.415 . . . . 10.0 111.644 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 220' ' ' ARG . . . . . 0.41 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -98.59 18.8 15.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.063 -179.007 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 85.0 m -84.57 113.0 46.41 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.319 -0.401 . . . . 10.0 110.465 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -92.82 135.1 1.25 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.806 2.337 . . . . 10.0 113.17 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 223' ' ' LEU . . . . . 0.642 ' O ' ' HA ' ' A' ' 374' ' ' SER . 96.9 mt -94.48 120.17 34.3 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 21.6 mt -113.99 132.76 62.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.241 0.46 . . . . 10.0 112.241 -178.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 27.9 mt . . . . . 0 C--N 1.327 -0.381 0 N-CA-C 108.767 -0.827 . . . . 10.0 108.767 177.802 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.279 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 374' ' ' SER . . . . . 0.642 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 1.4 t -156.41 142.55 18.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.115 0.483 . . . . 10.0 111.516 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 14.3 tt -146.9 147.39 17.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.794 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.96 142.37 30.54 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -56.74 -49.18 76.0 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 123.036 0.21 . . . . 10.0 111.215 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 378' ' ' GLN . . . . . 0.441 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.5 tm0? -57.07 -43.89 82.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.028 0.442 . . . . 10.0 110.715 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -73.54 -11.36 60.42 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.72 -0.673 . . . . 10.0 111.768 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -93.69 -44.88 7.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.911 0.386 . . . . 10.0 110.329 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -69.36 -21.7 63.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.136 -0.483 . . . . 10.0 111.313 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -72.88 -4.18 30.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.134 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 56.9 mt -97.42 8.57 44.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.937 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . 0.582 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 27.6 m-85 -99.17 146.44 26.15 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.818 0.342 . . . . 10.0 110.793 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 385' ' ' GLU . . . . . 0.409 ' OE2' ' HA ' ' A' ' 204' ' ' HIS . 34.4 mt-10 -70.37 -65.8 0.68 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.091 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -102.63 104.09 14.43 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.45 HD23 HD21 ' A' ' 407' ' ' LEU . 61.5 tp -110.72 110.61 21.33 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.641 -179.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -131.92 165.66 23.41 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.783 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -163.84 162.7 35.31 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.403 -0.903 . . . . 10.0 112.409 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 63.3 mtm -107.82 156.85 18.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.989 0.424 . . . . 10.0 110.399 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 391' ' ' THR . . . . . 0.41 ' HB ' HG22 ' A' ' 211' ' ' VAL . 15.3 t -153.59 165.68 35.15 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.21 179.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -101.9 -171.25 27.58 Favored Glycine 0 N--CA 1.441 -1.006 0 N-CA-C 110.613 -0.995 . . . . 10.0 110.613 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 393' ' ' THR . . . . . 0.497 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 3.1 m -74.67 66.26 1.43 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.536 0.684 . . . . 10.0 110.589 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . 0.533 ' HB1' ' HG2' ' A' ' 566' ' ' ARG . . . -102.76 -45.72 4.92 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.125 -0.943 . . . . 10.0 110.274 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 395' ' ' ASP . . . . . 0.426 ' CG ' ' H ' ' A' ' 396' ' ' THR . 10.0 t70 56.78 -144.35 0.66 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.615 -0.721 . . . . 10.0 110.214 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 396' ' ' THR . . . . . 0.426 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 3.0 m 70.02 -79.88 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.851 0.686 . . . . 10.0 112.851 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -79.31 26.98 0.26 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 10.0 111.683 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 398' ' ' ALA . . . . . 0.465 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -66.21 -35.89 81.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.138 0.494 . . . . 10.0 110.992 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -72.76 -15.58 61.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.598 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -83.88 -21.32 31.99 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.651 -0.25 . . . . 10.0 111.047 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 401' ' ' PHE . . . . . 0.465 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 24.7 m-85 -59.61 -46.67 88.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.056 0.455 . . . . 10.0 110.546 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.55 -0.15 36.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.733 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.3 m -108.26 -43.71 4.3 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.772 0.286 . . . . 10.0 111.772 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 44.6 mt -86.41 -55.18 6.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 405' ' ' TYR . . . . . 0.441 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 60.8 m-85 -100.04 -4.81 29.14 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 31.4 mmtt 60.98 51.09 4.69 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.365 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 407' ' ' LEU . . . . . 0.476 HD13 HD11 ' A' ' 99' ' ' ILE . 26.4 mt -117.65 149.77 40.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.896 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 408' ' ' ASP . . . . . 0.581 ' OD2' ' HD2' ' A' ' 13' ' ' ARG . 21.0 t70 -85.2 170.25 13.04 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 18.2 m -138.71 120.73 15.59 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.835 -0.541 . . . . 10.0 111.605 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 14.0 t -127.35 137.11 58.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.326 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 87.4 t -93.45 133.33 34.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.648 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 59.2 t -91.3 127.07 52.52 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.795 -0.446 . . . . 10.0 109.795 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.66 142.1 69.18 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.522 2.148 . . . . 10.0 112.634 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' A' ' 416' ' ' ARG . 0.2 OUTLIER -64.1 151.55 42.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.584 -0.735 . . . . 10.0 111.604 -179.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -70.0 -26.85 64.27 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.178 0.514 . . . . 10.0 110.492 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 416' ' ' ARG . . . . . 0.509 ' HB2' ' O ' ' A' ' 578' ' ' GLN . 58.3 mtm180 -134.14 157.9 76.55 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.84 122.49 11.06 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.28 1.987 . . . . 10.0 111.445 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 3.8 mtm -76.53 100.42 5.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.034 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.6 pt -95.24 51.39 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.303 0.573 . . . . 10.0 110.602 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 30.4 ttp-105 -94.2 116.02 28.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.494 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -84.43 105.04 14.95 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.148 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -88.54 112.47 23.05 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 26.5 mt -93.06 150.62 39.53 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.547 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -62.68 163.69 20.75 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.52 2.147 . . . . 10.0 112.381 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -83.7 133.97 34.78 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.937 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 31.3 mt -105.88 94.72 5.33 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.148 0.499 . . . . 10.0 110.389 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 427' ' ' VAL . . . . . 0.641 HG22 ' HB3' ' A' ' 588' ' ' LEU . 21.8 t -90.24 119.43 37.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.345 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 428' ' ' TYR . . . . . 0.533 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 3.3 m-85 -105.22 177.86 4.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.043 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 8.8 mmm -77.21 -77.62 0.14 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.862 -0.335 . . . . 10.0 111.409 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 41.4 p -86.09 165.65 16.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.972 0.415 . . . . 10.0 111.431 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 431' ' ' GLU . . . . . 0.448 ' O ' HG12 ' A' ' 435' ' ' ILE . 2.9 tp10 -62.44 -40.17 95.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.691 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.97 82.01 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.129 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -60.96 -42.03 97.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.272 0.558 . . . . 10.0 109.972 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 434' ' ' LYS . . . . . 0.54 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 28.4 ttpt -65.79 -52.42 50.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.369 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 435' ' ' ILE . . . . . 0.602 ' O ' HG12 ' A' ' 439' ' ' ILE . 32.3 mm -61.04 -44.1 97.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.342 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.56 -36.99 74.77 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.72 0.295 . . . . 10.0 110.985 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.91 -37.36 70.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.312 179.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 438' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 434' ' ' LYS . 81.1 mt -62.65 -45.59 98.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.155 179.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 439' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 435' ' ' ILE . 37.8 mm -59.89 -39.95 81.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.6 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -65.66 -43.78 88.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.601 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -60.35 -40.75 91.86 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.167 0.508 . . . . 10.0 110.136 179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.414 HG12 HG11 ' A' ' 452' ' ' VAL . 71.9 mt -70.74 -42.48 77.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.724 179.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -60.07 -42.52 94.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.035 -0.529 . . . . 10.0 111.147 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -73.38 0.79 11.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.159 -0.473 . . . . 10.0 112.202 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 70.3 mtt-85 -117.41 -31.25 5.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.855 0.359 . . . . 10.0 110.917 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.19 -28.31 65.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.229 0.538 . . . . 10.0 109.859 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -80.82 -3.47 51.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.38 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -108.89 -38.85 5.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.876 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 121.05 18.6 3.8 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.722 -0.752 . . . . 10.0 113.004 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -98.5 125.51 42.68 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 122.541 -0.388 . . . . 10.0 111.081 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.12 144.96 48.18 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.767 2.311 . . . . 10.0 111.226 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 452' ' ' VAL . . . . . 0.414 HG11 HG12 ' A' ' 442' ' ' ILE . 84.0 t -125.62 128.04 72.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.978 0.418 . . . . 10.0 111.464 -178.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 58.2 tp -108.46 111.2 22.96 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.182 -0.673 . . . . 10.0 109.182 178.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 47.5 t -94.72 124.42 47.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.523 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -111.3 114.52 3.68 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.839 -0.696 . . . . 10.0 111.898 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 22.8 p -106.17 145.21 31.81 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.712 0.291 . . . . 10.0 110.882 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 23.1 pt -92.71 -2.63 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.781 0.324 . . . . 10.0 111.142 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 59.5 m -149.66 141.48 23.69 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.433 -0.348 . . . . 10.0 110.234 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 17.1 mt -61.69 -34.38 61.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-O 121.111 0.482 . . . . 10.0 110.603 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -56.89 -40.31 75.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.539 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.407 ' HG2' ' OE2' ' A' ' 560' ' ' GLU . 0.6 OUTLIER -71.36 -33.53 69.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.475 179.833 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.5 m -62.44 -48.08 81.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.352 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -62.55 -37.78 87.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.203 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 55.8 tp -62.94 -54.85 32.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.341 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.5 p -65.7 -32.65 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.621 -0.263 . . . . 10.0 111.632 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 60.0 m -65.68 -37.56 86.82 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.777 0.322 . . . . 10.0 110.644 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -64.41 -48.47 75.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.523 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . 0.519 ' HG3' HG21 ' A' ' 435' ' ' ILE . 20.9 mm-40 -61.91 -41.24 97.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.122 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 26.4 mt -60.91 -36.05 78.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.675 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.3 m -70.45 -34.89 72.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.11 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 42.5 mtpt -63.98 -37.21 86.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.336 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.48 -16.68 51.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.129 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 81.47 29.02 41.43 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.307 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 60.9 mt -94.64 121.31 45.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 110.263 -0.273 . . . . 10.0 110.263 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -59.16 125.67 24.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.658 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 53.0 p-80 -148.6 151.59 35.29 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.762 -178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -134.8 141.06 46.32 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.4 t -105.81 131.29 55.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.818 0.342 . . . . 10.0 110.836 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.45 HD12 ' HB2' ' A' ' 503' ' ' ALA . 67.8 mt -73.08 105.53 4.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.107 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.89 123.84 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.48 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -82.58 -8.82 59.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.043 -0.526 . . . . 10.0 112.209 -178.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -92.85 -53.09 4.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.174 0.512 . . . . 10.0 110.014 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -102.49 96.61 7.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.37 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' HIS . . . . . 0.425 ' HA ' ' HB3' ' A' ' 487' ' ' GLU . 9.9 m170 -66.6 -15.48 63.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.685 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -57.98 -49.26 77.44 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.032 0.444 . . . . 10.0 110.6 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' ASN . . . . . 0.495 ' O ' HG13 ' A' ' 490' ' ' ILE . 64.8 t30 -72.56 -41.52 65.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.73 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.425 ' HB3' ' HA ' ' A' ' 484' ' ' HIS . 1.7 tt0 -55.36 -57.14 13.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.575 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -57.94 -34.2 69.64 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.571 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -67.88 -41.84 82.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.776 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 486' ' ' ASN . 45.7 mt -69.5 -45.81 77.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.809 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 487' ' ' GLU . 89.8 t -56.22 -38.38 54.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.402 -179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -60.82 -26.47 67.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.743 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -124.3 27.61 6.98 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.818 0.342 . . . . 10.0 110.721 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -73.72 -19.81 60.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.124 0.487 . . . . 10.0 110.943 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -90.58 10.39 74.74 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.669 -0.777 . . . . 10.0 112.023 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -67.26 140.29 95.33 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 110.269 -0.271 . . . . 10.0 110.269 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -51.9 123.91 13.47 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.616 2.211 . . . . 10.0 112.918 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 63.62 39.96 8.37 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.388 -0.824 . . . . 10.0 112.483 178.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -109.03 118.86 37.89 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 37.1 t -97.07 112.81 29.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.029 0.442 . . . . 10.0 110.426 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.8 m -111.91 128.37 56.12 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.41 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 43.4 mt -109.34 124.76 66.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.896 0.379 . . . . 10.0 110.328 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . 0.45 ' HB2' HD12 ' A' ' 479' ' ' LEU . . . -120.45 128.98 53.67 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.865 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 14.4 m -103.86 120.75 41.65 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.578 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 58.49 77.19 0.31 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.368 0.604 . . . . 10.0 110.453 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.56 133.3 34.45 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.449 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.67 -178.37 4.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.806 -0.633 . . . . 10.0 110.945 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -73.07 164.15 54.93 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.166 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 68.89 -75.44 0.07 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.116 0.567 . . . . 10.0 111.34 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 84.24 143.86 6.05 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.976 -0.631 . . . . 10.0 112.095 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.93 150.73 23.55 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.853 0.359 . . . . 10.0 111.463 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -75.67 95.93 3.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.014 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 71.4 mt -85.47 115.71 27.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.986 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 19.0 t -90.51 140.15 16.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.94 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 61.0 mt -67.91 128.85 38.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.302 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 87.28 9.11 73.59 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.438 -0.665 . . . . 10.0 111.438 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 91.8 -171.7 34.79 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 111.064 -0.814 . . . . 10.0 111.064 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 25.5 p -128.65 110.59 12.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.121 0.46 . . . . 10.0 110.441 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 61.7 p-90 -59.31 -25.32 64.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.568 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -41.63 91.44 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.451 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -73.23 -32.8 64.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.921 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -70.06 -47.49 61.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.194 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.8 m -68.14 -25.5 32.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.937 0.398 . . . . 10.0 110.232 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -80.52 -8.58 59.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.574 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -97.19 10.08 40.42 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.276 0.56 . . . . 10.0 110.645 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 70.8 mt -105.16 141.18 37.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.941 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 48.8 mp0 -73.99 -33.05 63.68 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.248 0.547 . . . . 10.0 109.769 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -137.96 82.08 26.18 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.547 -0.751 . . . . 10.0 109.692 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -78.18 95.01 1.06 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.835 2.357 . . . . 10.0 111.734 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 1.4 p -77.69 160.15 28.66 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.68 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.08 -44.12 70.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 10.0 111.437 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -63.55 -39.95 95.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.437 -0.347 . . . . 10.0 111.238 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.71 -42.37 95.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.669 0.271 . . . . 10.0 110.65 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 92.3 mt -59.88 -44.77 95.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.192 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.19 -36.97 69.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.149 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -64.26 -47.63 78.85 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.583 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 87.9 mt -64.04 -40.41 88.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.652 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -60.78 -37.63 82.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.826 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -65.32 -39.83 92.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.725 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.43 -40.02 67.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.013 -0.54 . . . . 10.0 109.978 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 56.8 t90 -57.69 -40.34 79.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.68 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 64.6 tp60 -56.43 -42.74 78.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.497 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.5 -44.67 93.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.451 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -69.93 -37.49 75.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.8 -0.637 . . . . 10.0 110.525 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 17.6 t-80 -61.26 -51.18 70.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.855 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -68.19 -31.36 70.84 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.639 -0.71 . . . . 10.0 111.312 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -63.67 -36.24 83.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.161 0.505 . . . . 10.0 110.179 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 71.7 t -78.74 -40.1 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.466 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 19.4 tp -59.3 -48.02 83.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.543 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -78.48 2.32 19.38 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.613 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -101.15 -5.06 26.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.808 0.337 . . . . 10.0 110.979 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 116.71 3.31 18.47 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.639 -0.791 . . . . 10.0 112.861 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 75.04 -162.5 53.81 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.993 -0.622 . . . . 10.0 112.632 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 44.3 tp -73.89 120.5 19.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.875 0.369 . . . . 10.0 110.576 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -94.47 123.28 37.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.999 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 36.7 mm -103.2 129.63 54.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.264 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 557' ' ' ILE . . . . . 0.4 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 10.7 mt -123.84 118.22 53.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.923 0.392 . . . . 10.0 110.207 178.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.16 118.27 5.81 Favored Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 111.28 -0.728 . . . . 10.0 111.28 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 18.8 p -68.89 -38.83 79.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.144 0.497 . . . . 10.0 110.195 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . 0.407 ' OE2' ' HG2' ' A' ' 461' ' ' LYS . 28.0 mp0 -144.34 158.86 43.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.124 -0.944 . . . . 10.0 109.638 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 561' ' ' ARG . . . . . 0.44 ' H ' HD22 ' A' ' 594' ' ' LEU . 93.0 mtt-85 -104.89 -160.12 0.74 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.62 -0.881 . . . . 10.0 108.62 178.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -152.32 150.92 30.26 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.769 -0.372 . . . . 10.0 110.552 178.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . 0.432 ' H ' ' CD ' ' A' ' 563' ' ' GLU . 1.8 mp0 -51.14 -47.54 62.04 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 123.882 0.739 . . . . 10.0 110.377 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . 0.45 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.7 OUTLIER -69.2 104.45 2.2 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.225 178.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 565' ' ' ARG . . . . . 0.409 ' HB3' ' CG2' ' A' ' 396' ' ' THR . 25.4 tpt180 -69.86 -19.99 63.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.105 -178.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 566' ' ' ARG . . . . . 0.533 ' HG2' ' HB1' ' A' ' 394' ' ' ALA . 16.1 ttm180 -59.01 -40.92 86.43 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.3 0.572 . . . . 10.0 109.771 178.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 48.0 mt -79.09 -36.33 18.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.718 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.59 -54.79 41.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.642 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -61.97 -40.1 94.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.149 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -65.0 -31.55 72.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.816 0.341 . . . . 10.0 110.884 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 37.2 tp -76.06 -31.28 58.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.136 0.493 . . . . 10.0 110.355 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 9.6 ttp180 -76.81 -36.4 56.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.66 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.15 36.61 2.37 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 121.071 -0.585 . . . . 10.0 114.137 -178.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 574' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 574' ' ' ARG . 3.2 mmt180 -83.89 -44.02 14.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 117.134 0.467 . . . . 10.0 110.095 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 5.9 m -81.76 175.55 10.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.072 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 67.5 45.93 73.87 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.435 -0.888 . . . . 10.0 111.689 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -70.64 118.28 13.24 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.354 -0.239 . . . . 10.0 110.354 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 578' ' ' GLN . . . . . 0.623 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 9.7 tt0 62.45 30.48 17.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.471 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 82.11 51.93 4.25 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.836 -0.62 . . . . 10.0 112.266 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.41 -167.62 1.21 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.375 -0.231 . . . . 10.0 110.375 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -87.03 175.44 8.11 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.252 0.549 . . . . 10.0 111.87 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 153.65 164.62 12.83 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.546 -0.752 . . . . 10.0 111.924 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.0 p -148.06 125.41 11.59 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 110.368 -0.234 . . . . 10.0 110.368 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.17 128.08 54.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.169 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 585' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 1.2 ttm180 -138.62 120.61 15.54 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -111.14 155.53 22.74 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.022 0.439 . . . . 10.0 110.61 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 587' ' ' TYR . . . . . 0.54 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 56.6 m-85 -129.27 166.17 19.97 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.852 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 588' ' ' LEU . . . . . 0.641 ' HB3' HG22 ' A' ' 427' ' ' VAL . 15.8 tp -161.69 158.31 25.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.533 -0.303 . . . . 10.0 110.274 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 589' ' ' SER . . . . . 0.448 ' OG ' ' HD3' ' A' ' 434' ' ' LYS . 0.7 OUTLIER -123.34 143.82 49.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.306 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 590' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 92.0 mmm -71.39 -11.64 61.0 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.361 -0.381 . . . . 10.0 111.252 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -108.76 7.64 26.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.538 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -81.66 158.24 24.35 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.341 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -67.38 -30.05 69.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.816 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 594' ' ' LEU . . . . . 0.44 HD22 ' H ' ' A' ' 561' ' ' ARG . 13.4 tp -66.89 -25.14 66.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.698 0.285 . . . . 10.0 111.53 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 4.1 tpt -74.2 0.65 13.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.128 0.489 . . . . 10.0 111.127 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -94.52 1.07 55.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.269 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 597' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 594' ' ' LEU . 41.5 pt -72.99 -7.79 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-O 120.637 0.255 . . . . 10.0 111.664 -179.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -81.07 -7.67 59.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.61 -0.268 . . . . 10.0 110.842 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.4 -64.56 0.38 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.498 0.719 . . . . 10.0 111.196 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 600' ' ' SER . . . . . 0.509 ' HB2' HG23 ' A' ' 603' ' ' VAL . 4.0 m -77.64 116.59 18.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.795 0.331 . . . . 10.0 110.473 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -62.71 -26.04 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.125 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 76.0 mmt-85 -60.45 -29.44 69.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.21 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 603' ' ' VAL . . . . . 0.509 HG23 ' HB2' ' A' ' 600' ' ' SER . 59.9 t -66.68 -51.66 53.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 604' ' ' SER . . . . . 0.555 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 0.7 OUTLIER -63.25 -38.05 89.65 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.989 179.063 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -61.48 -38.69 96.2 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.922 -0.581 . . . . 10.0 112.507 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 42.5 tpp -74.29 -33.52 63.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.955 0.407 . . . . 10.0 110.679 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 51.2 mtt -68.68 -17.91 64.17 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.047 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 608' ' ' ARG . . . . . 0.555 ' HG3' ' O ' ' A' ' 604' ' ' SER . 63.7 mtt180 -77.6 -5.46 50.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.155 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -91.92 8.46 37.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.986 0.422 . . . . 10.0 110.306 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 25.0 tp -73.15 -16.33 61.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 10.0 111.186 -179.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 98.79 -43.78 1.82 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.981 -0.628 . . . . 10.0 111.671 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 70.62 -54.97 0.64 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.687 0.795 . . . . 10.0 112.596 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt 59.64 76.13 0.45 Allowed Pre-proline 0 N--CA 1.463 0.219 0 O-C-N 123.448 0.467 . . . . 10.0 110.485 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 614' ' ' PRO . . . . . 0.533 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 32.3 Cg_exo -58.38 96.95 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.454 2.769 . . . . 10.0 113.064 -178.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 130.17 -13.66 5.72 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.778 -0.725 . . . . 10.0 111.92 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -117.16 142.54 46.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.86 0.362 . . . . 10.0 110.253 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -80.59 107.32 13.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.387 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.63 -30.31 49.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.962 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 41.5 74.25 0.11 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.564 0.746 . . . . 10.0 112.68 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 22.6 m170 -117.61 100.37 52.53 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -57.01 -29.28 82.24 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 123.415 2.744 . . . . 10.0 113.982 -178.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 68.3 p-90 -68.79 -20.4 64.33 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.746 -0.382 . . . . 10.0 111.075 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.88 -48.96 73.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.705 -0.48 . . . . 10.0 109.705 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.28 -39.27 82.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.42 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -69.68 -36.29 75.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.891 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -65.15 -44.7 87.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.402 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 75.7 mt -64.44 -42.99 96.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.024 -0.534 . . . . 10.0 110.254 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.81 -38.63 86.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.482 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -67.47 -39.92 85.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.141 179.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -65.69 -44.11 87.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.652 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -61.45 -42.32 98.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.109 0.481 . . . . 10.0 109.743 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -62.28 -30.38 71.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.632 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 633' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' A' ' 633' ' ' LYS . 66.1 mmtt -64.7 -39.32 93.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.521 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 13.3 t -64.52 -43.13 96.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.45 ' OE2' ' HA ' ' A' ' 564' ' ' SER . 3.6 mm-40 -65.0 -35.7 82.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.865 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 27.9 m -62.92 -42.95 99.97 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.701 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 637' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 637' ' ' ARG . 41.7 ttm180 -63.33 -41.74 98.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.394 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . 0.57 HD21 ' NH2' ' A' ' 642' ' ' ARG . 0.6 OUTLIER -59.01 -43.5 91.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.298 -0.865 . . . . 10.0 110.322 179.189 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -67.76 -39.3 84.18 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.869 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 640' ' ' ASP . . . . . 0.53 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 27.0 t70 -60.06 -35.56 75.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.202 -0.453 . . . . 10.0 110.394 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 66.6 mt -83.29 -36.16 12.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.795 178.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 642' ' ' ARG . . . . . 0.57 ' NH2' HD21 ' A' ' 638' ' ' ASN . 1.7 ttp180 -57.74 -40.47 79.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.419 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 20.2 pttm -69.15 -28.34 66.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.312 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 644' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 16.0 mm100 -66.9 -38.26 85.9 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.908 0.385 . . . . 10.0 110.181 -179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 26.8 mt -66.73 -38.41 86.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.878 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 646' ' ' LEU . . . . . . . . . . . . . 94.9 mt -64.0 -35.02 79.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.698 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.73 -19.81 65.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.969 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -100.57 -45.86 5.39 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.323 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -72.1 -28.47 63.32 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.029 0.751 . . . . 10.0 113.029 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -67.16 -22.79 65.75 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.05 0.452 . . . . 10.0 110.554 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 18.7 t -68.88 -48.87 68.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -68.18 -29.52 68.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.437 -0.801 . . . . 10.0 109.579 178.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -60.12 -51.53 69.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.615 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -60.92 -45.83 93.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.769 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -61.32 -42.78 99.24 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.458 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 4.3 ttp-105 -63.39 -42.55 98.82 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.924 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -62.21 -44.35 96.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.592 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.73 -48.68 76.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.592 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.45 -34.64 58.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.599 -0.273 . . . . 10.0 111.547 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -64.98 -44.34 89.64 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.0 m -61.62 -41.75 97.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.014 -0.539 . . . . 10.0 109.921 179.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -65.05 -46.64 80.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.727 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 23.8 ttt-85 -65.08 -43.62 91.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.724 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -66.61 -35.12 79.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.734 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -62.65 -51.2 68.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.081 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 666' ' ' LEU . . . . . 0.485 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 54.4 mt -65.28 -28.81 69.6 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.227 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 27.9 tp -71.21 -40.76 70.95 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.962 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.8 -41.8 74.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.812 -178.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 33.0 m -82.6 158.7 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.38 . . . . 10.0 111.223 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 50.8 m -102.97 -34.04 9.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.752 0.31 . . . . 10.0 111.111 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -90.31 117.07 28.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.848 0.356 . . . . 10.0 110.409 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 8.1 p -123.21 -1.01 6.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.656 0.741 . . . . 10.0 109.947 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 673' ' ' SER . . . . . 0.431 ' OG ' ' HD3' ' A' ' 760' ' ' ARG . 0.3 OUTLIER -54.15 -39.09 66.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.868 -1.06 . . . . 10.0 111.846 -179.209 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -59.44 -48.19 82.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.833 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 675' ' ' THR . . . . . 0.404 ' O ' HG12 ' A' ' 679' ' ' ILE . 1.8 m -64.68 -44.27 90.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.664 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 44.4 mm -57.72 -48.34 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.689 -0.687 . . . . 10.0 111.438 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -66.53 -39.83 88.8 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.605 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 46.3 m -64.42 -46.01 85.09 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.867 0.321 . . . . 10.0 111.867 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 679' ' ' ILE . . . . . 0.54 ' O ' HG23 ' A' ' 683' ' ' VAL . 37.9 pt -71.67 -25.29 24.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.472 -0.491 . . . . 10.0 110.642 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 3.4 ttm-85 -58.55 -39.41 80.16 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.848 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -63.23 -43.76 97.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.667 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -70.56 -36.9 73.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.129 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 683' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 679' ' ' ILE . 69.1 t -59.5 -52.21 63.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 120.928 0.394 . . . . 10.0 110.429 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -63.41 -38.75 92.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.919 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 10.2 tttm -58.02 -52.53 65.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.24 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -61.46 -37.69 84.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.033 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 35.8 m -64.14 -41.58 97.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.543 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 94.2 mt -70.53 -42.44 78.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.241 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -56.3 -30.35 62.4 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.042 0.449 . . . . 10.0 111.725 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -66.33 -25.26 66.74 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.77 0.656 . . . . 10.0 112.77 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -120.86 -24.14 5.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.917 0.389 . . . . 10.0 111.445 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 692' ' ' ILE . . . . . 0.574 HG23 ' CD1' ' A' ' 701' ' ' TRP . 71.3 mt -127.65 103.76 21.77 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.4 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -68.58 128.79 17.69 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.027 1.818 . . . . 10.0 111.338 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -54.79 123.03 12.73 Favored 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 122.695 2.263 . . . . 10.0 112.784 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 61.55 78.76 0.28 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.251 -0.886 . . . . 10.0 111.406 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 17.5 p -145.93 -167.72 2.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.134 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 79.4 mt -85.65 152.54 23.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.64 0.257 . . . . 10.0 110.51 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.73 -31.49 68.35 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.741 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -76.63 -3.42 37.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.591 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.45 3.63 35.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.055 0.455 . . . . 10.0 110.238 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 701' ' ' TRP . . . . . 0.574 ' CD1' HG23 ' A' ' 692' ' ' ILE . 34.2 m0 -100.9 107.78 19.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.939 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -82.34 82.48 7.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.207 0.527 . . . . 10.0 109.582 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 703' ' ' ILE . . . . . 0.557 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 46.8 mm -58.6 -50.82 85.95 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.443 -0.799 . . . . 10.0 111.65 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 704' ' ' PRO . . . . . 0.557 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.2 Cg_exo -57.23 -42.94 57.47 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 121.91 1.74 . . . . 10.0 112.078 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -60.45 -42.96 99.21 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.128 -0.558 . . . . 10.0 111.993 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 47.5 tp -67.73 -39.95 84.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.97 0.414 . . . . 10.0 110.135 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -64.37 -49.29 72.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.482 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -58.29 -35.92 72.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.005 0.431 . . . . 10.0 110.26 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -66.35 -52.36 47.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.673 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 93.8 mt -65.69 -38.66 89.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.751 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -78.33 0.02 27.13 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.847 0.684 . . . . 10.0 112.847 -178.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -127.33 -53.58 1.37 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.846 0.355 . . . . 10.0 111.69 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 713' ' ' ASP . . . . . 0.561 ' O ' ' HE2' ' A' ' 828' ' ' LYS . 0.9 OUTLIER -76.15 -39.08 55.82 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.591 -178.461 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -100.6 -14.67 18.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.607 0.225 . . . . 10.0 111.607 -179.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.48 33.06 18.72 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.337 0.589 . . . . 10.0 110.678 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 49.3 tp -115.45 114.09 24.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.171 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -83.53 115.43 22.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.881 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 50.2 mt -133.14 129.52 20.96 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.121 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -86.04 61.6 5.01 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 123.116 2.544 . . . . 10.0 112.035 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 31.3 mt -60.62 -36.95 73.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.274 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -62.69 -30.86 71.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.972 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.12 -39.31 29.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.157 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 34.0 m0 -61.06 -48.36 82.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.155 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 55.2 tp -69.0 -20.02 64.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.682 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -87.61 -46.01 9.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.762 0.315 . . . . 10.0 111.384 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -81.86 -31.69 31.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.464 -0.334 . . . . 10.0 111.698 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -123.16 76.59 51.68 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 116.622 -0.263 . . . . 10.0 110.959 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.5 -18.87 60.54 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.38 2.053 . . . . 10.0 111.784 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.09 -15.95 63.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.301 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 67.3 mt -66.43 -23.35 66.28 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.766 0.317 . . . . 10.0 110.456 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 57.19 -101.98 0.14 Allowed 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 115.528 -0.76 . . . . 10.0 111.303 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -144.8 -47.02 0.24 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.022 0.439 . . . . 10.0 109.907 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -59.5 -51.07 71.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.118 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 3.1 m -62.69 -31.69 72.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.126 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 8.3 mt -60.74 -42.01 96.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.898 0.38 . . . . 10.0 110.198 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -62.69 -43.44 98.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.707 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -62.07 -39.28 91.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.35 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 27.4 mmm-85 -64.48 -46.41 83.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.317 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 90.2 mt -61.94 -43.47 97.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.278 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 54.1 tp -61.5 -52.67 63.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.912 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -58.8 -41.03 85.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.124 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -62.7 -40.75 98.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.967 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 24.3 p -64.46 -30.13 71.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.903 0.382 . . . . 10.0 110.453 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 744' ' ' ILE . . . . . 0.446 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 78.1 mt -73.28 -47.95 44.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 10.0 109.898 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -49.24 78.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.105 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 76.1 t -60.89 -38.12 78.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.064 0.459 . . . . 10.0 110.401 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -65.5 -42.94 91.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.041 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 748' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 27.0 mt-30 -63.02 -37.36 86.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.367 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 -59.59 -34.97 73.41 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.355 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -76.75 -36.83 56.84 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -61.4 -35.64 78.06 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.016 -0.993 . . . . 10.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -68.88 -14.6 63.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.759 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.47 -37.57 5.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.754 0.312 . . . . 10.0 111.639 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.7 t -84.15 -42.75 17.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.864 0.364 . . . . 10.0 111.364 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 126.07 130.69 3.46 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.905 -0.878 . . . . 10.0 110.905 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 756' ' ' ALA . . . . . 0.601 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -56.35 -54.22 48.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.749 0.309 . . . . 10.0 111.603 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -64.1 -38.1 89.82 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.089 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 14.3 tpt -64.86 -43.85 91.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.318 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 70.0 mmm -60.26 -43.97 95.7 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 116.06 -0.518 . . . . 10.0 111.151 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.601 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 15.6 mmp_? -55.23 -41.78 72.52 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.244 0.545 . . . . 10.0 111.06 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -72.97 -35.2 66.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.265 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -66.84 -45.24 78.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.273 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 760' ' ' ARG . 61.8 mt-10 -58.15 -47.07 84.47 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.641 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 764' ' ' LYS . . . . . 0.485 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 83.0 tttt -61.52 -45.72 92.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.785 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -59.88 -48.31 86.72 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.01 -0.614 . . . . 10.0 111.992 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 55.8 t -63.05 -44.63 99.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.617 0.246 . . . . 10.0 110.879 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 21.4 ttt -60.11 -47.91 83.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.813 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 48.0 mt -63.04 -43.01 99.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.644 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -60.39 -48.27 82.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.926 0.393 . . . . 10.0 110.538 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 11.9 m -62.43 -44.17 97.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.735 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 4.4 tt -61.35 -47.33 86.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.622 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 772' ' ' ASP . . . . . 0.578 ' O ' ' HG3' ' A' ' 776' ' ' LYS . 1.9 t70 -62.03 -47.39 84.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.091 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 29.6 m -59.15 -48.06 82.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.424 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 74.5 mt -65.91 -30.35 70.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.979 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -65.48 -40.88 93.64 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.578 ' HG3' ' O ' ' A' ' 772' ' ' ASP . 51.5 mttm -63.01 -39.14 93.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.913 -0.585 . . . . 10.0 109.767 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -64.73 -42.96 94.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.416 178.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 778' ' ' HIS . . . . . 0.492 ' O ' ' HG2' ' A' ' 782' ' ' MET . 47.1 t60 -63.49 -41.02 98.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.371 -0.831 . . . . 10.0 110.575 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 39.5 mt -56.26 -50.59 70.9 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 123.335 0.397 . . . . 10.0 110.421 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -65.62 -44.04 87.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.78 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.2 73.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.671 -179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 782' ' ' MET . . . . . 0.492 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 91.6 mmm -61.0 -41.98 97.56 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.909 0.385 . . . . 10.0 110.929 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -75.49 -33.35 60.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.583 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -60.86 -39.26 88.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.932 0.396 . . . . 10.0 110.257 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.1 tp -76.23 -32.16 58.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.576 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -65.63 -38.96 90.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.617 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.529 179.336 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo . . . . . 0 CA--C 1.526 0.109 0 N-CA-C 113.533 0.551 . . . . 10.0 113.533 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 800' ' ' LYS . . . . . 0.54 ' HB2' ' NZ ' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -78.64 -47.06 17.8 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.859 -0.336 . . . . 10.0 110.354 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -61.92 -40.89 97.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.545 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -64.09 -43.73 94.49 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 92.0 t80 -60.6 -43.34 97.52 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.219 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -58.3 -50.85 72.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.847 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -59.29 -45.9 90.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.864 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.2 -41.8 93.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.531 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 26.7 m -65.51 -34.76 79.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.904 -0.589 . . . . 10.0 111.146 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 21.6 m-30 -65.81 -43.2 89.35 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.975 0.417 . . . . 10.0 110.042 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 32.2 m -65.93 -36.34 83.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.428 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 29.2 ttm -65.49 -37.59 87.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.25 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -67.98 -43.04 79.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.21 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 812' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 816' ' ' GLU . . . -59.47 -49.14 78.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.965 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.89 -32.33 73.57 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.941 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 29.5 ttp -65.82 -44.55 85.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.008 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.53 -36.48 83.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.511 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 816' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 812' ' ' ALA . 18.0 mm-40 -63.37 -42.03 98.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.299 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 12.8 m -74.09 -29.82 62.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.523 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 50.6 tp -60.46 -58.47 8.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.757 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 40.4 pttt -60.73 -32.63 71.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.541 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -64.57 -59.01 4.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.645 -0.707 . . . . 10.0 111.322 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -60.87 -39.74 90.36 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.339 0.496 . . . . 10.0 112.339 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 54.7 t -57.66 -50.24 78.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.841 0.353 . . . . 10.0 110.66 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.1 -38.72 72.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.904 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 38.6 m -61.93 -40.1 94.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.626 0.25 . . . . 10.0 110.615 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 74.7 m -63.94 -41.26 97.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.709 0.29 . . . . 10.0 110.769 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 87.7 mt -69.76 -19.63 63.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.235 0.54 . . . . 10.0 110.871 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 16.9 m -92.42 -36.82 12.91 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.753 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 828' ' ' LYS . . . . . 0.561 ' HE2' ' O ' ' A' ' 713' ' ' ASP . 44.1 mttm -69.66 -28.99 66.34 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.966 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 5.7 p -66.82 108.15 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.688 0.756 . . . . 10.0 109.908 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -98.73 99.88 11.03 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.75 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 21.7 t . . . . . 0 C--N 1.322 -0.6 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.991 179.423 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.8 t80 . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.96 0.409 . . . . 10.0 110.635 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 130.38 178.84 15.64 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.903 -0.665 . . . . 10.0 111.972 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.2 m -68.64 116.58 9.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.801 0.334 . . . . 10.0 110.181 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.53 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 17.3 mmt180 -67.54 155.16 39.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.042 -0.527 . . . . 10.0 111.345 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.3 m120 73.65 -49.56 0.69 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.264 -0.88 . . . . 10.0 112.318 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -90.53 -71.26 0.63 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.824 0.675 . . . . 10.0 112.824 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -65.2 -18.25 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 -177.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.51 -52.74 64.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.684 0.278 . . . . 10.0 111.159 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 mt -67.06 -33.4 75.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.946 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 19' ' ' ARG . 12.4 ttp-105 -66.78 -45.05 79.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.384 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.54 -28.41 64.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.129 0.49 . . . . 10.0 109.996 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.554 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 45.3 mtt -76.22 -36.23 58.66 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.842 179.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -60.97 -35.64 77.31 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -60.37 -38.0 82.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.432 -0.803 . . . . 10.0 109.532 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -77.1 -35.36 22.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.848 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.9 t -58.13 -36.16 55.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.95 178.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.5 -37.44 87.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.729 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.3 mt -68.3 -44.0 84.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.716 -0.674 . . . . 10.0 109.704 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 77.6 mt -59.78 -40.57 82.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.774 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -63.64 -38.42 91.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.377 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.56 -28.32 65.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.006 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 53.4 mtt -84.11 -17.53 39.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.138 -0.483 . . . . 10.0 111.61 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.509 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 17.9 tt0 -57.46 -54.62 53.11 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-O 119.271 -0.395 . . . . 10.0 111.646 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 38.2 Cg_exo -61.05 -28.25 85.74 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.755 1.637 . . . . 10.0 111.516 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -69.51 -43.99 71.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.613 -0.722 . . . . 10.0 109.924 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 25.9 mmt -69.37 -29.03 66.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.355 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -62.68 -27.24 69.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.768 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -79.97 -16.45 55.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.709 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp -84.01 147.8 27.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.301 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 p -76.6 165.56 24.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.103 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.54 -43.17 84.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.865 0.364 . . . . 10.0 111.449 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -68.59 -28.08 66.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.922 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -69.79 -33.09 71.9 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.669 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.5 mt -61.94 -40.38 95.32 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -67.23 -32.4 73.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.14 -0.936 . . . . 10.0 109.552 178.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.97 -35.99 92.84 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.474 -0.785 . . . . 10.0 111.687 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -65.6 -37.3 86.23 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 28.1 m -61.38 -47.35 86.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.282 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.82 -30.02 70.1 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.236 0.541 . . . . 10.0 110.144 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -66.26 -45.66 79.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.441 -0.799 . . . . 10.0 110.564 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -59.64 -37.95 80.07 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.048 0.452 . . . . 10.0 110.252 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -57.95 -41.74 83.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.729 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.16 -41.47 61.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.994 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -60.48 -36.37 78.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.35 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.39 -38.13 89.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.771 0.319 . . . . 10.0 111.035 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -70.37 -28.12 64.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.421 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -69.16 -33.57 73.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.368 179.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 132.19 16.77 1.34 Allowed Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.532 -0.842 . . . . 10.0 113.069 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -77.3 149.55 35.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.926 0.393 . . . . 10.0 110.145 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.1 t -86.86 131.82 33.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.19 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.541 HD11 ' O ' ' A' ' 118' ' ' LEU . 18.8 tp -58.8 -39.87 82.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.135 0.493 . . . . 10.0 110.864 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.408 ' HG3' ' ND2' ' A' ' 95' ' ' ASN . 14.6 mp0 -68.0 -10.49 54.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.39 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -97.91 -13.52 21.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.301 0.572 . . . . 10.0 110.112 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.5 mt -91.6 -7.06 51.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.887 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.509 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 75.2 mt -49.99 -51.52 60.84 Favored Pre-proline 0 CA--C 1.541 0.622 0 N-CA-C 113.192 0.812 . . . . 10.0 113.192 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.509 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 62.2 Cg_exo -52.08 -51.17 11.73 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 122.085 1.856 . . . . 10.0 113.209 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -71.25 -42.75 68.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.65 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.427 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -61.05 -49.72 76.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.806 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -63.84 -35.2 79.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.321 -0.399 . . . . 10.0 111.025 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.28 -45.58 90.79 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 120.872 0.367 . . . . 10.0 110.494 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 70.1 t -61.74 -47.14 94.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.469 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 67' ' ' ALA . 63.4 t -61.73 -41.97 92.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.955 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.458 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 7.0 ttm180 -59.43 -49.36 78.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.927 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.45 ' HA ' ' OE1' ' A' ' 73' ' ' GLU . 35.1 tp10 -65.83 -40.21 91.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.917 0.389 . . . . 10.0 110.39 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.71 -32.46 71.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.136 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 17.2 m -68.27 -33.5 74.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.416 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.1 mtmm -72.35 -24.07 61.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.25 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 67.7 mtt180 -97.16 -50.35 4.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 96.8 t -67.5 -61.52 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.713 0.292 . . . . 10.0 111.24 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -82.75 -59.62 2.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.849 0.357 . . . . 10.0 110.937 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 131.08 -27.95 3.74 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.535 -0.626 . . . . 10.0 111.535 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -90.69 138.4 31.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.897 0.379 . . . . 10.0 110.594 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 82' ' ' ARG . 12.4 ttp180 -80.86 139.69 35.8 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.596 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.27 109.0 2.93 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -53.35 147.03 11.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.799 -0.637 . . . . 10.0 111.967 -178.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.07 -35.54 77.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.318 -0.855 . . . . 10.0 111.165 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.2 m -65.62 -28.94 45.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.83 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -75.02 -30.56 61.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.22 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.5 mt -63.31 -36.26 83.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.235 -0.439 . . . . 10.0 109.866 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.433 ' O ' HG23 ' A' ' 93' ' ' VAL . 48.9 mt -64.98 -47.94 75.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.83 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -64.75 -39.36 96.59 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.908 -0.663 . . . . 10.0 111.961 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.9 -35.2 91.7 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.021 -0.609 . . . . 10.0 112.301 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.554 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 18.5 ttm -71.03 -34.47 71.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.04 0.447 . . . . 10.0 110.008 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 89' ' ' LEU . 68.7 t -67.56 -37.04 78.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.505 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.35 6.28 2.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.533 -0.758 . . . . 10.0 112.915 -178.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.408 ' ND2' ' HG3' ' A' ' 61' ' ' GLU . 50.0 t30 -88.82 -20.75 24.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.301 0.572 . . . . 10.0 109.882 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -117.31 -176.95 3.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.405 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.579 ' HA ' ' O ' ' A' ' 387' ' ' LEU . 6.7 ttt85 -76.36 74.95 3.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.121 0.486 . . . . 10.0 111.037 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -142.81 154.66 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.235 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.535 HD12 HG11 ' A' ' 211' ' ' VAL . 36.3 mm -108.61 124.2 64.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.013 -0.736 . . . . 10.0 109.013 178.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -100.75 111.54 23.79 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.744 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.43 125.39 29.88 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.914 -0.772 . . . . 10.0 108.914 178.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 47.9 ttm -130.56 147.6 52.26 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.006 0.431 . . . . 10.0 110.793 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.527 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 13.0 mmm180 -76.59 153.93 34.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.964 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.32 99.25 1.91 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.022 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 139.42 -23.78 2.82 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.471 -0.871 . . . . 10.0 112.839 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -68.78 -20.48 64.35 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.932 0.396 . . . . 10.0 111.073 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.16 70.48 1.32 Allowed Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 121.039 -0.6 . . . . 10.0 113.065 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.3 ptmm? -68.34 -32.79 73.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.329 . . . . 10.0 110.974 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -36.02 80.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 10.0 111.192 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 24.2 tp -78.07 -18.32 55.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.212 0.529 . . . . 10.0 110.474 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 60.2 m -82.11 -29.43 31.71 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.365 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.44 -23.89 67.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.563 -0.744 . . . . 10.0 112.205 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.18 -23.92 66.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.234 0.457 . . . . 10.0 112.234 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 58.3 mt -70.65 -59.26 3.89 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.156 0.428 . . . . 10.0 112.156 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.36 -28.25 63.15 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.929 1.752 . . . . 10.0 111.883 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.72 -50.19 65.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.459 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.442 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 63.0 t80 -60.87 -45.89 92.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.026 0.441 . . . . 10.0 110.504 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.541 ' O ' HD11 ' A' ' 60' ' ' LEU . 23.9 tp -59.47 -54.61 44.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.865 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -70.5 -20.54 62.83 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.413 0.523 . . . . 10.0 112.413 -178.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.549 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -71.9 -29.79 64.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.729 0.3 . . . . 10.0 110.763 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 65.4 mt -56.8 -25.53 55.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.791 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 73.1 p -69.22 -25.15 64.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.887 0.375 . . . . 10.0 111.35 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 82.15 -1.13 87.81 Favored Glycine 0 CA--C 1.519 0.318 0 C-N-CA 121.019 -0.61 . . . . 10.0 112.624 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -74.13 -33.95 63.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.92 0.39 . . . . 10.0 110.813 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 115.8 131.57 4.91 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.493 -0.86 . . . . 10.0 113.341 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 73.9 t -106.22 112.96 41.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -94.13 105.41 17.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.887 0.375 . . . . 10.0 110.481 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 55.4 t -91.73 116.91 33.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.165 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 82.8 t -98.11 112.54 30.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.323 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.27 158.47 15.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.528 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 16.0 m -66.74 -24.11 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -154.81 170.69 21.04 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.965 -0.383 . . . . 10.0 109.965 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -78.54 -24.24 45.77 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.177 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -62.49 -55.04 31.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.956 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.9 mt -71.11 -29.25 65.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.558 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.67 -53.53 56.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.782 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.21 -30.09 64.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.459 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -63.55 -54.74 31.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.296 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . 0.464 ' HA ' ' HB3' ' A' ' 142' ' ' ASN . 0.5 OUTLIER -75.87 -20.02 58.41 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.711 -0.396 . . . . 10.0 112.034 -178.402 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.65 -35.74 81.54 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -84.47 -27.94 27.13 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.189 -0.914 . . . . 10.0 110.05 178.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . 0.464 ' HB3' ' HA ' ' A' ' 139' ' ' ASP . 38.8 t30 -67.82 -47.57 68.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.093 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -86.48 -4.92 59.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.541 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.503 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 56.1 ttm-85 -58.82 -49.86 91.14 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' PRO . . . . . 0.503 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 27.6 Cg_exo -63.6 -7.3 12.35 Favored 'Trans proline' 0 C--N 1.36 1.171 0 C-N-CA 122.32 2.013 . . . . 10.0 113.031 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 19.8 tp -100.35 -50.14 4.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.948 0.404 . . . . 10.0 110.346 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -65.83 -50.6 64.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.667 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -67.12 -21.15 65.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.885 0.374 . . . . 10.0 111.119 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -69.4 -34.63 74.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.312 0.577 . . . . 10.0 109.613 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.415 HD13 ' CE1' ' A' ' 117' ' ' TYR . 39.5 mt -89.26 -22.65 22.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.262 -0.881 . . . . 10.0 110.72 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.7 4.44 11.74 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.21 -0.995 . . . . 10.0 113.831 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 36.6 mt -88.86 134.15 34.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.949 0.375 . . . . 10.0 110.135 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 7.0 p -83.4 128.1 34.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.388 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.464 HG21 ' HA ' ' A' ' 144' ' ' ARG . 4.8 t -104.52 111.87 35.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.858 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -107.91 145.03 16.18 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 111.647 -0.581 . . . . 10.0 111.647 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.4 tp -122.08 127.36 75.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 120.798 0.332 . . . . 10.0 110.153 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -112.21 115.08 28.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.122 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 92.2 mt -107.97 148.29 37.14 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.31 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' PRO . . . . . 0.501 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 19.2 Cg_endo -58.91 112.46 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 122.71 2.273 . . . . 10.0 112.691 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.75 -1.53 48.74 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.689 -0.767 . . . . 10.0 112.927 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . 0.516 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 49.9 ttm -59.2 138.31 88.31 Favored Pre-proline 0 C--N 1.326 -0.424 0 C-N-CA 122.195 0.198 . . . . 10.0 110.745 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -53.68 144.42 53.49 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.812 2.341 . . . . 10.0 112.654 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . 0.468 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.18 -49.08 86.7 Favored Pre-proline 0 CA--C 1.54 0.584 0 N-CA-C 113.202 0.816 . . . . 10.0 113.202 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 31.9 Cg_exo -60.38 -32.78 94.38 Favored 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 121.771 1.647 . . . . 10.0 112.26 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.13 -37.85 63.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.577 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.516 ' HE2' ' O ' ' A' ' 161' ' ' MET . 60.6 mttm -60.49 -40.5 91.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.708 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -64.23 -27.97 69.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.116 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -78.12 -18.92 55.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.971 0.415 . . . . 10.0 110.779 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -96.27 -39.64 9.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.932 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -73.08 -27.02 61.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.327 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . 0.47 ' HA ' ' NE ' ' A' ' 201' ' ' ARG . . . -82.99 -3.23 56.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.959 0.409 . . . . 10.0 110.784 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -80.25 169.64 17.5 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.408 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . 0.549 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 11.9 m-20 -64.9 -47.25 78.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.199 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.8 mp -124.04 130.33 73.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.142 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.7 m -118.49 112.19 19.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.853 0.359 . . . . 10.0 111.16 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -88.73 137.54 32.23 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.492 -0.558 . . . . 10.0 109.492 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -174.63 174.88 46.8 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.219 -0.991 . . . . 10.0 112.898 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.59 149.06 21.86 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.608 0.242 . . . . 10.0 110.777 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -58.4 -38.02 76.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.729 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -59.19 -52.26 66.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.364 -179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.501 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.5 tp10 -68.18 -38.02 81.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.836 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -57.99 -37.59 74.54 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.99 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -73.54 -43.35 37.23 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.929 -0.653 . . . . 10.0 111.848 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -65.51 -38.84 90.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.695 0.283 . . . . 10.0 110.628 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 185' ' ' ASP . . . . . 0.449 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 20.2 m-20 -60.54 -44.13 96.44 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.008 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -61.94 -39.97 93.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.568 -0.742 . . . . 10.0 110.449 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 75.8 mt -66.98 -44.1 81.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.509 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 56.9 mtm-85 -63.81 -41.69 97.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.781 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 189' ' ' ASP . . . . . 0.427 ' OD1' HG22 ' A' ' 199' ' ' VAL . 0.4 OUTLIER -64.44 -31.22 72.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.267 0.556 . . . . 10.0 110.88 179.732 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -80.1 -14.87 58.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.163 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 35.6 mtp -103.66 17.08 24.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.963 0.411 . . . . 10.0 111.099 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -80.35 162.24 24.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.333 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -104.13 -25.12 13.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.342 0.592 . . . . 10.0 109.927 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -128.6 139.3 35.18 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.56 -0.746 . . . . 10.0 109.357 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.58 -22.7 73.35 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.528 2.152 . . . . 10.0 111.983 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 48.0 mp0 -71.83 -15.88 62.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.14 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -84.61 -17.78 37.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.272 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 24.6 mtt85 -55.36 137.85 47.0 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 123.481 0.488 . . . . 10.0 111.53 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 199' ' ' VAL . . . . . 0.427 HG22 ' OD1' ' A' ' 189' ' ' ASP . 22.6 m -110.15 -20.38 6.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.998 -0.547 . . . . 10.0 111.287 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -90.74 -175.09 4.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.339 0.59 . . . . 10.0 111.552 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 201' ' ' ARG . . . . . 0.47 ' NE ' ' HA ' ' A' ' 171' ' ' ALA . 11.2 mtm180 -140.29 -174.41 3.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.611 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 26.5 mttm -55.61 137.83 48.24 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.239 0.542 . . . . 10.0 111.804 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 18.5 mt -86.37 66.65 9.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.619 -0.719 . . . . 10.0 109.692 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -74.68 -72.7 0.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.661 -0.7 . . . . 10.0 112.235 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 205' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' A' ' 386' ' ' LYS . 29.1 t80 -122.33 135.91 54.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.008 0.432 . . . . 10.0 111.778 -177.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.49 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -128.07 123.74 35.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.369 -0.832 . . . . 10.0 109.499 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 64.4 tp -119.83 110.52 16.86 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.334 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -100.54 130.62 49.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.355 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -58.47 -65.38 0.66 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.798 -0.637 . . . . 10.0 111.984 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 210' ' ' GLU . . . . . 0.469 ' OE2' ' HA ' ' A' ' 391' ' ' THR . 17.6 tp10 -112.75 110.39 20.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.006 0.432 . . . . 10.0 110.482 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.535 HG11 HD12 ' A' ' 99' ' ' ILE . 28.4 m -82.91 -18.83 10.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.237 -0.438 . . . . 10.0 112.083 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 212' ' ' ASP . . . . . 0.483 ' OD1' ' HD2' ' A' ' 566' ' ' ARG . 7.2 t70 -51.87 -72.22 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.23 19.24 2.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.749 0.648 . . . . 10.0 112.749 -177.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 214' ' ' ILE . . . . . 0.4 ' O ' ' HB2' ' A' ' 218' ' ' GLU . 36.3 mt -125.04 -50.52 2.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.624 -0.431 . . . . 10.0 112.002 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 18.8 mt -82.7 -30.31 29.25 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 35.0 mm -98.43 -50.99 10.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.785 -0.366 . . . . 10.0 111.466 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.56 -46.54 72.42 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.02 0.378 . . . . 10.0 112.02 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 218' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 214' ' ' ILE . 5.8 mm-40 -95.89 31.97 1.99 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.687 0.28 . . . . 10.0 111.602 -178.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 378' ' ' GLN . . . -72.91 -51.94 16.61 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.826 0.346 . . . . 10.0 111.789 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 220' ' ' ARG . . . . . 0.474 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -93.8 22.06 5.95 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -178.085 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 4.1 m -88.74 108.99 26.46 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.94 -0.392 . . . . 10.0 109.94 178.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 222' ' ' PRO . . . . . 0.474 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 87.0 Cg_endo -93.47 134.16 0.98 Allowed 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.054 2.503 . . . . 10.0 113.789 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 223' ' ' LEU . . . . . 0.582 ' O ' ' HA ' ' A' ' 374' ' ' SER . 86.5 mt -94.04 110.46 22.15 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.875 -0.787 . . . . 10.0 108.875 178.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . 0.414 HG12 ' OG ' ' A' ' 374' ' ' SER . 22.1 mt -105.72 125.59 61.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 120.809 0.338 . . . . 10.0 111.32 -179.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 54.0 mt . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 178.49 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.403 0 N-CA-C 109.683 -0.488 . . . . 10.0 109.683 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 374' ' ' SER . . . . . 0.582 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 7.5 t -155.55 147.82 23.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.809 0.338 . . . . 10.0 111.031 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.3 tt -157.06 147.08 11.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.021 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 4.0 p -97.31 148.77 22.8 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -57.68 -41.75 82.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.712 0.291 . . . . 10.0 110.889 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 378' ' ' GLN . . . . . 0.4 ' HB3' ' O ' ' A' ' 219' ' ' ALA . 0.0 OUTLIER -61.17 -33.06 72.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.375 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 -90.01 -8.44 51.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.775 0.321 . . . . 10.0 111.119 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -87.61 -43.52 11.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.113 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -72.96 -11.25 60.5 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.267 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 44.5 mtp180 -77.86 -9.72 59.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.023 0.439 . . . . 10.0 110.304 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 30.3 mt -94.77 -8.25 38.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.502 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . 0.49 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 18.5 m-85 -84.96 132.89 34.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.684 0.278 . . . . 10.0 111.208 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -64.15 -56.09 17.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.197 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 386' ' ' LYS . . . . . 0.457 ' O ' ' HA ' ' A' ' 205' ' ' TYR . 69.1 mttt -110.56 113.14 25.53 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.579 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 41.5 tp -122.25 124.68 44.34 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.257 -0.428 . . . . 10.0 110.082 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -140.64 160.04 40.88 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.595 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -166.53 164.21 37.51 Favored Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.381 -0.914 . . . . 10.0 112.368 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 62.4 mtm -119.03 171.65 8.11 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.877 -0.416 . . . . 10.0 109.877 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 391' ' ' THR . . . . . 0.469 ' HA ' ' OE2' ' A' ' 210' ' ' GLU . 1.9 t -162.55 158.31 23.32 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.881 0.372 . . . . 10.0 110.782 179.093 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -81.76 -171.32 45.62 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.916 -0.659 . . . . 10.0 111.843 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 393' ' ' THR . . . . . 0.527 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 1.9 m -73.56 79.59 1.47 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.228 0.537 . . . . 10.0 111.136 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -119.89 -60.86 1.67 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.56 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 395' ' ' ASP . . . . . 0.449 ' CG ' ' H ' ' A' ' 396' ' ' THR . 9.9 t70 58.8 -145.84 0.54 Allowed 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.262 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 396' ' ' THR . . . . . 0.686 HG21 ' HB3' ' A' ' 565' ' ' ARG . 5.3 m 69.56 -79.53 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.101 0.56 . . . . 10.0 112.169 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -86.26 26.49 1.04 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.129 0.49 . . . . 10.0 110.444 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -69.86 -29.72 67.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 10.0 111.238 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -64.13 -23.87 67.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.063 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 400' ' ' GLU . . . . . 0.471 ' HA ' ' OE1' ' A' ' 400' ' ' GLU . 5.0 mm-40 -68.93 -24.06 64.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.875 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 401' ' ' PHE . . . . . 0.464 ' HB3' ' HB2' ' A' ' 407' ' ' LEU . 39.2 m-85 -64.09 -31.81 73.14 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 178.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.23 -27.41 26.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.262 -0.881 . . . . 10.0 110.539 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 2.6 m -73.01 -39.54 65.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.806 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 17.4 mt -98.96 -53.66 7.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 113.451 0.908 . . . . 10.0 113.451 -177.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -99.64 -2.0 36.62 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.802 0.667 . . . . 10.0 112.802 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt 63.16 29.8 16.05 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.45 0.469 . . . . 10.0 111.659 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 407' ' ' LEU . . . . . 0.496 HD13 HD11 ' A' ' 99' ' ' ILE . 5.3 mt -84.94 138.58 32.41 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.617 -0.265 . . . . 10.0 111.065 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 408' ' ' ASP . . . . . 0.53 ' OD2' ' HD2' ' A' ' 13' ' ' ARG . 22.0 t70 -81.41 160.09 24.14 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 6.8 m -114.4 115.5 27.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.986 0.422 . . . . 10.0 111.733 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.61 138.28 54.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.016 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 44.7 t -104.32 125.55 59.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.73 0.3 . . . . 10.0 110.752 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 94.4 t -84.0 127.66 66.03 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.497 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.32 136.6 47.88 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.665 2.244 . . . . 10.0 112.41 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.43 HG23 ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.8 149.87 45.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.651 -0.704 . . . . 10.0 111.016 179.257 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -58.4 -50.23 74.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.146 0.498 . . . . 10.0 110.066 179.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -114.34 158.71 39.12 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.94 114.12 2.16 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.239 1.959 . . . . 10.0 111.333 178.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 54.0 ttp -68.55 113.44 6.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.092 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 34.3 mt -98.67 73.12 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.335 0.588 . . . . 10.0 109.827 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -102.04 116.48 32.77 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.024 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -84.96 99.23 10.85 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.71 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.23 110.52 16.78 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.734 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 424' ' ' PRO . 51.4 mt -100.55 132.28 22.58 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.101 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 424' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 423' ' ' LEU . 50.6 Cg_exo -53.86 144.7 54.28 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.936 2.424 . . . . 10.0 113.544 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.83 138.83 48.57 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.506 -0.77 . . . . 10.0 109.825 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 15.4 mt -113.56 118.54 34.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.991 0.424 . . . . 10.0 110.549 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 91.3 t -99.7 122.23 51.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.598 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 428' ' ' TYR . . . . . 0.471 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 5.0 m-85 -109.76 176.36 5.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.252 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -80.25 -79.28 0.15 Allowed 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.972 -0.291 . . . . 10.0 110.99 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 70.1 p -82.24 160.23 23.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.737 0.303 . . . . 10.0 110.993 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -62.5 -33.52 75.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.371 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.79 80.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.595 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.51 -42.77 99.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.247 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 434' ' ' LYS . . . . . 0.435 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 38.3 ttpt -62.09 -50.08 73.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.566 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 435' ' ' ILE . . . . . 0.496 ' O ' HG12 ' A' ' 439' ' ' ILE . 51.4 mm -62.88 -44.3 99.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.598 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.6 -41.88 86.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.615 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.23 -36.97 85.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.339 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 438' ' ' ILE . . . . . 0.428 HG23 HG21 ' A' ' 557' ' ' ILE . 90.6 mt -64.24 -47.92 87.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.769 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 439' ' ' ILE . . . . . 0.496 HG12 ' O ' ' A' ' 435' ' ' ILE . 46.6 mm -59.78 -40.24 82.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.081 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -62.05 -44.57 96.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.443 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -63.58 -36.62 84.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.609 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.488 HG12 HG11 ' A' ' 452' ' ' VAL . 96.4 mt -72.24 -42.75 66.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.445 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -48.52 -53.93 16.28 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.971 0.73 . . . . 10.0 112.971 -179.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -62.49 -41.84 99.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.967 0.413 . . . . 10.0 111.866 -178.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.419 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 76.2 mtt-85 -71.26 -35.79 71.51 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.18 0.437 . . . . 10.0 112.18 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 24.8 m -66.43 -33.89 76.72 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.258 0.551 . . . . 10.0 110.146 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -70.69 -46.14 63.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.37 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.63 -44.89 76.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.357 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 120.9 32.45 1.08 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.43 -0.891 . . . . 10.0 112.97 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 450' ' ' GLN . . . . . 0.419 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 61.9 tt0 -104.04 125.82 33.41 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.871 0.335 . . . . 10.0 110.16 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.38 136.51 47.31 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.553 2.168 . . . . 10.0 111.697 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 452' ' ' VAL . . . . . 0.488 HG11 HG12 ' A' ' 442' ' ' ILE . 59.5 t -124.57 122.61 64.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.04 0.448 . . . . 10.0 111.62 -178.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 52.2 tp -108.33 110.0 21.46 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 19.9 t -89.61 113.83 26.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.464 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -93.66 123.78 7.56 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.79 -0.719 . . . . 10.0 111.664 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 34.2 p -122.9 130.47 52.89 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.591 0.234 . . . . 10.0 110.695 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 30.0 pt -95.73 -8.76 9.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.103 0.478 . . . . 10.0 110.296 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 458' ' ' SER . . . . . 0.415 ' HB2' ' HD3' ' A' ' 461' ' ' LYS . 0.9 OUTLIER -124.79 126.13 45.13 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.769 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 47.0 mt -57.73 -37.09 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-O 121.051 0.453 . . . . 10.0 111.517 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -56.19 -42.95 77.94 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.142 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.415 ' HD3' ' HB2' ' A' ' 458' ' ' SER . 0.8 OUTLIER -72.91 -28.93 62.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.314 -178.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.5 m -62.44 -47.65 83.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.247 0.546 . . . . 10.0 109.685 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -68.45 -35.4 77.54 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.718 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 50.7 tp -63.79 -52.45 60.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.799 -0.637 . . . . 10.0 111.356 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 8.8 p -67.16 -31.62 54.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.847 0.356 . . . . 10.0 110.812 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 5.6 t -65.59 -38.96 90.98 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.72 -0.474 . . . . 10.0 109.72 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -62.35 -51.05 69.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.41 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -60.58 -41.19 94.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.39 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.64 -38.42 87.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.761 0.315 . . . . 10.0 110.755 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.0 m -68.51 -36.88 79.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.326 0.584 . . . . 10.0 110.058 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -67.64 -23.31 65.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.854 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -95.5 -3.09 47.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.009 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 72.65 14.15 77.91 Favored Glycine 0 C--N 1.329 0.169 0 C-N-CA 121.013 -0.613 . . . . 10.0 112.481 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 94.5 mt -78.4 120.86 30.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.837 0.351 . . . . 10.0 110.23 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -65.93 117.34 8.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.019 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -145.56 158.21 43.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.171 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . 0.506 ' ND2' HD13 ' A' ' 490' ' ' ILE . 8.1 t30 -132.1 144.76 50.95 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.255 179.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 17.2 t -104.63 132.12 52.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.967 -0.382 . . . . 10.0 109.967 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.4 HD12 ' HB2' ' A' ' 503' ' ' ALA . 88.4 mt -86.31 93.84 9.19 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.122 0.486 . . . . 10.0 110.425 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -85.37 119.81 26.15 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.413 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -64.62 -25.06 67.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.901 -0.59 . . . . 10.0 112.179 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -69.68 -23.1 63.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.042 0.449 . . . . 10.0 110.701 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -120.06 64.84 0.82 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.644 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' HIS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 487' ' ' GLU . 0.0 OUTLIER -64.58 -24.36 67.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.593 -178.756 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.38 -33.22 75.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.085 0.469 . . . . 10.0 110.05 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -89.88 -40.49 12.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.955 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 484' ' ' HIS . 0.1 OUTLIER -54.01 -51.92 62.43 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.659 -0.7 . . . . 10.0 111.515 -179.81 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -56.46 -32.47 64.97 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 112.4 0.518 . . . . 10.0 112.4 -178.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -73.49 -37.52 65.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.033 0.444 . . . . 10.0 110.754 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' ILE . . . . . 0.506 HD13 ' ND2' ' A' ' 477' ' ' ASN . 28.8 mt -76.55 -41.43 34.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.329 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 66.6 t -57.22 -34.75 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-O 121.073 0.463 . . . . 10.0 110.744 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -63.43 -22.34 66.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.57 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 -120.03 22.44 11.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.64 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -71.6 -16.66 62.3 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.997 0.427 . . . . 10.0 111.144 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -95.39 16.44 61.26 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.854 -0.688 . . . . 10.0 111.862 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -74.39 141.09 76.44 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 110.134 -0.321 . . . . 10.0 110.134 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.38 125.6 19.7 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.452 2.101 . . . . 10.0 112.51 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.24 29.8 4.48 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.697 -0.683 . . . . 10.0 112.35 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -105.66 114.61 28.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.832 0.348 . . . . 10.0 110.341 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 23.4 t -98.7 118.4 45.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.198 -0.455 . . . . 10.0 109.892 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.62 138.18 54.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.061 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 41.2 mt -109.98 129.36 65.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.727 -0.471 . . . . 10.0 109.727 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . 0.4 ' HB2' HD12 ' A' ' 479' ' ' LEU . . . -121.42 129.45 53.01 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.818 0.342 . . . . 10.0 111.066 -179.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 7.4 m -104.89 119.55 39.28 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.464 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 66.8 t30 59.21 77.3 0.32 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.953 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -78.03 123.61 27.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.482 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -70.51 172.74 7.96 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.172 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -65.64 152.95 51.49 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.044 -0.598 . . . . 10.0 112.578 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 67.78 -81.91 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.162 0.585 . . . . 10.0 111.502 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 87.33 149.15 15.23 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.967 -0.635 . . . . 10.0 112.37 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.96 151.07 31.39 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 122.666 0.387 . . . . 10.0 111.527 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -76.27 103.65 6.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.447 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 66.8 mt -84.97 111.29 20.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.209 -0.45 . . . . 10.0 109.98 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 18.4 t -80.5 132.49 31.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.736 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 65.4 mt -67.42 130.39 42.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.703 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 94.32 -11.42 70.41 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.986 -0.626 . . . . 10.0 111.786 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 117.13 -170.78 13.56 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 110.914 -0.874 . . . . 10.0 110.914 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 5.1 p -129.19 99.49 5.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 117.206 0.503 . . . . 10.0 110.993 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 20.0 p-90 -58.28 -28.48 65.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.88 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -62.88 -31.38 72.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.871 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -86.48 -34.26 20.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.057 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -64.76 -40.76 95.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.716 -0.675 . . . . 10.0 111.169 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.9 m -73.42 -19.9 18.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.979 0.419 . . . . 10.0 110.708 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -87.31 -6.81 58.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.728 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -91.47 3.57 54.65 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.486 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 16.5 mt -97.83 150.33 21.39 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.26 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -74.83 -49.08 21.89 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -126.63 90.59 49.41 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.535 -0.542 . . . . 10.0 109.535 179.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.3 113.46 2.26 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.765 2.31 . . . . 10.0 112.504 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -104.18 149.0 25.66 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.525 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.38 -37.17 64.68 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.689 0.281 . . . . 10.0 111.465 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -58.19 -36.28 72.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.87 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -81.95 -40.49 22.18 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.793 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 76.7 mt -58.81 -48.04 87.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.353 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -72.41 -29.07 63.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.81 0.338 . . . . 10.0 110.859 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -69.59 -50.74 41.66 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 94.2 mt -62.81 -36.23 74.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.141 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -59.78 -42.16 92.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.023 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -70.06 -45.29 67.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.566 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.19 -47.08 84.54 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.331 0.586 . . . . 10.0 110.065 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -62.46 -40.66 97.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.334 -0.848 . . . . 10.0 110.427 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -55.21 -42.51 73.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.854 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 61.9 t -65.79 -47.81 84.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.437 179.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 10.0 mtp180 -62.67 -37.84 88.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.572 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -60.71 -49.05 79.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.326 -0.852 . . . . 10.0 111.058 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -70.15 -27.34 64.47 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.537 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -65.27 -35.55 81.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.106 0.479 . . . . 10.0 109.991 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 95.6 t -73.46 -33.97 41.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.576 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 88.6 mt -58.88 -50.4 74.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.322 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -69.07 -24.78 64.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.916 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -72.12 -23.42 61.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.24 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 122.46 5.15 8.69 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.362 -0.923 . . . . 10.0 113.477 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 79.24 -169.03 53.61 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.732 -0.747 . . . . 10.0 112.678 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 52.9 tp -69.2 123.06 20.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.865 0.364 . . . . 10.0 110.693 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -101.59 123.23 45.27 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.965 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 21.8 mm -106.89 131.49 56.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.335 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 557' ' ' ILE . . . . . 0.428 HG21 HG23 ' A' ' 438' ' ' ILE . 25.5 mt -119.24 124.41 73.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.054 178.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . 0.537 ' HA3' ' CD2' ' A' ' 586' ' ' PHE . . . -101.68 125.6 8.61 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.991 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 2.0 p -83.02 -30.41 28.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.24 0.543 . . . . 10.0 110.428 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -153.6 152.75 31.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.043 -0.98 . . . . 10.0 109.134 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 37.4 mtt-85 -101.16 158.76 15.79 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.195 -0.298 . . . . 10.0 110.195 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -87.41 152.58 22.13 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.012 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.25 -45.25 95.31 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 3.9 p -89.22 128.61 35.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.487 -0.779 . . . . 10.0 109.874 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 565' ' ' ARG . . . . . 0.686 ' HB3' HG21 ' A' ' 396' ' ' THR . 16.2 tpt180 -70.91 -21.59 62.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.535 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 566' ' ' ARG . . . . . 0.483 ' HD2' ' OD1' ' A' ' 212' ' ' ASP . 3.2 mtm180 -54.65 -52.6 61.79 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.954 0.407 . . . . 10.0 110.796 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 46.5 mt -80.03 -30.75 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.54 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -62.42 -40.34 96.23 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.77 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -69.13 -31.81 70.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.791 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -65.12 -28.22 69.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.998 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 35.7 tp -74.4 -26.96 60.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.109 0.48 . . . . 10.0 110.375 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 20.9 ttp180 -84.82 -27.47 26.76 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.518 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -84.03 29.64 3.79 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.991 -0.623 . . . . 10.0 113.499 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -82.17 -44.33 16.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 117.001 0.401 . . . . 10.0 110.211 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 1.2 m -87.97 172.45 9.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.938 -0.573 . . . . 10.0 110.201 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 69.38 42.3 74.66 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.568 -0.825 . . . . 10.0 112.337 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -82.36 135.88 35.09 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 64.61 18.02 11.18 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.131 0.491 . . . . 10.0 110.018 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 80.84 43.92 8.66 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.696 -0.684 . . . . 10.0 111.825 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -99.29 -163.84 1.07 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.513 -0.18 . . . . 10.0 110.513 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -93.73 173.1 7.85 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.232 0.539 . . . . 10.0 111.791 -179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 159.29 166.69 18.75 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.761 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 p -147.6 138.37 23.37 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.761 0.281 . . . . 10.0 110.326 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 12.6 m -123.06 132.08 53.97 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.605 -0.271 . . . . 10.0 110.681 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -146.21 128.31 15.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.091 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 586' ' ' PHE . . . . . 0.537 ' CD2' ' HA3' ' A' ' 558' ' ' GLY . 18.1 m-85 -114.84 146.96 40.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.039 0.447 . . . . 10.0 110.646 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 587' ' ' TYR . . . . . 0.435 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 65.3 m-85 -126.5 135.38 51.25 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 63.9 mt -133.91 160.0 39.0 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.697 0.284 . . . . 10.0 110.699 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 25.5 p -130.88 164.75 24.56 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.003 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 78.5 mmm -76.22 -2.52 31.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.92 0.391 . . . . 10.0 111.117 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -98.01 1.93 48.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.366 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -88.41 142.69 27.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.78 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -65.26 -13.73 59.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.547 -0.751 . . . . 10.0 112.34 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 594' ' ' LEU . . . . . 0.562 ' O ' HG12 ' A' ' 597' ' ' ILE . 15.7 tp -65.38 -23.95 67.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.918 0.39 . . . . 10.0 110.858 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 19.5 mmt -77.52 -3.79 42.35 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.916 0.389 . . . . 10.0 111.159 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -92.4 -15.33 27.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.771 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 597' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 594' ' ' LEU . 29.1 pt -67.3 -14.29 17.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-O 120.999 0.428 . . . . 10.0 111.241 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -76.53 -10.65 59.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.046 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.83 -55.93 0.65 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.458 0.703 . . . . 10.0 110.781 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 7.3 m -93.91 103.64 15.73 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -16.52 39.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.871 -0.604 . . . . 10.0 112.113 -178.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 4.4 mmt180 -63.0 -32.78 74.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.696 0.284 . . . . 10.0 110.552 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 50.7 t -68.0 -48.89 72.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.281 -0.418 . . . . 10.0 109.938 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.1 -38.47 85.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.32 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -64.6 -26.57 71.0 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.946 -0.57 . . . . 10.0 112.489 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 58.2 tpp -68.93 -18.04 64.04 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.113 0.482 . . . . 10.0 110.572 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 59.7 mtt -76.58 -14.98 59.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.257 -0.428 . . . . 10.0 110.522 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 608' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 608' ' ' ARG . 36.5 mtt-85 -72.07 -12.97 61.46 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.23 0.538 . . . . 10.0 110.358 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 10.6 mmmt -82.93 1.99 36.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.889 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 5.2 mp -75.91 -14.87 60.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.572 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 92.35 -31.73 5.89 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.973 -0.632 . . . . 10.0 111.774 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 612' ' ' MET . . . . . 0.438 ' HG3' ' HA ' ' A' ' 428' ' ' TYR . 0.0 OUTLIER 69.78 -66.8 0.25 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 123.539 0.736 . . . . 10.0 111.69 179.763 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp 57.42 78.32 0.37 Allowed Pre-proline 0 CA--C 1.53 0.198 0 O-C-N 123.524 0.515 . . . . 10.0 111.131 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 614' ' ' PRO . . . . . 0.471 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 52.3 Cg_exo -56.56 119.12 6.13 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.142 2.561 . . . . 10.0 112.506 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 101.74 -9.32 56.88 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.893 -0.67 . . . . 10.0 111.891 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -111.05 120.11 41.26 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.992 0.425 . . . . 10.0 110.347 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -79.28 96.93 6.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.618 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.2 tp -72.24 -23.22 21.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.841 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 46.98 83.65 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.797 0.685 . . . . 10.0 112.524 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -116.79 94.03 42.87 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.273 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -61.44 -29.22 84.87 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.102 2.535 . . . . 10.0 113.447 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 70.1 p-90 -65.36 -25.75 67.71 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.886 -0.326 . . . . 10.0 110.996 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 73.1 t -67.85 -42.36 85.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 1.8 m -62.74 -38.85 92.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.445 -0.798 . . . . 10.0 110.081 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -68.97 -39.18 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.177 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -61.68 -38.4 87.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.231 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.76 -43.64 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.935 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 628' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' A' ' 632' ' ' ARG . . . -60.33 -42.21 95.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.411 179.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 629' ' ' ASN . . . . . 0.411 ' O ' ' HG3' ' A' ' 633' ' ' LYS . 61.3 t30 -67.65 -35.86 79.69 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.144 179.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -64.75 -41.87 95.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.975 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 631' ' ' GLN . . . . . 0.402 ' OE1' ' HD3' ' A' ' 565' ' ' ARG . 49.5 mt-30 -62.76 -37.45 86.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.083 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 632' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 628' ' ' ALA . 12.7 mtp180 -61.77 -34.62 76.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.277 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 633' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 629' ' ' ASN . 57.5 mttm -64.91 -38.93 92.61 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 92.1 t -62.22 -49.56 83.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.053 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -62.41 -30.95 71.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.292 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.4 m -69.43 -23.78 63.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.282 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -73.28 -35.68 66.21 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -65.0 -42.29 94.61 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.63 -0.713 . . . . 10.0 109.521 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -55.7 -44.84 77.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.308 -0.86 . . . . 10.0 110.4 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -59.6 -43.37 93.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.821 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 52.3 mt -64.57 -47.6 88.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.224 179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 642' ' ' ARG . . . . . 0.507 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 75.4 mtm-85 -60.28 -43.34 96.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.945 -0.57 . . . . 10.0 110.314 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 18.5 ttpt -55.21 -45.99 75.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.914 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -64.93 -41.5 95.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.944 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 88.9 mt -65.99 -41.39 91.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.926 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 646' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 97.5 mt -59.07 -42.47 90.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.879 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -66.43 -13.59 60.96 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.002 0.371 . . . . 10.0 112.002 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -102.27 -38.72 7.53 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.946 0.403 . . . . 10.0 111.162 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -83.41 -25.5 31.25 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 -178.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -65.27 -31.34 72.44 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.021 0.439 . . . . 10.0 110.319 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 651' ' ' VAL . . . . . 0.427 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 13.2 t -62.98 -47.28 93.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.8 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.12 -26.54 64.95 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.539 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -63.18 -48.23 79.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.598 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.79 -44.61 95.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.555 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 655' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 42.3 mt-30 -61.56 -44.05 97.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.364 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 24.9 ttp-105 -63.02 -42.44 99.8 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.857 -0.61 . . . . 10.0 109.952 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -63.23 -44.91 93.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.956 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.83 -49.64 69.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.769 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.3 tp -65.93 -36.9 78.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 C-N-CA 121.103 -0.239 . . . . 10.0 111.271 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 6.1 m-30 -68.32 -40.08 81.75 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.937 -0.394 . . . . 10.0 109.937 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 5.1 t -60.47 -49.46 77.48 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.066 -0.516 . . . . 10.0 109.698 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -58.88 -47.77 83.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.781 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 667' ' ' LEU . 43.8 ttt-85 -60.91 -39.23 88.57 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.042 -0.527 . . . . 10.0 111.571 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -73.45 -43.35 60.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.562 0.22 . . . . 10.0 111.487 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -58.45 -37.62 75.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.095 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 61.2 mt -88.7 -4.43 58.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.834 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.498 ' HB2' ' O ' ' A' ' 663' ' ' ARG . 20.3 tp -87.15 -46.96 9.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.075 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -68.41 -41.71 80.05 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.066 -0.516 . . . . 10.0 111.623 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 21.7 m -72.67 164.2 3.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.072 0.463 . . . . 10.0 111.423 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 53.9 m -115.96 -38.72 3.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.331 -179.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -80.12 84.63 5.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.136 0.493 . . . . 10.0 110.579 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 672' ' ' VAL . . . . . 0.4 ' O ' HG12 ' A' ' 676' ' ' ILE . 9.5 p -95.01 -5.46 10.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.567 0.699 . . . . 10.0 109.716 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -39.16 69.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.074 -0.966 . . . . 10.0 111.93 -179.308 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -58.54 -50.47 73.67 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.097 0.475 . . . . 10.0 110.551 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 675' ' ' THR . . . . . 0.443 ' O ' HG12 ' A' ' 679' ' ' ILE . 0.6 OUTLIER -64.9 -44.49 89.41 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.811 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 676' ' ' ILE . . . . . 0.4 HG12 ' O ' ' A' ' 672' ' ' VAL . 36.0 mm -56.7 -51.63 64.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.755 -0.657 . . . . 10.0 111.954 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -67.52 -35.75 79.7 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 52.8 m -65.43 -46.6 79.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.618 0.247 . . . . 10.0 111.483 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 679' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 675' ' ' THR . 48.1 pt -74.76 -20.73 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.92 -0.312 . . . . 10.0 110.732 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 48.5 ttm-85 -60.48 -40.84 92.73 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.957 0.408 . . . . 10.0 110.179 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -62.96 -38.26 90.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.662 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -72.78 -46.79 51.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.223 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 683' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 679' ' ' ILE . 94.2 t -58.62 -46.11 90.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-O 120.831 0.348 . . . . 10.0 111.05 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -62.53 -42.24 99.4 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.465 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -64.07 -43.2 96.17 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.651 -0.249 . . . . 10.0 110.438 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.7 87.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.976 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 8.8 m -68.37 -37.32 80.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.563 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.04 -44.32 50.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.797 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -31.11 62.26 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.037 0.535 . . . . 10.0 111.931 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -66.62 -28.17 68.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.852 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -110.17 -22.09 11.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.739 0.304 . . . . 10.0 111.599 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 692' ' ' ILE . . . . . 0.403 HG12 ' HB3' ' A' ' 701' ' ' TRP . 28.1 mt -125.85 100.26 31.08 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.515 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.48 130.28 26.22 Favored 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.507 2.138 . . . . 10.0 110.766 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -48.11 109.04 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 123.056 2.504 . . . . 10.0 113.529 -178.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.06 88.91 0.07 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.661 -0.699 . . . . 10.0 111.551 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 11.9 p -154.67 -168.71 2.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.215 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 697' ' ' LEU . 32.3 mt -72.56 136.64 45.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.206 -0.294 . . . . 10.0 110.206 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -59.86 -31.71 70.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.873 -178.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -76.33 -4.56 42.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.974 0.416 . . . . 10.0 111.48 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 13.1 mmt -100.95 8.79 42.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.334 0.588 . . . . 10.0 109.784 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 701' ' ' TRP . . . . . 0.403 ' HB3' HG12 ' A' ' 692' ' ' ILE . 48.4 m0 -102.5 125.09 49.1 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.298 -0.865 . . . . 10.0 110.194 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -82.14 77.49 8.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.431 0.634 . . . . 10.0 109.334 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 703' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 32.8 mm -63.36 -49.45 79.0 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.175 -0.92 . . . . 10.0 111.16 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 704' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 51.7 Cg_exo -56.44 -45.88 34.26 Favored 'Trans proline' 0 C--N 1.359 1.13 0 C-N-CA 121.866 1.711 . . . . 10.0 112.008 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -64.22 -41.76 98.19 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.962 -0.637 . . . . 10.0 111.965 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.468 ' O ' ' HG ' ' A' ' 710' ' ' LEU . 60.0 tp -64.7 -43.44 93.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.487 0.184 . . . . 10.0 110.702 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -61.15 -47.41 86.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.525 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -66.09 -35.04 79.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.393 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.5 -46.85 88.24 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.254 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 710' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 706' ' ' LEU . 63.1 mt -60.58 -36.74 79.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.776 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -73.22 -21.08 60.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.989 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -99.15 -42.28 7.13 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.523 0.564 . . . . 10.0 112.523 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -96.02 -23.36 16.85 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.699 1.0 . . . . 10.0 113.699 -177.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -120.34 1.23 10.72 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.504 0.927 . . . . 10.0 113.504 -177.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 715' ' ' ASP . . . . . 0.415 ' HB2' ' HA ' ' A' ' 828' ' ' LYS . 22.8 t70 57.76 31.31 20.27 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 121.554 0.692 . . . . 10.0 110.22 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 14.8 tp -125.96 128.17 47.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.155 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -104.02 105.19 15.28 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.898 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 82.3 mt -121.04 104.05 41.87 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.938 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.56 73.84 3.94 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 122.536 2.157 . . . . 10.0 111.655 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 57.3 mt -55.73 -43.14 72.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.42 -0.809 . . . . 10.0 111.932 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -64.91 -21.99 66.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.679 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -80.51 -17.21 52.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.977 0.418 . . . . 10.0 110.453 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 20.0 m0 -101.75 -43.87 5.71 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.533 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 16.1 tp -57.17 -27.6 62.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.415 -178.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -86.73 -10.5 53.52 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.841 0.311 . . . . 10.0 111.841 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 42.8 mttp -111.02 -45.9 3.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.663 0.268 . . . . 10.0 111.285 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -116.3 95.15 44.52 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 121.178 0.513 . . . . 10.0 110.336 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -72.97 8.91 1.51 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.456 2.104 . . . . 10.0 112.346 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -79.45 -8.47 59.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.132 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 63.7 mt -65.43 -40.24 93.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.242 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 53.93 -97.57 0.07 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.597 -0.728 . . . . 10.0 110.833 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 732' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 736' ' ' ARG . 0.2 OUTLIER -144.55 -57.63 0.36 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.21 -48.75 76.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.981 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 2.3 m -60.14 -33.1 71.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.154 0.502 . . . . 10.0 110.376 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.99 -43.57 98.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.733 -0.667 . . . . 10.0 109.483 178.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 736' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 732' ' ' GLU . 71.0 mtt-85 -65.07 -47.77 76.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.199 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -57.94 -39.91 79.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.474 -0.784 . . . . 10.0 111.335 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 27.9 mmm-85 -62.11 -40.27 95.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.854 0.359 . . . . 10.0 110.45 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 92.2 mt -67.61 -44.35 86.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.526 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 29.1 tp -66.35 -43.14 86.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.016 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.96 -42.7 94.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.803 0.335 . . . . 10.0 110.928 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -64.88 -40.61 95.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.317 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 2.3 p -66.38 -44.6 82.67 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.865 -0.334 . . . . 10.0 110.632 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.6 -38.87 83.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.05 -54.76 42.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.392 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.421 ' HA ' ' HD3' ' A' ' 749' ' ' ARG . 97.0 t -63.65 -34.12 65.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.987 0.423 . . . . 10.0 110.576 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -60.39 -49.95 75.54 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.36 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -65.16 -31.75 73.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.556 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 749' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 746' ' ' VAL . 65.9 mtp180 -67.2 -41.34 85.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.87 -0.605 . . . . 10.0 109.695 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -66.08 -39.97 90.48 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -59.09 -39.12 81.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.053 -0.976 . . . . 10.0 111.725 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.43 -21.25 65.26 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.457 0.54 . . . . 10.0 112.457 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.0 t -87.63 -27.93 5.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.883 0.373 . . . . 10.0 111.463 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 6.6 t -96.77 -42.12 11.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.033 0.444 . . . . 10.0 111.259 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 125.46 130.81 3.52 Favored Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 111.158 -0.777 . . . . 10.0 111.158 -179.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 756' ' ' ALA . . . . . 0.505 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -55.12 -47.12 75.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 10.0 111.707 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.13 -38.57 91.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.163 0.506 . . . . 10.0 110.663 -179.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.5 tpt -69.4 -42.31 75.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.839 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 76.8 mmm -61.12 -39.54 90.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.948 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.505 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.8 mmp_? -60.81 -39.95 90.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.266 0.555 . . . . 10.0 110.011 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 10.9 m-70 -71.11 -33.4 70.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.927 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -67.04 -46.85 73.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.687 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 79.5 mt-10 -59.6 -44.88 93.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.335 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -61.46 -41.08 96.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.173 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -66.81 -43.66 91.1 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.15 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 48.7 t -60.69 -41.45 88.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 120.678 0.275 . . . . 10.0 110.906 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 8.9 mtp -57.64 -49.12 77.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.254 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 60.4 mt -66.65 -40.41 88.67 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.235 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -53.21 -57.12 11.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.751 -0.659 . . . . 10.0 111.312 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 3.7 m -68.72 -35.78 77.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.346 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.26 -54.27 43.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.977 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -62.19 -37.58 85.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.298 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 49.6 m -65.75 -42.45 90.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.816 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 62.9 mt -77.41 -23.83 50.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.611 -0.268 . . . . 10.0 110.908 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -66.14 -51.06 61.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.645 -0.252 . . . . 10.0 110.658 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.441 ' HG3' ' N ' ' A' ' 777' ' ' GLU . 13.5 ptpt -62.45 -34.24 76.41 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.805 0.336 . . . . 10.0 110.324 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 777' ' ' GLU . . . . . 0.441 ' N ' ' HG3' ' A' ' 776' ' ' LYS . 0.9 OUTLIER -70.34 -39.92 74.4 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 178.845 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -60.65 -32.42 71.6 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.929 -0.578 . . . . 10.0 109.986 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 85.0 mt -65.69 -45.81 81.4 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -67.96 -42.4 80.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.125 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.77 -42.93 94.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.936 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 85.1 mmm -64.39 -38.27 90.45 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.024 0.44 . . . . 10.0 109.979 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.58 -40.77 93.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.066 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -64.84 -41.92 95.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.216 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.7 tp -71.59 -35.52 70.56 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.706 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -57.25 -39.36 75.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.145 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.754 179.841 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo . . . . . 0 C--O 1.232 0.22 0 N-CA-C 113.479 0.53 . . . . 10.0 113.479 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 800' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 804' ' ' LYS . 27.4 mtpt -74.28 -46.82 38.79 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.638 -0.504 . . . . 10.0 109.638 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -65.38 -37.94 88.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.538 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -66.33 -41.28 89.85 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -57.54 -44.16 84.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.491 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 804' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 800' ' ' LYS . 95.6 mttt -62.51 -47.24 84.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.857 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 39.3 ttp85 -61.03 -47.6 85.63 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.427 -0.351 . . . . 10.0 111.238 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.26 -47.25 86.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.467 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 8.3 p -65.77 -39.21 90.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.495 -0.321 . . . . 10.0 111.501 -179.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -65.05 -35.65 81.85 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.873 0.368 . . . . 10.0 110.272 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 19.4 m -68.56 -40.79 80.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.206 0.527 . . . . 10.0 109.754 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 13.4 ttm -62.69 -38.42 90.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.609 -0.723 . . . . 10.0 110.241 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -65.28 -44.11 89.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.666 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.78 -49.05 77.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.612 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -61.65 -34.91 76.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.693 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 32.9 ttp -64.59 -43.61 93.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.216 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 97.3 mt -65.97 -40.59 91.38 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.409 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 816' ' ' GLU . . . . . 0.42 ' HA ' ' HE2' ' A' ' 819' ' ' LYS . 37.9 mm-40 -62.94 -39.43 94.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.591 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 19.9 m -76.58 -27.2 55.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.508 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 36.7 tp -62.76 -57.11 12.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.729 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 819' ' ' LYS . . . . . 0.42 ' HE2' ' HA ' ' A' ' 816' ' ' GLU . 53.9 pttt -61.32 -30.06 70.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.478 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -61.73 -56.53 18.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.817 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.55 -31.3 71.29 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.587 -0.278 . . . . 10.0 111.498 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 822' ' ' VAL . . . . . 0.64 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 36.6 t -60.63 -56.95 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 39.5 mm -63.44 -37.28 79.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 121.073 0.463 . . . . 10.0 110.03 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 824' ' ' SER . . . . . 0.505 ' O ' ' HB2' ' A' ' 828' ' ' LYS . 29.4 t -59.78 -53.83 53.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.37 179.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 98.0 m -59.99 -38.69 83.33 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.557 -0.292 . . . . 10.0 111.727 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 826' ' ' LEU . . . . . 0.64 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 94.4 mt -62.03 -29.06 70.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.92 0.39 . . . . 10.0 111.423 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 1.7 m -97.0 -27.92 14.4 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.237 0.541 . . . . 10.0 110.095 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 828' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 824' ' ' SER . 2.0 ttpt -69.8 -19.63 63.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.127 -0.942 . . . . 10.0 111.415 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.8 p -53.2 130.09 14.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 CA-C-O 121.213 0.53 . . . . 10.0 111.183 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 36.3 mm-40 -86.0 113.66 22.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.728 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.816 -179.107 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.5 t80 . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 120.692 0.282 . . . . 10.0 110.7 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.66 163.65 10.68 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 111.569 -0.612 . . . . 10.0 111.569 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.72 117.64 5.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.789 0.328 . . . . 10.0 110.207 179.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -58.21 142.93 46.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.037 -0.528 . . . . 10.0 111.214 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 77.12 -63.16 0.38 Allowed 'General case' 0 N--CA 1.465 0.277 0 O-C-N 124.158 0.911 . . . . 10.0 111.595 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -69.29 -66.51 0.57 Allowed 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.215 0.82 . . . . 10.0 113.215 -177.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -72.57 -26.27 61.66 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -178.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 m -56.81 -45.09 82.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 10.0 111.366 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.3 mt -69.47 -28.81 66.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.398 -0.365 . . . . 10.0 111.731 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -71.71 -49.07 42.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.765 0.317 . . . . 10.0 110.549 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 20' ' ' ARG . 3.0 ttp85 -66.63 -37.04 84.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.406 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.594 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -64.12 -32.99 74.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.251 179.38 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.0 tpp180 -62.1 -36.17 80.92 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.645 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.9 -41.03 97.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.104 -0.498 . . . . 10.0 109.868 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 22.7 t -67.57 -36.79 77.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.999 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 21' ' ' MET . 70.2 t -59.49 -37.3 69.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.08 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -62.95 -43.1 99.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.894 -0.594 . . . . 10.0 109.944 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.4 mt -62.07 -47.12 94.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.268 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 60.5 mt -60.39 -35.9 65.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.804 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -69.38 -34.43 74.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.056 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.482 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -77.61 -26.56 50.74 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.062 0.458 . . . . 10.0 110.744 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 45.8 mtt -79.06 -10.5 59.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.136 -0.483 . . . . 10.0 111.263 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.47 ' CD ' ' HD3' ' A' ' 72' ' ' ARG . 5.8 mt-10 -57.79 -56.89 29.88 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 119.147 -0.454 . . . . 10.0 111.632 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.482 ' HD2' ' O ' ' A' ' 30' ' ' ALA . 50.7 Cg_exo -56.0 -32.31 85.56 Favored 'Trans proline' 0 C--N 1.36 1.141 0 C-N-CA 121.803 1.669 . . . . 10.0 112.022 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -67.05 -46.62 73.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.704 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 24.6 mmt -68.51 -35.6 77.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.823 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -63.13 -29.3 70.68 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.207 0.527 . . . . 10.0 110.253 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -74.34 -31.73 62.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.89 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.4 mp -74.83 136.95 41.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.962 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.6 p -78.55 175.93 9.89 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.894 -0.322 . . . . 10.0 110.497 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -55.64 -51.9 65.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.213 0.449 . . . . 10.0 112.213 -178.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -63.87 -29.6 70.77 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.069 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -67.93 -39.41 83.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.677 0.275 . . . . 10.0 110.308 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -66.04 -40.14 90.75 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -60.75 -38.85 86.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.17 -0.923 . . . . 10.0 109.815 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.01 -26.14 74.11 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.466 -0.788 . . . . 10.0 112.038 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -65.48 -38.78 90.78 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.049 -0.352 . . . . 10.0 110.049 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 17.1 m -62.76 -40.23 96.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.198 0.523 . . . . 10.0 109.75 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.77 -35.76 77.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.06 178.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -62.59 -41.91 99.24 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.077 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -62.96 -39.63 95.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.231 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -59.99 -46.62 88.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.052 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.68 -38.94 80.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.782 -0.644 . . . . 10.0 111.077 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -61.39 -47.61 85.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.97 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.2 mt -62.97 -35.0 78.71 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.146 0.498 . . . . 10.0 110.704 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.61 -42.63 95.41 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.485 -0.78 . . . . 10.0 111.138 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.483 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -83.98 -51.08 7.42 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.005 0.372 . . . . 10.0 112.005 -179.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 171.28 88.13 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.254 -0.975 . . . . 10.0 113.006 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -149.07 148.72 30.02 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.8 t -95.79 131.44 42.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.6 tp -58.77 -41.82 87.52 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.098 0.475 . . . . 10.0 110.636 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -69.46 -11.42 60.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.377 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -93.45 -20.04 20.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.282 0.563 . . . . 10.0 110.371 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 67.3 mt -82.2 -10.78 59.02 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.756 -0.657 . . . . 10.0 111.557 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.545 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 67.4 mt -46.9 -53.33 27.17 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.545 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.5 Cg_exo -54.11 -54.06 5.33 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.736 1.624 . . . . 10.0 113.067 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.431 ' O ' HG23 ' A' ' 70' ' ' VAL . 42.5 mt-10 -68.08 -43.67 78.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 10.0 112.108 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.524 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -62.18 -50.28 72.43 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.805 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -63.08 -33.0 74.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.772 -179.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.78 -45.4 86.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.484 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 66' ' ' GLU . 96.5 t -61.93 -46.68 95.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.134 -0.485 . . . . 10.0 110.211 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 67' ' ' ALA . 45.3 t -60.82 -45.77 97.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.208 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.47 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 5.3 ttm180 -59.45 -43.74 93.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.593 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 -62.88 -47.43 83.35 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.116 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.5 -30.33 71.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.849 -0.614 . . . . 10.0 111.124 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.9 m -61.78 -35.62 78.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.756 0.313 . . . . 10.0 111.185 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.494 ' O ' ' HA2' ' A' ' 80' ' ' GLY . 51.2 mtmt -76.41 -28.85 56.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.532 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -88.28 -43.81 11.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.352 -0.386 . . . . 10.0 111.931 -178.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 90.4 t -77.11 -62.81 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.828 0.347 . . . . 10.0 111.694 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -83.05 -41.6 18.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.384 -178.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . 0.494 ' HA2' ' O ' ' A' ' 76' ' ' LYS . . . 100.33 29.58 6.65 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.888 -0.672 . . . . 10.0 111.868 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 47.1 ttm -144.27 127.95 17.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.701 0.286 . . . . 10.0 110.39 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 29.4 ttp85 -71.48 126.23 29.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.202 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.38 117.46 3.84 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.803 -0.443 . . . . 10.0 109.803 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -57.06 147.16 25.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.315 0.578 . . . . 10.0 111.636 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -63.89 -32.52 74.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.198 -0.91 . . . . 10.0 111.79 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.67 -26.64 31.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.033 0.444 . . . . 10.0 110.728 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.52 HE22 HD23 ' A' ' 110' ' ' LEU . 92.9 mt-30 -74.14 -31.05 62.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.265 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.405 HD11 ' CZ ' ' A' ' 72' ' ' ARG . 92.8 mt -63.45 -37.65 88.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.153 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.0 mt -65.04 -49.53 69.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.426 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -64.51 -44.68 94.82 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.733 -0.667 . . . . 10.0 112.554 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.33 -31.23 80.17 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.082 -0.58 . . . . 10.0 112.566 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.594 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 16.3 ttm -70.14 -37.74 75.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.763 0.316 . . . . 10.0 110.69 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 91.8 t -72.87 -29.14 28.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.149 0.5 . . . . 10.0 110.198 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 mt -70.63 -5.57 30.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.715 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -80.41 -25.74 38.86 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.03 -0.729 . . . . 10.0 109.03 178.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -93.96 177.49 5.97 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.319 -0.855 . . . . 10.0 110.179 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.587 ' HG2' ' CD2' ' A' ' 407' ' ' LEU . 13.7 ttt85 -86.57 75.36 9.73 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.097 -0.501 . . . . 10.0 109.708 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 85.6 m -147.94 174.94 11.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.114 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.445 HD12 HG11 ' A' ' 211' ' ' VAL . 40.9 mm -112.72 134.39 55.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.619 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -112.36 119.73 39.28 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.869 0.366 . . . . 10.0 111.375 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -89.89 106.05 18.21 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.422 ' O ' ' HA2' ' A' ' 392' ' ' GLY . 35.4 ttm -103.3 151.47 22.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.095 0.474 . . . . 10.0 110.665 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.505 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 0.2 OUTLIER -85.52 149.68 25.21 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.758 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.78 107.28 5.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.982 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 133.66 -25.66 3.56 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.775 -0.726 . . . . 10.0 112.705 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.609 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 1.2 mm-40 -74.31 -21.17 59.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.818 0.342 . . . . 10.0 110.983 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.33 85.39 1.87 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.638 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.498 ' HD2' ' SD ' ' A' ' 390' ' ' MET . 8.4 mtmt -62.97 -65.88 0.62 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.925 0.393 . . . . 10.0 111.852 -179.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -60.09 -30.03 68.98 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.162 0.43 . . . . 10.0 112.162 -178.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.52 HD23 HE22 ' A' ' 87' ' ' GLN . 35.0 tp -68.01 -25.82 65.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.787 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 60.6 m -89.69 -28.95 19.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.008 0.432 . . . . 10.0 111.07 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.12 -11.46 49.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.976 -0.556 . . . . 10.0 112.492 -179.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 14.9 p -74.98 -23.73 58.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.797 0.332 . . . . 10.0 111.622 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 38.1 mt -68.24 -57.87 8.34 Favored Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -65.46 -26.64 54.93 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.888 1.725 . . . . 10.0 112.098 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -67.67 -48.44 66.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.822 -0.627 . . . . 10.0 110.784 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.426 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 55.2 t80 -60.85 -45.4 94.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.644 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 32.0 tp -59.87 -52.34 65.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.02 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -70.49 -20.62 62.84 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 111.971 0.36 . . . . 10.0 111.971 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.546 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -73.52 -27.59 61.45 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.497 -0.32 . . . . 10.0 110.743 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 69.3 mt -57.49 -35.5 70.29 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.985 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -20.84 66.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.71 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.41 25.76 75.19 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.926 -0.654 . . . . 10.0 112.677 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -96.41 -10.88 26.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.736 0.303 . . . . 10.0 110.932 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 94.3 112.66 2.41 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.728 -0.749 . . . . 10.0 113.343 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.5 t -88.21 113.57 25.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.428 -0.582 . . . . 10.0 109.428 178.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -89.52 100.4 13.2 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.971 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 29.8 t -91.59 114.44 28.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.975 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 54.8 t -97.69 118.49 44.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.508 -179.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.43 148.54 34.15 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.629 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.66 -31.55 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 112.191 0.441 . . . . 10.0 112.191 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -149.92 166.09 30.65 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.667 0.27 . . . . 10.0 110.801 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -72.64 -23.47 60.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.696 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -55.8 -54.56 43.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.691 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.3 mt -73.72 -35.87 65.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.564 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.64 -52.3 64.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.077 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -69.28 -39.47 78.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.601 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 138' ' ' ARG . 4.1 ttp85 -53.83 -55.64 24.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.134 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.93 -28.94 61.76 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.741 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.81 85.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.967 0.413 . . . . 10.0 110.783 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -90.54 -32.17 16.43 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.051 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -68.42 -42.62 78.68 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.933 0.397 . . . . 10.0 111.291 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -89.51 2.91 53.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.222 -0.444 . . . . 10.0 111.105 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.457 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 56.3 ttm-85 -63.62 -48.18 81.08 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.79 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' PRO . . . . . 0.457 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 16.3 Cg_exo -68.73 8.73 0.52 Allowed 'Trans proline' 0 C--N 1.361 1.216 0 C-N-CA 122.21 1.94 . . . . 10.0 112.618 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.7 tp -111.59 -57.84 2.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.138 -0.483 . . . . 10.0 109.863 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -71.11 -49.43 44.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.65 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.13 -13.51 62.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.23 0.538 . . . . 10.0 110.601 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -78.62 -39.81 36.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.901 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 92.4 mt -81.86 -37.75 26.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.405 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 139.26 29.15 0.22 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.075 -1.06 . . . . 10.0 113.277 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 88.8 mt -119.94 123.2 42.97 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.62 127.43 32.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.19 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.407 ' HB ' ' NH1' ' A' ' 144' ' ' ARG . 14.7 t -104.68 107.02 21.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.474 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -105.31 143.23 15.64 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.841 -0.695 . . . . 10.0 111.999 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.4 tp -117.02 123.71 72.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.051 0.453 . . . . 10.0 110.544 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -101.69 115.19 29.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.134 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 85.2 mt -103.99 144.86 29.54 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.035 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' PRO . . . . . 0.514 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 23.5 Cg_endo -62.06 112.52 1.55 Allowed 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.623 2.215 . . . . 10.0 111.937 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 96.99 8.7 56.7 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.874 -0.679 . . . . 10.0 112.434 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 43.3 ttm -68.31 135.93 91.18 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.428 -0.212 . . . . 10.0 110.428 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -50.45 144.29 24.97 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.799 2.333 . . . . 10.0 112.573 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . 0.441 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.46 -48.24 90.58 Favored Pre-proline 0 CA--C 1.54 0.573 0 N-CA-C 113.359 0.874 . . . . 10.0 113.359 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.441 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.4 Cg_exo -57.1 -33.36 95.65 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 121.789 1.659 . . . . 10.0 112.584 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.44 -38.99 48.29 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -59.61 -42.99 93.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.797 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -58.81 -32.9 69.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.437 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -75.72 -38.33 58.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.893 0.378 . . . . 10.0 110.417 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.27 -38.69 88.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.628 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -79.58 -24.28 42.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.194 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -75.24 -11.82 60.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.139 0.495 . . . . 10.0 110.285 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -72.69 173.33 9.18 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.471 -0.786 . . . . 10.0 110.28 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . 0.546 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 5.1 m-20 -77.36 -36.01 54.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.088 0.47 . . . . 10.0 109.826 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 76.1 mt -130.02 128.3 64.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.911 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 9.4 m -119.4 117.54 28.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.915 0.388 . . . . 10.0 111.527 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -94.29 133.06 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.638 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -167.61 164.68 38.12 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.126 -1.035 . . . . 10.0 113.131 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.56 150.11 28.33 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 122.275 0.23 . . . . 10.0 110.972 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -57.98 -41.07 82.2 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -51.81 66.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.506 -0.315 . . . . 10.0 111.261 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.514 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 4.4 tp10 -64.33 -36.96 85.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.954 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.28 -34.84 72.75 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.019 0.438 . . . . 10.0 110.543 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -77.66 -41.16 20.48 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 111.298 -0.721 . . . . 10.0 111.298 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -62.44 -39.47 93.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.339 . . . . 10.0 110.485 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -61.26 -41.78 97.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.579 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -64.16 -35.96 82.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.178 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 62.5 mt -68.95 -42.88 76.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.666 -0.697 . . . . 10.0 110.29 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 62.3 mtm-85 -67.04 -41.36 86.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.559 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.82 -39.92 90.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.758 -0.656 . . . . 10.0 110.731 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -83.86 7.97 16.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.694 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.98 5.27 13.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.909 0.385 . . . . 10.0 110.736 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -78.34 168.32 20.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.629 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -110.45 -24.29 10.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.208 0.528 . . . . 10.0 110.271 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.89 138.36 30.41 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.46 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 195' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 667' ' ' LEU . 16.1 Cg_endo -59.05 -23.31 68.2 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.628 2.218 . . . . 10.0 112.377 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -77.49 -7.07 55.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.246 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -94.36 0.2 55.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.8 0.333 . . . . 10.0 110.476 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 198' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 198' ' ' ARG . 43.6 mtt85 -62.88 158.84 18.04 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.151 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 16.7 m -134.8 -19.21 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.908 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -84.93 175.77 8.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.218 0.532 . . . . 10.0 111.654 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.43 -179.19 5.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.6 -0.727 . . . . 10.0 109.67 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -61.73 129.75 42.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.026 0.441 . . . . 10.0 111.05 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . 0.4 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . 22.3 mt -84.11 63.51 7.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.387 0.613 . . . . 10.0 110.154 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -80.3 -53.42 6.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.738 -0.665 . . . . 10.0 112.03 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -130.97 137.58 49.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.981 0.42 . . . . 10.0 111.416 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.588 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -133.13 121.3 22.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.416 -0.811 . . . . 10.0 109.703 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 57.7 tp -122.91 113.48 19.16 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 208' ' ' VAL . . . . . 0.468 HG22 ' H ' ' A' ' 210' ' ' GLU . 9.0 p -97.0 139.34 19.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.594 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.73 -27.61 62.15 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.591 -179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 210' ' ' GLU . . . . . 0.541 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 4.4 tp10 -145.76 134.09 21.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.113 0.482 . . . . 10.0 110.954 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.652 HG22 ' HB ' ' A' ' 391' ' ' THR . 3.4 m -102.37 -17.95 6.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.335 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 212' ' ' ASP . . . . . 0.401 ' OD1' ' HD2' ' A' ' 566' ' ' ARG . 3.8 t70 -60.04 -68.41 0.29 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.52 -0.764 . . . . 10.0 111.574 -179.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . 0.433 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 0.8 OUTLIER -84.58 22.57 1.28 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.561 0.578 . . . . 10.0 112.561 -178.22 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 45.4 mt -138.05 -66.22 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 112.545 0.572 . . . . 10.0 112.545 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 27.0 mt -70.28 -46.05 65.12 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.495 0.554 . . . . 10.0 112.495 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 50.8 mm -85.51 -47.36 16.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.882 -0.327 . . . . 10.0 111.759 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 217' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 0.3 OUTLIER -69.98 -59.63 2.79 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -178.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -85.38 46.59 1.31 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.005 0.431 . . . . 10.0 111.78 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -76.51 -53.19 8.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.389 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 220' ' ' ARG . . . . . 0.458 ' O ' ' HD3' ' A' ' 220' ' ' ARG . 0.2 OUTLIER -105.85 46.68 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.227 0.537 . . . . 10.0 110.837 -179.08 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 2.9 m -107.55 102.44 44.52 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.583 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -88.83 132.44 2.41 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.802 2.335 . . . . 10.0 113.578 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 223' ' ' LEU . . . . . . . . . . . . . 96.7 mt -82.62 93.12 7.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.147 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 29.2 mt -92.74 125.8 45.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.051 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 2.6 mt . . . . . 0 C--N 1.326 -0.431 0 N-CA-C 109.416 -0.587 . . . . 10.0 109.416 179.655 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.705 0.288 . . . . 10.0 110.735 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 374' ' ' SER . . . . . . . . . . . . . 8.8 t -164.22 161.84 22.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.239 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.6 tt -157.73 148.46 9.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.38 . . . . 10.0 110.489 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.14 143.06 29.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.619 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -56.06 -50.64 70.4 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 123.126 0.266 . . . . 10.0 111.356 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -53.45 -47.64 69.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.101 -0.499 . . . . 10.0 111.402 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -67.18 -31.11 71.28 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.202 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -70.27 -41.42 73.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.509 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -72.78 -19.26 61.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.047 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 72.1 mtp180 -77.12 -5.85 50.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.735 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.417 HD21 HH22 ' A' ' 656' ' ' ARG . 47.1 mt -96.79 7.58 46.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.798 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . 0.588 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 21.2 m-85 -99.51 151.36 21.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.733 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -78.95 -76.36 0.2 Allowed 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 76.1 mttt -90.41 90.3 7.97 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.412 ' H ' ' HG3' ' A' ' 97' ' ' ARG . 57.7 tp -95.73 109.55 21.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.768 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -125.66 154.08 42.88 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.692 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -155.24 143.97 10.5 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.539 -0.839 . . . . 10.0 112.192 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 390' ' ' MET . . . . . 0.498 ' SD ' ' HD2' ' A' ' 108' ' ' LYS . 33.4 ttm -114.0 128.93 56.61 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 391' ' ' THR . . . . . 0.652 ' HB ' HG22 ' A' ' 211' ' ' VAL . 5.7 t -122.75 -175.35 3.14 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 121.147 -0.221 . . . . 10.0 110.574 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 392' ' ' GLY . . . . . 0.422 ' HA2' ' O ' ' A' ' 102' ' ' MET . . . -103.4 165.54 15.8 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 110.979 -0.848 . . . . 10.0 110.979 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 393' ' ' THR . . . . . 0.454 ' OG1' ' HA ' ' A' ' 103' ' ' ARG . 1.0 OUTLIER -62.17 103.46 0.38 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.845 0.355 . . . . 10.0 111.074 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -151.61 -27.97 0.18 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.471 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 18.2 t70 54.39 -118.93 1.38 Allowed 'General case' 0 CA--C 1.535 0.377 0 O-C-N 123.374 0.421 . . . . 10.0 110.318 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 4.7 m 64.74 -96.66 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -81.62 36.87 0.45 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.912 0.387 . . . . 10.0 111.452 -178.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -64.5 -20.14 66.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.081 0.467 . . . . 10.0 110.961 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -81.74 -24.73 35.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.128 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -65.44 -38.3 89.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.733 0.302 . . . . 10.0 110.983 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -57.97 -47.26 83.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.171 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 4.9 m -75.83 -9.19 58.4 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.503 0.557 . . . . 10.0 112.503 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.2 m -102.77 -53.24 2.9 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.01 0.374 . . . . 10.0 112.01 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 60.3 mt -82.58 -50.41 15.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 112.809 0.67 . . . . 10.0 112.809 -177.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -94.97 -8.82 35.82 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm 62.09 43.34 8.91 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.834 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 407' ' ' LEU . . . . . 0.587 ' CD2' ' HG2' ' A' ' 97' ' ' ARG . 14.6 mt -117.66 140.92 49.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.36 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -88.98 128.85 35.71 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 110.067 -0.345 . . . . 10.0 110.067 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 2.1 m -87.13 101.2 13.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.984 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 38.2 t -96.57 133.86 36.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.607 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 15.3 t -88.68 122.23 39.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.934 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 48.6 t -87.22 130.15 48.95 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.219 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.83 150.21 86.06 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.719 2.279 . . . . 10.0 112.336 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 17.4 p -79.83 157.73 26.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.881 -0.599 . . . . 10.0 111.426 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -66.75 -40.46 88.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.334 0.588 . . . . 10.0 109.708 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 69.5 mtm180 -125.49 153.47 72.51 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.764 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -63.46 117.93 4.87 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.368 2.045 . . . . 10.0 111.413 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 30.9 mtm -66.33 114.14 5.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.557 -179.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 419' ' ' ILE . . . . . 0.476 ' HB ' ' HA ' ' A' ' 581' ' ' ALA . 0.7 OUTLIER -96.37 41.89 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.317 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -81.37 101.11 9.61 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.441 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -76.98 100.16 5.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.482 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -80.03 131.51 35.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.797 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 40.2 mt -116.04 149.14 42.87 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -62.47 169.21 8.54 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 122.85 2.367 . . . . 10.0 113.712 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -86.54 116.12 24.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.374 -0.83 . . . . 10.0 109.857 179.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 426' ' ' LEU . 25.2 mt -92.28 88.22 6.37 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.181 0.515 . . . . 10.0 110.273 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 15.8 t -83.38 125.18 40.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.474 -0.785 . . . . 10.0 110.11 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 428' ' ' TYR . . . . . 0.53 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 10.2 m-85 -111.99 179.5 3.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.511 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 4.3 mmt -70.53 -75.86 0.11 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.909 0.385 . . . . 10.0 111.923 -178.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 41.1 p -90.58 165.62 13.65 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.71 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 431' ' ' GLU . . . . . 0.431 ' HG3' ' HE2' ' A' ' 434' ' ' LYS . 8.0 tt0 -67.32 -26.88 66.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.547 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -61.1 -44.5 97.26 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.031 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -63.21 -40.83 98.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.572 -0.74 . . . . 10.0 110.21 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 434' ' ' LYS . . . . . 0.484 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 39.7 ttpt -59.72 -50.54 73.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.468 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 435' ' ' ILE . . . . . 0.537 ' O ' HG12 ' A' ' 439' ' ' ILE . 48.5 mm -65.44 -43.7 94.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.859 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -39.69 89.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.746 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.87 -33.92 76.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.026 0.441 . . . . 10.0 110.441 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 438' ' ' ILE . . . . . 0.406 HG23 HG21 ' A' ' 557' ' ' ILE . 89.1 mt -66.23 -45.49 89.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.688 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 439' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 435' ' ' ILE . 33.5 mm -62.38 -36.38 74.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.348 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -64.04 -45.54 88.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.378 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -61.76 -40.77 96.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.469 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.434 HG12 HG11 ' A' ' 452' ' ' VAL . 78.7 mt -72.13 -38.03 61.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.901 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 14.2 tttm -53.01 -38.68 62.55 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.918 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 444' ' ' GLU . . . . . 0.503 ' O ' ' HE2' ' A' ' 448' ' ' LYS . 61.8 mm-40 -78.0 -45.05 24.83 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.918 0.39 . . . . 10.0 111.959 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 43.1 mtt-85 -68.14 -29.89 68.89 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 -177.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 1.6 p -68.69 -35.05 76.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.134 0.492 . . . . 10.0 110.268 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.97 -15.01 49.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.49 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 448' ' ' LYS . . . . . 0.503 ' HE2' ' O ' ' A' ' 444' ' ' GLU . 0.2 OUTLIER -90.46 -31.44 16.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.627 179.804 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 105.57 23.55 7.49 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.766 -0.731 . . . . 10.0 112.964 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 450' ' ' GLN . . . . . 0.44 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 64.3 tt0 -104.64 127.76 28.27 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.896 0.348 . . . . 10.0 110.887 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 451' ' ' PRO . . . . . 0.409 ' HB3' ' O ' ' A' ' 496' ' ' TYR . 38.2 Cg_endo -68.25 140.01 47.64 Favored 'Trans proline' 0 C--O 1.237 0.466 0 C-N-CA 122.625 2.217 . . . . 10.0 111.372 178.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 452' ' ' VAL . . . . . 0.434 HG11 HG12 ' A' ' 442' ' ' ILE . 77.4 t -125.28 130.78 72.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.086 0.47 . . . . 10.0 111.695 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 55.8 tp -114.66 106.61 14.44 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 40.9 t -92.73 117.82 36.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.508 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -96.89 127.75 9.31 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.597 -0.811 . . . . 10.0 111.738 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 10.1 p -120.61 137.0 54.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.589 0.233 . . . . 10.0 110.556 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 34.5 pt -93.6 -25.61 4.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.053 0.454 . . . . 10.0 110.486 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 4.0 p -115.62 133.54 55.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.102 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 20.5 mt -62.79 -32.84 57.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.256 0.55 . . . . 10.0 110.22 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.456 ' CD ' ' H ' ' A' ' 460' ' ' GLU . 1.9 mp0 -59.57 -35.03 73.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.606 -0.724 . . . . 10.0 110.577 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.91 -32.33 51.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.773 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.4 m -61.25 -42.55 98.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.049 0.452 . . . . 10.0 110.089 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -70.68 -35.45 72.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.179 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.64 -51.6 54.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.79 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 14.2 p -62.51 -35.44 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.71 0.29 . . . . 10.0 110.743 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 60.3 m -65.71 -39.74 91.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.574 -0.284 . . . . 10.0 110.407 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -58.46 -43.26 88.79 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.957 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -71.44 -35.42 70.92 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.64 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 47.5 mt -65.6 -44.22 87.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.553 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 3.1 m -67.8 -30.31 69.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.202 0.525 . . . . 10.0 109.886 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -66.1 -38.78 89.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.395 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -84.96 -3.09 58.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.986 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 72.83 36.24 57.91 Favored Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.88 -0.6 . . . . 10.0 112.483 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 88.5 mt -104.42 123.61 58.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 120.622 0.249 . . . . 10.0 110.67 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -64.21 139.37 58.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.403 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -159.8 145.04 15.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.918 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -117.17 125.47 51.25 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . 0.448 HG22 HD12 ' A' ' 502' ' ' ILE . 4.5 t -100.08 140.23 19.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.158 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 90.3 mt -94.02 151.61 19.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.101 -0.5 . . . . 10.0 109.752 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -161.71 130.12 4.29 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -58.18 -19.6 34.52 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -80.46 -6.83 58.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.938 0.399 . . . . 10.0 110.723 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' PHE . . . . . 0.435 ' O ' ' HG3' ' A' ' 487' ' ' GLU . 54.6 m-85 -131.07 45.96 2.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.45 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 9.2 m80 -51.32 -41.1 60.31 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.896 -179.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -63.64 -30.91 71.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.846 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -81.81 -38.12 26.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.918 0.39 . . . . 10.0 110.395 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 483' ' ' PHE . 53.8 mt-10 -55.6 -37.41 68.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.27 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -54.66 -41.48 70.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.592 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.26 -29.14 42.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.986 0.422 . . . . 10.0 111.092 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.1 mt -73.22 -53.3 18.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.308 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 68.6 t -60.48 -35.49 63.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.949 0.404 . . . . 10.0 111.239 -179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -64.08 -26.33 68.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.363 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -115.8 19.07 15.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.822 0.344 . . . . 10.0 110.888 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.74 -17.32 62.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.056 0.455 . . . . 10.0 111.045 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -93.89 8.65 73.5 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.851 -0.69 . . . . 10.0 112.086 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' TYR . . . . . 0.409 ' O ' ' HB3' ' A' ' 451' ' ' PRO . 61.7 t80 -68.72 138.55 90.76 Favored Pre-proline 0 C--N 1.325 -0.465 0 N-CA-C 110.271 -0.27 . . . . 10.0 110.271 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.84 128.13 29.16 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.642 2.228 . . . . 10.0 112.682 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.61 14.18 8.23 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.561 -0.745 . . . . 10.0 112.808 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.92 133.76 34.59 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.879 0.371 . . . . 10.0 110.351 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 25.9 t -111.62 113.45 44.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.375 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.9 m -111.79 134.17 53.53 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.502 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 502' ' ' ILE . . . . . 0.448 HD12 HG22 ' A' ' 478' ' ' VAL . 80.1 mt -111.63 117.62 55.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.787 0.327 . . . . 10.0 110.133 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -97.9 121.3 39.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.087 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 2.7 m -98.94 109.72 22.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.868 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 55.81 67.33 1.02 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.391 0.615 . . . . 10.0 111.002 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 38.6 tpp -76.3 128.57 35.15 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.699 -0.682 . . . . 10.0 111.136 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -76.68 179.75 5.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.789 -0.642 . . . . 10.0 111.448 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -68.59 160.82 51.44 Favored Glycine 0 CA--C 1.52 0.402 0 CA-C-N 116.029 -0.532 . . . . 10.0 113.357 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.541 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 99.1 mtt180 65.15 -82.72 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.54 0.736 . . . . 10.0 111.895 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 81.07 155.75 13.26 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.961 -0.638 . . . . 10.0 112.717 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.05 154.28 41.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.77 0.319 . . . . 10.0 111.009 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -75.66 109.9 9.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.367 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 45.9 mt -78.47 118.42 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.157 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 2.7 t -86.65 128.65 39.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.805 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 60.7 mt -74.05 133.31 42.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.33 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 83.78 15.72 69.76 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.274 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 95.43 -170.54 28.53 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.629 -0.796 . . . . 10.0 111.475 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 2.8 p -134.1 94.58 3.27 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.944 0.372 . . . . 10.0 110.896 -179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 519' ' ' TRP . . . . . 0.408 ' O ' HG22 ' A' ' 523' ' ' VAL . 21.9 p-90 -56.57 -30.07 62.75 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.826 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -61.25 -40.66 94.9 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.986 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.37 -24.55 39.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.972 0.415 . . . . 10.0 110.873 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -77.43 -46.87 21.27 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.98 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 519' ' ' TRP . 33.8 m -69.62 -26.41 30.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.861 0.362 . . . . 10.0 110.94 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -84.79 -5.61 59.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.432 . . . . 10.0 110.78 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -89.65 -9.73 48.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.481 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 11.2 mt -82.16 158.33 23.67 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.311 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.99 -28.87 32.39 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 178.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -146.75 92.35 5.07 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.461 -0.791 . . . . 10.0 109.759 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.5 92.48 1.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.449 2.1 . . . . 10.0 112.688 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -75.09 153.96 38.09 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.205 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -57.11 -35.68 69.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.979 0.419 . . . . 10.0 110.915 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -66.81 -43.95 82.46 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.15 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -69.12 -40.63 78.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.925 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.19 -44.08 94.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.32 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.55 -39.78 94.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.355 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -59.95 -53.37 58.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.736 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 94.0 mt -63.66 -39.1 84.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.74 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -61.97 -41.19 97.73 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.263 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.48 86.01 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.372 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . 0.593 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 40.7 m-20 -60.69 -46.21 91.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.777 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 541' ' ' TRP . . . . . 0.416 ' CZ2' ' HD2' ' A' ' 545' ' ' HIS . 70.6 t90 -58.58 -41.03 84.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.318 -0.856 . . . . 10.0 110.558 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -58.37 -43.54 88.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.622 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.84 -45.03 96.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.149 0.499 . . . . 10.0 110.019 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 544' ' ' ARG . . . . . 0.593 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 14.6 mtm180 -63.68 -38.96 93.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.547 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 545' ' ' HIS . . . . . 0.416 ' HD2' ' CZ2' ' A' ' 541' ' ' TRP . 6.3 t-80 -66.25 -39.41 89.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.094 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -66.24 -40.03 89.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.157 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -58.85 -43.44 90.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.876 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 548' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 544' ' ' ARG . 65.1 t -62.57 -35.89 72.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.79 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 545' ' ' HIS . 99.7 mt -64.33 -43.66 93.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.005 0.431 . . . . 10.0 110.225 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -71.14 -29.49 65.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.673 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 551' ' ' ALA . . . . . 0.44 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -70.02 -35.74 74.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.951 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 129.49 18.08 1.67 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.484 -0.865 . . . . 10.0 113.04 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 75.31 -169.94 54.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.828 -0.701 . . . . 10.0 112.55 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.433 ' HB3' ' OG ' ' A' ' 575' ' ' SER . 54.3 tp -75.5 126.08 30.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.928 0.394 . . . . 10.0 110.115 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -95.36 120.53 35.75 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.936 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 35.1 mm -98.04 128.3 49.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.596 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 557' ' ' ILE . . . . . 0.406 HG21 HG23 ' A' ' 438' ' ' ILE . 17.1 mt -119.34 125.75 74.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.384 . . . . 10.0 110.186 178.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -107.41 117.23 5.17 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.625 -0.798 . . . . 10.0 112.094 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 3.4 p -70.71 -48.12 56.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.539 0.685 . . . . 10.0 109.757 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.55 140.07 35.13 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.608 -1.178 . . . . 10.0 108.676 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 561' ' ' ARG . . . . . 0.512 ' HB2' HD22 ' A' ' 594' ' ' LEU . 77.8 mtt-85 -78.65 164.05 24.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.824 0.345 . . . . 10.0 110.18 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -86.98 153.26 21.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.198 -0.455 . . . . 10.0 109.839 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.89 -44.1 81.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.122 0.487 . . . . 10.0 110.026 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 58.7 m -99.53 142.23 31.28 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.488 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 565' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 565' ' ' ARG . 0.0 OUTLIER -68.84 -27.88 66.23 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.538 -179.555 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 566' ' ' ARG . . . . . 0.401 ' HD2' ' OD1' ' A' ' 212' ' ' ASP . 8.9 ttm180 -59.98 -51.22 70.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.107 0.479 . . . . 10.0 110.391 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 13.2 mt -72.59 -25.36 22.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.269 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -69.51 -50.62 43.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.069 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 17.1 m-20 -62.7 -37.67 87.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.03 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -58.86 -33.02 69.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.918 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.409 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 39.5 tp -78.49 -35.21 46.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.876 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -74.11 -30.43 62.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.898 0.38 . . . . 10.0 111.114 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.61 17.52 14.61 Favored Glycine 0 CA--C 1.521 0.426 0 C-N-CA 121.082 -0.58 . . . . 10.0 114.015 -178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 574' ' ' ARG . . . . . 0.409 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 1.2 mmt180 -72.17 -41.59 66.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 117.595 0.697 . . . . 10.0 110.557 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . 0.433 ' OG ' ' HB3' ' A' ' 554' ' ' LEU . 19.4 t -87.61 161.27 17.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.475 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 73.43 36.32 55.01 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.147 -0.549 . . . . 10.0 112.794 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -61.61 130.44 45.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.442 0.163 . . . . 10.0 111.027 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 578' ' ' GLN . . . . . 0.609 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 17.5 tt0 64.03 19.7 11.87 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.635 0.584 . . . . 10.0 111.23 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 87.41 51.34 3.33 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.634 -0.793 . . . . 10.0 112.821 179.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -105.76 -168.83 1.5 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.847 -0.208 . . . . 10.0 110.484 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 581' ' ' ALA . . . . . 0.476 ' HA ' ' HB ' ' A' ' 419' ' ' ILE . . . -88.45 155.23 19.79 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.122 0.487 . . . . 10.0 111.72 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 173.72 177.47 42.95 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.734 -0.667 . . . . 10.0 111.612 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.9 p -153.87 134.43 13.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.823 0.312 . . . . 10.0 110.614 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.88 124.05 49.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.596 -0.274 . . . . 10.0 111.078 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 585' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 3.6 tpm_? -131.19 115.92 17.0 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.951 -0.389 . . . . 10.0 109.951 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -114.5 151.14 33.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.015 0.436 . . . . 10.0 111.285 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 587' ' ' TYR . . . . . 0.484 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 86.4 m-85 -132.54 169.25 16.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.378 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 10.8 tp -168.22 162.16 12.65 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.169 0.293 . . . . 10.0 110.24 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 589' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.8 OUTLIER -113.59 157.31 22.25 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.019 -0.363 . . . . 10.0 110.019 178.796 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 590' ' ' MET . . . . . 0.438 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 70.6 mmm -71.87 -14.21 61.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.162 0.506 . . . . 10.0 111.276 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -121.26 24.18 10.13 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.673 -0.694 . . . . 10.0 109.314 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 592' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 589' ' ' SER . 0.9 OUTLIER -74.14 169.04 18.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.194 -0.912 . . . . 10.0 111.373 -179.099 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -69.18 -34.46 74.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 594' ' ' LEU . . . . . 0.615 ' O ' HG12 ' A' ' 597' ' ' ILE . 10.8 tp -69.87 -21.64 63.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.236 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 3.5 mmt -75.59 -5.86 47.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.097 0.475 . . . . 10.0 110.832 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -93.27 -11.08 33.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.461 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 597' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 594' ' ' LEU . 19.0 pt -74.53 -8.79 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 121.138 0.495 . . . . 10.0 110.539 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -79.19 -10.15 59.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.522 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 72.88 -53.86 0.7 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.923 0.764 . . . . 10.0 111.512 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 31.1 t -89.58 134.84 33.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.498 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -85.01 -4.3 59.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.151 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.66 -33.93 75.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.327 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 21.4 t -65.39 -50.81 70.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.216 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 604' ' ' SER . . . . . 0.497 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 0.2 OUTLIER -63.42 -38.96 93.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.848 179.946 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -68.5 -30.37 73.14 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.822 -0.704 . . . . 10.0 112.639 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 41.0 tpp -81.42 -38.35 26.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.712 0.291 . . . . 10.0 111.27 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 46.9 mtt -66.63 -16.85 64.49 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.545 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 608' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 604' ' ' SER . 33.6 mtt180 -68.45 -15.58 63.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.896 0.379 . . . . 10.0 110.936 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -87.04 23.44 1.77 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.277 -0.42 . . . . 10.0 111.2 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 49.0 tp -93.08 -14.58 27.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.076 0.465 . . . . 10.0 110.589 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 611' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 92.13 -48.88 2.71 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.992 -0.623 . . . . 10.0 111.919 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 612' ' ' MET . . . . . 0.438 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.0 OUTLIER 73.55 -55.01 0.68 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.647 0.779 . . . . 10.0 112.01 179.057 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 15.3 mmtp 59.35 80.74 0.26 Allowed Pre-proline 0 N--CA 1.464 0.273 0 O-C-N 123.475 0.484 . . . . 10.0 111.847 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 614' ' ' PRO . . . . . 0.53 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 21.4 Cg_endo -62.9 95.29 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.629 2.22 . . . . 10.0 112.103 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 140.16 -24.2 2.69 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.21 -0.904 . . . . 10.0 111.03 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -114.38 113.56 24.69 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.73 -0.47 . . . . 10.0 109.73 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -66.32 110.4 3.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.827 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 4.5 tp -67.99 -30.4 48.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.734 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 43.55 74.85 0.11 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.615 0.766 . . . . 10.0 112.643 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -120.44 99.53 47.88 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.66 -26.43 72.71 Favored 'Trans proline' 0 N--CA 1.475 0.403 0 C-N-CA 123.494 2.796 . . . . 10.0 114.584 -178.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 43.3 p-90 -63.06 -24.72 68.04 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.837 -0.345 . . . . 10.0 111.523 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 65.9 t -63.2 -45.83 97.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-O 120.996 0.427 . . . . 10.0 110.115 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 51.6 m -62.08 -36.18 80.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.484 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -67.85 -38.27 82.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.289 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -64.68 -45.71 85.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.836 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 98.6 mt -65.46 -37.57 80.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.136 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -57.92 -41.01 81.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.002 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -70.75 -38.94 73.52 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.895 -0.409 . . . . 10.0 109.895 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.41 89.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.343 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -63.12 -42.24 99.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.076 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -61.9 -32.45 72.83 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.159 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 633' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 637' ' ' ARG . 43.1 mttm -63.75 -37.54 87.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.425 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 40.0 t -61.83 -47.81 91.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.417 ' H ' ' HG2' ' A' ' 635' ' ' GLU . 0.8 OUTLIER -61.99 -40.84 97.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.721 179.254 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 28.3 m -61.56 -35.3 77.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.349 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 637' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 633' ' ' LYS . 72.4 mtt180 -67.22 -48.71 67.03 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -60.46 -42.49 96.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.512 -0.767 . . . . 10.0 110.445 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -56.21 -44.32 79.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.745 -0.662 . . . . 10.0 110.762 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.6 -42.67 99.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.298 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 71.3 mt -58.77 -53.41 47.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.231 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 642' ' ' ARG . . . . . 0.471 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 0.0 OUTLIER -69.02 -27.92 66.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.643 0.259 . . . . 10.0 110.711 -179.792 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -66.78 -38.4 86.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.259 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -68.07 -32.01 72.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.033 0.444 . . . . 10.0 110.141 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 95.5 mt -71.53 -26.29 62.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.384 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 646' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 89.2 mt -62.69 -32.85 74.01 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.383 179.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -64.48 -13.53 52.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.855 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -107.3 -46.22 3.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.115 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -73.3 -29.28 62.6 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 -177.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -64.87 -34.78 79.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.038 0.447 . . . . 10.0 109.835 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 651' ' ' VAL . . . . . 0.402 HG21 ' HG2' ' A' ' 804' ' ' LYS . 16.7 t -65.02 -43.07 96.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.738 -0.665 . . . . 10.0 109.917 179.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -64.06 -39.8 94.88 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.025 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -61.15 -43.57 98.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.174 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -61.32 -51.44 68.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.418 -0.81 . . . . 10.0 110.968 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -61.92 -42.89 99.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.797 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 656' ' ' ARG . . . . . 0.417 HH22 HD21 ' A' ' 383' ' ' LEU . 2.6 ttp-105 -62.5 -36.12 81.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.325 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -63.9 -48.3 77.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.632 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.53 -50.22 68.19 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.851 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 659' ' ' ILE . . . . . 0.418 HG23 ' HD1' ' A' ' 660' ' ' TYR . 9.1 tp -66.48 -35.99 76.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 111.901 0.334 . . . . 10.0 111.901 -178.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 660' ' ' TYR . . . . . 0.418 ' HD1' HG23 ' A' ' 659' ' ' ILE . 2.9 m-30 -70.6 -35.62 73.09 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 9.9 t -62.23 -50.66 70.87 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -57.3 -43.59 83.34 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.431 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 38.7 ttt-85 -63.05 -41.84 99.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.613 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -65.82 -43.11 89.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.606 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 665' ' ' GLU . . . . . 0.403 ' O ' HG22 ' A' ' 669' ' ' VAL . 28.1 mt-10 -58.45 -50.1 74.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.245 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 26.8 mt -70.02 -16.12 63.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.171 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.406 ' O ' ' HD3' ' A' ' 195' ' ' PRO . 12.1 tp -83.8 -46.04 12.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.662 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -68.73 -41.98 78.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.855 -0.611 . . . . 10.0 112.161 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 665' ' ' GLU . 27.0 m -74.86 150.93 6.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.038 0.447 . . . . 10.0 111.191 -179.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 1.5 m -94.29 -42.21 9.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.451 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -84.32 126.26 33.03 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.564 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 672' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 676' ' ' ILE . 5.6 p -127.49 -0.68 3.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.004 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 673' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 677' ' ' ASN . 0.8 OUTLIER -52.65 -45.51 66.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.348 -0.842 . . . . 10.0 112.364 -178.66 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -62.34 -46.25 89.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.591 0.234 . . . . 10.0 111.586 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 675' ' ' THR . . . . . 0.466 ' O ' HG12 ' A' ' 679' ' ' ILE . 3.9 m -63.57 -46.84 84.05 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.767 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 676' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 672' ' ' VAL . 36.4 mm -65.27 -37.96 81.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.99 0.424 . . . . 10.0 110.856 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 673' ' ' SER . 5.5 t30 -68.53 -40.23 80.83 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.58 -0.282 . . . . 10.0 111.316 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 29.0 m -62.77 -42.27 99.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.748 0.308 . . . . 10.0 111.142 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 679' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 675' ' ' THR . 27.1 pt -77.44 -21.04 14.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.677 -0.409 . . . . 10.0 110.844 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 680' ' ' ARG . . . . . 0.562 ' HG3' HD12 ' A' ' 823' ' ' ILE . 10.7 mtm-85 -59.53 -46.37 89.05 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.04 0.448 . . . . 10.0 110.144 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -65.81 -44.59 85.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.565 -0.743 . . . . 10.0 110.931 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -62.62 -47.4 83.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.245 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 41.2 t -61.18 -44.95 99.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.767 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -62.74 -42.36 99.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.655 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 54.8 tttm -63.25 -48.32 78.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.559 -0.292 . . . . 10.0 110.325 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.85 -40.6 84.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.209 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 30.0 m -64.72 -43.33 93.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.195 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.68 -39.92 84.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.353 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -61.85 -18.17 59.1 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.254 -0.43 . . . . 10.0 112.143 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -79.26 -14.2 59.18 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.852 0.358 . . . . 10.0 111.495 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -127.14 -24.54 3.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.958 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 692' ' ' ILE . . . . . 0.549 HG23 ' CD1' ' A' ' 701' ' ' TRP . 69.4 mt -129.72 101.03 18.81 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.579 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 693' ' ' PRO . . . . . 0.409 ' HA ' ' HD3' ' A' ' 694' ' ' PRO . 23.4 Cg_exo -64.12 140.39 71.45 Favored 'Trans proline' 0 N--CA 1.464 -0.233 0 C-N-CA 122.518 2.145 . . . . 10.0 111.494 179.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 694' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 693' ' ' PRO . 59.3 Cg_exo -52.28 113.8 1.37 Allowed 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.897 2.398 . . . . 10.0 112.823 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 56.71 67.77 0.95 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.391 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 6.0 p -118.9 -172.32 2.27 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.914 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 35.9 mt -83.5 154.89 23.64 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.769 -0.456 . . . . 10.0 109.769 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -57.71 -34.32 69.34 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 120.937 0.399 . . . . 10.0 111.69 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -74.34 -6.3 47.29 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.288 -0.414 . . . . 10.0 111.882 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.22 8.75 40.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.839 0.352 . . . . 10.0 110.234 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 701' ' ' TRP . . . . . 0.549 ' CD1' HG23 ' A' ' 692' ' ' ILE . 48.4 m0 -101.43 108.13 19.64 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.966 -179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -83.72 82.78 8.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.364 0.602 . . . . 10.0 109.414 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 703' ' ' ILE . . . . . 0.511 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 43.0 mm -60.86 -50.22 85.95 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.201 -0.909 . . . . 10.0 111.956 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 704' ' ' PRO . . . . . 0.511 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 47.7 Cg_exo -56.27 -47.45 24.28 Favored 'Trans proline' 0 C--N 1.36 1.138 0 C-N-CA 122.052 1.834 . . . . 10.0 112.561 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -60.67 -40.67 98.3 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.448 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 61.1 tp -70.47 -45.89 64.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.389 0.138 . . . . 10.0 111.006 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -59.19 -51.23 70.87 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.357 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -59.71 -35.72 75.08 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.826 0.346 . . . . 10.0 110.771 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 709' ' ' ARG . 2.3 tpt180 -65.5 -45.92 81.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.277 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 79.5 mt -64.87 -38.19 90.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.135 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.88 -36.22 72.69 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.695 0.628 . . . . 10.0 112.695 -179.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -92.68 -44.48 8.54 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -177.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 713' ' ' ASP . . . . . 0.675 ' O ' ' HE3' ' A' ' 828' ' ' LYS . 0.8 OUTLIER -89.27 -31.51 17.83 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 -177.547 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -106.15 -4.22 20.55 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.057 -0.657 . . . . 10.0 112.079 -178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 25.6 t70 57.67 28.72 16.19 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.326 0.584 . . . . 10.0 110.526 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 43.8 tp -118.96 129.79 55.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.09 -0.505 . . . . 10.0 111.662 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -97.68 128.13 44.14 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.492 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.435 HD21 ' HG2' ' A' ' 742' ' ' GLN . 11.8 mt -140.0 122.11 9.87 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 120.782 0.325 . . . . 10.0 111.695 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -81.81 60.86 7.72 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.859 2.373 . . . . 10.0 111.675 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 52.8 mt -63.48 -42.63 96.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.383 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -67.04 -31.67 72.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.207 0.527 . . . . 10.0 110.474 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -88.7 6.86 36.55 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.905 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -106.11 -54.1 2.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.857 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 77.8 mt -63.68 -23.45 67.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.756 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 725' ' ' ASP . . . . . 0.477 ' OD1' ' HG3' ' A' ' 726' ' ' LYS . 0.0 OUTLIER -78.59 -11.79 59.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.942 -179.76 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 726' ' ' LYS . . . . . 0.477 ' HG3' ' OD1' ' A' ' 725' ' ' ASP . 50.6 mttp -111.71 -48.63 3.05 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.01 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -120.64 94.71 48.93 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.26 0.553 . . . . 10.0 110.817 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.27 -3.62 14.11 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.456 2.104 . . . . 10.0 111.851 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.44 -12.31 61.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.012 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 730' ' ' LEU . . . . . 0.508 HD21 ' NH1' ' A' ' 738' ' ' ARG . 32.2 mt -66.48 -34.69 78.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.154 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 53.42 -104.09 0.19 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.142 -0.936 . . . . 10.0 111.318 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.16 -56.34 0.86 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.05 -179.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -58.0 -54.41 47.25 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.513 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.28 -31.27 71.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.114 0.483 . . . . 10.0 110.539 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 39.9 tp -65.69 -46.76 77.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.802 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 22.8 mtt180 -63.49 -36.33 83.4 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.966 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -60.37 -45.2 94.34 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.404 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 738' ' ' ARG . . . . . 0.508 ' NH1' HD21 ' A' ' 730' ' ' LEU . 16.7 mmm-85 -63.35 -41.71 98.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.513 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 90.7 mt -62.53 -51.84 67.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.694 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 740' ' ' LEU . . . . . 0.42 ' O ' HG13 ' A' ' 744' ' ' ILE . 36.4 tp -62.08 -44.37 96.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.418 -179.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -61.01 -41.23 96.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.745 0.307 . . . . 10.0 111.407 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 742' ' ' GLN . . . . . 0.435 ' HG2' HD21 ' A' ' 718' ' ' LEU . 23.8 tp60 -60.59 -42.98 97.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.187 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -39.82 95.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.965 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 744' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 740' ' ' LEU . 75.3 mt -62.45 -44.01 98.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.765 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -46.5 87.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.24 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 88.3 t -65.53 -40.2 87.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.126 0.488 . . . . 10.0 110.155 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -59.69 -43.39 94.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.78 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 748' ' ' GLN . . . . . 0.494 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 24.5 mt-30 -59.1 -44.2 91.94 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.02 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.45 -39.94 89.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.475 -0.329 . . . . 10.0 110.77 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -68.36 -34.92 76.93 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.975 0.417 . . . . 10.0 109.879 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -72.42 -39.38 67.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.07 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 752' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 45.9 mt-10 -53.39 -39.83 64.56 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 13.3 t -75.17 -30.93 23.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.315 -0.402 . . . . 10.0 112.003 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 50.5 t -85.42 -46.52 17.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.245 0.545 . . . . 10.0 111.098 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.03 132.11 3.94 Favored Glycine 0 N--CA 1.441 -0.995 0 N-CA-C 110.404 -1.078 . . . . 10.0 110.404 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 756' ' ' ALA . . . . . 0.617 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -56.84 -51.81 67.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 117.001 0.4 . . . . 10.0 111.646 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 757' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' A' ' 757' ' ' GLU . 11.2 mp0 -59.15 -39.27 81.89 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.076 -0.511 . . . . 10.0 111.132 -179.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 16.1 tpt -73.56 -38.68 65.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.725 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 7.8 tpt -60.59 -36.49 78.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.794 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.617 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -61.81 -37.54 84.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.33 0.586 . . . . 10.0 109.491 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -71.07 -34.48 71.22 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.527 -0.761 . . . . 10.0 109.414 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -68.1 -51.61 44.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.272 -0.876 . . . . 10.0 110.304 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -56.84 -44.48 82.14 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.933 0.397 . . . . 10.0 110.145 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 43.6 tttp -60.44 -50.41 73.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.343 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.27 -42.23 99.72 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.494 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 766' ' ' VAL . . . . . 0.405 ' HA ' ' HG2' ' A' ' 769' ' ' GLN . 44.7 t -62.49 -49.19 84.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.424 0.154 . . . . 10.0 110.588 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 18.7 ttt -59.56 -43.3 93.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.657 0.265 . . . . 10.0 110.877 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 84.4 mt -64.28 -51.78 61.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.604 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 769' ' ' GLN . . . . . 0.418 ' HG3' ' N ' ' A' ' 770' ' ' THR . 13.9 pt20 -63.43 -37.29 86.71 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.796 0.295 . . . . 10.0 111.796 -178.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 770' ' ' THR . . . . . 0.418 ' N ' ' HG3' ' A' ' 769' ' ' GLN . 12.6 m -68.39 -34.84 76.76 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.665 -0.495 . . . . 10.0 109.665 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.8 tt -62.14 -50.05 73.4 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.84 -34.05 75.27 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.034 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 773' ' ' SER . . . . . 0.417 ' HA ' ' NZ ' ' A' ' 776' ' ' LYS . 72.7 m -61.63 -52.87 62.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.467 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 16.9 mt -78.02 -22.74 48.8 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.887 -0.325 . . . . 10.0 111.675 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 31.1 t-105 -63.94 -50.37 68.9 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.952 -0.299 . . . . 10.0 110.821 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.417 ' NZ ' ' HA ' ' A' ' 773' ' ' SER . 10.9 ptpp? -62.25 -35.25 78.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.919 0.39 . . . . 10.0 110.434 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -67.28 -41.66 85.11 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 73.5 t60 -61.74 -38.16 86.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.002 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 63.6 mt -66.0 -49.02 69.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.117 179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -61.52 -45.25 95.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.543 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.32 94.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.997 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 37.9 ttm -64.39 -42.86 95.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.766 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 783' ' ' ASP . . . . . 0.466 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 38.5 t70 -64.88 -41.13 95.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.209 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -62.97 -35.35 79.86 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.681 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 13.7 tp -78.37 -35.45 47.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.809 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -59.07 -38.04 78.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.597 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 787' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 C-N-CA 120.998 -0.281 . . . . 10.0 111.157 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo . . . . . 0 CA--C 1.529 0.231 0 N-CA-C 113.535 0.552 . . . . 10.0 113.535 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 800' ' ' LYS . . . . . 0.45 ' HB2' ' NZ ' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -91.0 -48.42 6.99 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.89 -0.324 . . . . 10.0 110.65 -179.674 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 -63.55 -38.88 92.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.219 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -65.11 -40.23 94.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.065 0.46 . . . . 10.0 109.922 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -60.56 -42.52 96.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.06 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 804' ' ' LYS . . . . . 0.402 ' HG2' HG21 ' A' ' 651' ' ' VAL . 88.0 mttt -65.98 -39.72 90.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.571 -0.74 . . . . 10.0 110.601 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 805' ' ' ARG . . . . . 0.42 HH11 ' HG2' ' A' ' 805' ' ' ARG . 41.3 ttp85 -61.34 -45.31 94.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.015 0.436 . . . . 10.0 110.431 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -65.66 -46.97 77.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.279 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 3.5 p -64.59 -37.54 87.92 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.608 -0.269 . . . . 10.0 111.652 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -64.74 -45.79 84.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.757 0.313 . . . . 10.0 110.2 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 13.2 m -64.82 -42.29 95.09 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.01 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 38.5 ttm -60.84 -37.29 81.56 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.866 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -70.23 -41.45 73.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.442 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.21 -50.05 74.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.669 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.41 -33.83 75.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.387 179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 11.6 ttt -63.82 -47.83 79.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.515 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 91.2 mt -62.46 -41.45 98.76 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.929 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -63.09 -44.25 96.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.848 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 12.1 m -73.46 -29.82 62.78 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.896 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 55.0 tp -62.56 -56.79 14.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.976 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 819' ' ' LYS . . . . . 0.406 ' O ' HG12 ' A' ' 823' ' ' ILE . 43.5 pttt -62.24 -28.87 70.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.674 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -62.35 -67.05 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.32 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . 0.528 ' HA ' ' OG ' ' A' ' 824' ' ' SER . 1.3 mm-40 -61.43 -28.61 69.39 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 -178.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 5.6 t -60.23 -41.05 85.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 178.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 823' ' ' ILE . . . . . 0.562 HD12 ' HG3' ' A' ' 680' ' ' ARG . 22.4 mm -76.56 -46.49 31.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.251 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 824' ' ' SER . . . . . 0.528 ' OG ' ' HA ' ' A' ' 821' ' ' GLU . 0.1 OUTLIER -63.47 -42.25 98.59 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 121.029 -0.268 . . . . 10.0 111.372 -179.42 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 97.5 m -59.42 -39.56 83.9 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.7 0.286 . . . . 10.0 111.194 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 76.3 mt -67.73 -17.97 64.74 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.099 0.476 . . . . 10.0 110.612 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 3.9 m -100.77 -29.52 12.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.157 179.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 828' ' ' LYS . . . . . 0.675 ' HE3' ' O ' ' A' ' 713' ' ' ASP . 77.7 mttt -70.1 -16.22 63.09 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.276 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.2 p -59.75 131.45 24.35 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.334 0.587 . . . . 10.0 111.055 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -97.88 96.9 8.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.823 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.636 179.68 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 86.9 t80 . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 121.003 0.43 . . . . 10.0 111.173 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.99 173.33 12.95 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.886 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.31 129.28 40.47 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.138 -0.319 . . . . 10.0 110.138 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.3 mmt180 -61.85 139.52 58.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.897 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.8 m120 72.35 -19.16 0.3 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.057 0.943 . . . . 10.0 112.046 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -102.9 -64.85 1.04 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.825 0.345 . . . . 10.0 111.586 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -70.07 -27.73 64.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.441 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.7 p -55.67 -62.44 1.69 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.765 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.8 mt -62.69 -36.59 83.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.523 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.0 ttp-105 -63.87 -48.84 75.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.576 -0.283 . . . . 10.0 110.914 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.416 ' O ' HG23 ' A' ' 24' ' ' VAL . 26.2 mtp180 -65.85 -38.12 88.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.922 0.391 . . . . 10.0 110.042 179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.406 ' O ' HG23 ' A' ' 25' ' ' VAL . 41.8 mtt -62.29 -41.64 98.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.431 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HD3' ' O ' ' A' ' 22' ' ' ARG . 15.5 tpp180 -61.75 -36.52 81.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.308 -0.406 . . . . 10.0 109.91 179.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -63.76 -37.64 88.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.205 -0.452 . . . . 10.0 109.899 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 20' ' ' ARG . 44.5 t -72.79 -37.35 54.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.849 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.507 HG13 HD12 ' A' ' 88' ' ' LEU . 36.3 t -57.84 -36.13 54.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.663 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -59.9 -40.27 88.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.182 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.1 mt -66.04 -41.88 90.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.912 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.97 -37.61 78.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.414 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -66.56 -25.21 66.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.018 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -93.17 -17.58 23.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.983 0.421 . . . . 10.0 111.073 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 18.3 mtt -88.02 -25.51 23.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.022 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.491 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 20.2 tt0 -56.78 -49.7 92.27 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 116.166 -0.47 . . . . 10.0 112.01 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 51.2 Cg_exo -55.53 -28.96 67.28 Favored 'Trans proline' 0 C--N 1.363 1.323 0 C-N-CA 122.138 1.892 . . . . 10.0 112.474 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.66 -40.78 66.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.995 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 23.6 mmt -67.59 -29.86 69.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.483 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 23.0 mt-10 -62.89 -32.15 73.35 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.224 0.535 . . . . 10.0 110.251 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -78.13 -24.8 47.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.112 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.9 mp -72.86 142.28 47.95 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.251 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 p -75.56 172.02 13.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.712 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -58.35 -43.71 88.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.101 0.477 . . . . 10.0 110.689 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -67.93 -34.54 76.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.245 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.94 -36.05 82.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.547 -0.297 . . . . 10.0 110.822 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.4 mt -61.55 -46.62 89.15 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.04 -0.726 . . . . 10.0 109.04 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -65.69 -35.7 81.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.289 -0.869 . . . . 10.0 109.643 178.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.76 -36.7 92.32 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.622 -0.717 . . . . 10.0 111.311 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -67.18 -39.29 86.39 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.491 -0.559 . . . . 10.0 109.491 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.7 m -60.73 -45.97 92.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.738 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.48 -35.16 79.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.803 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -62.22 -42.43 99.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.311 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -59.64 -40.21 86.89 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.3 -0.409 . . . . 10.0 109.982 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.7 tpp180 -62.68 -43.31 99.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.767 -0.652 . . . . 10.0 109.955 179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.536 ' O ' ' HG2' ' A' ' 56' ' ' LYS . . . -67.84 -42.09 81.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.633 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 55.8 mtp180 -61.57 -40.0 93.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.74 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 33.2 mt -62.92 -34.17 76.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.168 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.59 -34.87 76.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.158 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 56.0 mmtt -76.9 -43.88 33.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.077 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 145.77 78.3 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.725 -0.75 . . . . 10.0 112.335 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -130.62 144.94 51.77 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.647 -0.501 . . . . 10.0 109.647 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.5 t -85.75 131.52 34.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.441 HD11 ' O ' ' A' ' 118' ' ' LEU . 15.5 tp -56.17 -42.38 76.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.036 0.446 . . . . 10.0 111.038 -179.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -66.75 -16.22 64.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.537 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -88.4 -14.88 36.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.042 0.448 . . . . 10.0 110.536 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.4 mt -87.49 -9.93 53.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.4 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.522 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 76.4 mt -47.3 -53.29 29.75 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 113.399 0.888 . . . . 10.0 113.399 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.522 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 52.1 Cg_exo -54.37 -56.82 2.18 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.905 1.737 . . . . 10.0 113.199 -179.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -65.06 -43.41 92.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.89 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.72 80.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.569 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -65.25 -34.0 77.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.851 -179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.04 -44.66 83.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.451 -0.341 . . . . 10.0 110.562 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.7 t -62.54 -48.6 87.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.436 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 71.4 t -61.9 -39.74 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.502 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.477 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 5.4 ttt180 -58.46 -46.13 87.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.454 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -68.9 -42.77 76.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.628 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.34 -36.79 76.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.489 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.9 m -63.19 -34.06 76.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.708 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.405 ' O ' ' HA2' ' A' ' 80' ' ' GLY . 11.2 mtmm -70.47 -30.5 67.33 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.732 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -89.47 -38.8 13.79 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 48.9 t -81.47 -64.54 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.793 0.33 . . . . 10.0 111.632 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -82.07 -33.28 29.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.739 0.304 . . . . 10.0 111.816 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . 0.405 ' HA2' ' O ' ' A' ' 76' ' ' LYS . . . 91.89 13.73 57.45 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.582 -0.818 . . . . 10.0 111.392 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 59.0 ttm -125.02 127.5 47.08 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.697 0.284 . . . . 10.0 110.267 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -78.63 131.73 36.8 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.241 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.91 117.38 4.97 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 179.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -58.82 154.89 14.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.194 0.521 . . . . 10.0 112.005 -178.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -43.05 94.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.285 -0.87 . . . . 10.0 111.275 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 m -65.77 -29.02 45.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.143 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -67.22 -34.16 76.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.076 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.507 HD12 HG13 ' A' ' 25' ' ' VAL . 68.2 mt -64.15 -37.13 86.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.705 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 53.2 mt -65.31 -49.99 67.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.732 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.94 -36.71 93.24 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.49 -0.777 . . . . 10.0 112.325 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.64 -33.46 86.72 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.134 -0.555 . . . . 10.0 112.308 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.485 ' HG3' ' O ' ' A' ' 88' ' ' LEU . 56.1 mtt -74.07 -36.72 64.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.967 0.413 . . . . 10.0 110.146 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 95.9 t -64.35 -35.57 74.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.34 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 94.2 mt -77.39 -0.8 27.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.643 -0.708 . . . . 10.0 112.195 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -83.84 -32.27 25.35 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.267 0.556 . . . . 10.0 109.924 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -98.22 -178.93 4.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.274 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.46 ' HG2' HD23 ' A' ' 407' ' ' LEU . 21.9 ttt85 -80.5 71.73 7.36 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.469 ' SG ' ' HB3' ' A' ' 408' ' ' ASP . 14.6 m -141.32 162.93 34.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.432 -178.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.685 HD12 HG11 ' A' ' 211' ' ' VAL . 36.3 mm -110.36 127.27 67.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.468 -0.787 . . . . 10.0 108.988 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -101.25 105.66 16.78 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.886 0.374 . . . . 10.0 111.5 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.418 ' HB3' HG23 ' A' ' 393' ' ' THR . 11.1 mt-10 -76.99 107.03 9.04 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.413 -0.588 . . . . 10.0 109.413 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 55.6 mtt -104.11 -177.44 3.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.059 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -116.55 141.37 48.28 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.847 0.356 . . . . 10.0 111.088 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.21 106.74 2.11 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.204 179.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 138.93 -41.82 1.31 Allowed Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.803 -0.713 . . . . 10.0 111.963 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.04 -73.04 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.845 0.355 . . . . 10.0 110.554 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 159.52 126.77 0.87 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.593 -0.813 . . . . 10.0 112.445 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -109.04 -60.68 1.72 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.906 0.384 . . . . 10.0 110.177 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -31.85 72.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.847 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.1 mp -72.75 -14.77 61.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.58 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 20.4 m -100.32 -30.59 11.78 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.266 0.555 . . . . 10.0 110.618 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.439 ' HB1' HD21 ' A' ' 207' ' ' LEU . . . -66.03 -9.81 34.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.415 -0.812 . . . . 10.0 112.504 -179.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.412 HG22 ' CZ ' ' A' ' 147' ' ' PHE . 0.6 OUTLIER -71.92 -22.91 61.41 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.722 0.267 . . . . 10.0 111.722 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.414 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 54.9 mt -72.58 -56.79 3.68 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.214 0.45 . . . . 10.0 112.214 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 35.5 Cg_endo -63.12 -31.13 75.64 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 122.15 1.9 . . . . 10.0 112.327 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.72 -45.92 77.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.51 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.427 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 62.9 t80 -63.06 -45.74 90.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.598 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.441 ' O ' HD11 ' A' ' 60' ' ' LEU . 44.7 tp -60.39 -51.79 67.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.944 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -71.38 -14.94 62.33 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.862 0.319 . . . . 10.0 111.862 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -81.77 -22.85 36.97 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.685 0.279 . . . . 10.0 110.411 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.6 mt -61.9 -31.17 71.45 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.866 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.38 -19.36 61.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.239 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 73.33 9.19 76.95 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.193 -0.527 . . . . 10.0 113.117 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -76.33 -18.33 58.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.733 0.301 . . . . 10.0 110.867 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 103.16 127.97 6.24 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.637 -0.792 . . . . 10.0 113.243 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.1 t -105.84 118.74 53.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 178.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 39.5 m170 -101.09 101.74 12.55 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.853 0.359 . . . . 10.0 111.043 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 38.3 t -92.19 116.53 33.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.767 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.507 ' HB ' HG12 ' A' ' 208' ' ' VAL . 84.0 t -105.27 114.78 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.917 -178.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -101.71 164.12 11.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.634 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.7 m -69.52 -26.95 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -148.32 175.18 11.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.718 0.294 . . . . 10.0 110.705 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -78.35 -25.44 46.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.68 -179.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.21 -56.13 26.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.724 0.297 . . . . 10.0 110.717 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.8 mt -65.78 -38.22 88.44 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.917 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.64 -51.62 69.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.798 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -70.47 -31.48 68.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.039 0.447 . . . . 10.0 110.693 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 138' ' ' ARG . 1.7 ttp180 -63.08 -57.51 10.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.806 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.23 -32.65 73.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.888 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.502 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -59.38 -39.4 83.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.903 0.382 . . . . 10.0 111.042 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -90.4 -28.5 18.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.209 -0.45 . . . . 10.0 111.391 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -73.17 -43.95 60.71 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.537 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -89.2 -1.36 58.05 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.865 0.364 . . . . 10.0 111.15 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 58.4 ttm-85 -61.62 -49.23 87.63 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' PRO . . . . . 0.465 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 18.3 Cg_exo -66.93 -1.26 5.77 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 122.163 1.909 . . . . 10.0 112.621 -179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.8 tp -101.93 -52.33 3.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.202 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' PHE . . . . . 0.412 ' CZ ' HG22 ' A' ' 113' ' ' THR . 24.3 m-85 -69.47 -45.49 68.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.165 -0.471 . . . . 10.0 111.586 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -70.1 -15.35 62.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.111 0.481 . . . . 10.0 110.941 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -73.78 -27.39 61.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.344 178.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 66.8 mt -98.93 -11.03 22.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.384 -0.825 . . . . 10.0 110.823 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 115.19 -5.64 21.71 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.293 -0.956 . . . . 10.0 114.149 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 82.7 mt -82.29 131.19 35.23 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.339 0.57 . . . . 10.0 110.639 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 11.0 p -86.3 134.42 33.75 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.217 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . 0.404 HG21 ' HA ' ' A' ' 144' ' ' ARG . 40.4 t -106.83 127.34 62.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.409 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -123.22 134.89 9.67 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.764 -0.731 . . . . 10.0 111.969 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 5.4 tp -108.91 130.57 61.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.898 0.38 . . . . 10.0 110.305 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -111.89 102.3 10.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.111 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' A' ' 161' ' ' MET . 97.0 mt -90.9 141.99 27.16 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.451 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' PRO . . . . . 0.423 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 32.2 Cg_exo -59.12 112.0 1.08 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.85 2.366 . . . . 10.0 112.41 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 100.12 18.68 21.32 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.995 -0.621 . . . . 10.0 112.447 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . 0.52 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 8.2 ttp -82.07 140.13 46.14 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 109.881 -0.415 . . . . 10.0 109.881 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.88 153.17 32.4 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.509 2.139 . . . . 10.0 112.832 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . 0.472 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -54.2 -49.0 92.67 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.939 0.718 . . . . 10.0 112.939 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.472 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 50.5 Cg_exo -55.67 -36.35 94.68 Favored 'Trans proline' 0 C--N 1.36 1.158 0 C-N-CA 121.824 1.683 . . . . 10.0 112.155 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -70.63 -43.1 69.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.41 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.52 ' HE2' ' O ' ' A' ' 161' ' ' MET . 62.5 mttm -61.34 -46.26 90.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.568 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -57.87 -39.34 77.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.059 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -68.91 -37.31 78.87 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.839 0.352 . . . . 10.0 111.204 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -74.09 -39.19 63.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.454 -179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -75.8 -25.06 56.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.442 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.84 -5.97 54.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.872 0.368 . . . . 10.0 110.591 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -78.78 175.7 10.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.127 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -74.12 -44.42 53.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.821 0.344 . . . . 10.0 110.537 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 70.4 mt -126.69 123.87 63.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.931 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.2 m -112.92 128.12 56.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.998 0.428 . . . . 10.0 111.448 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -104.24 135.24 46.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.752 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.19 173.34 44.19 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.304 -0.951 . . . . 10.0 112.826 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.1 m -92.35 151.81 20.08 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.151 0.18 . . . . 10.0 110.538 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -56.85 -43.44 81.17 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -59.08 -51.94 67.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.687 0.28 . . . . 10.0 111.532 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.423 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 4.0 tp10 -66.14 -37.4 85.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.986 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -59.67 -39.78 85.61 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.88 0.372 . . . . 10.0 110.913 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -74.97 -41.8 31.7 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.738 -0.744 . . . . 10.0 111.548 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -62.95 -36.76 84.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.033 0.445 . . . . 10.0 110.389 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 185' ' ' ASP . . . . . 0.41 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 11.3 m-20 -60.35 -44.57 95.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.012 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -62.83 -38.14 89.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.339 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 187' ' ' LEU . . . . . 0.403 HD11 HG22 ' A' ' 375' ' ' ILE . 74.8 mt -63.03 -48.16 79.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.776 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 40.9 mtm-85 -67.55 -37.76 83.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.799 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -61.62 -50.36 72.87 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.514 -0.766 . . . . 10.0 111.498 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.01 1.18 28.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.754 -0.657 . . . . 10.0 112.463 -178.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 22.5 ttp -108.47 11.01 27.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.113 0.482 . . . . 10.0 110.566 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -79.31 170.67 16.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.869 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -106.34 -30.32 9.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.952 0.406 . . . . 10.0 110.451 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.32 139.65 24.11 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.87 -24.31 78.9 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.831 2.354 . . . . 10.0 113.202 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -76.96 -16.02 59.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.68 0.276 . . . . 10.0 111.125 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -76.88 -9.95 59.04 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.345 -0.389 . . . . 10.0 110.646 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -54.87 155.54 4.31 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.787 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 11.4 m -133.26 -15.4 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.784 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -87.32 -175.2 5.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.305 0.574 . . . . 10.0 111.691 -179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -145.12 -171.23 3.61 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.36 -0.837 . . . . 10.0 108.861 179.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 24.5 tttm -65.44 131.54 46.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.008 0.432 . . . . 10.0 110.637 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 19.9 mt -83.85 60.7 5.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.337 0.589 . . . . 10.0 109.629 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -76.59 -60.22 2.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.512 -0.767 . . . . 10.0 112.868 -178.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -127.83 135.0 49.46 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 111.988 0.366 . . . . 10.0 111.988 -178.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.538 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -133.14 126.21 31.21 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.751 178.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 207' ' ' LEU . . . . . 0.439 HD21 ' HB1' ' A' ' 112' ' ' ALA . 59.1 tp -123.07 116.06 22.86 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.117 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 208' ' ' VAL . . . . . 0.507 HG12 ' HB ' ' A' ' 129' ' ' VAL . 15.5 m -99.19 141.54 16.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.204 0.526 . . . . 10.0 111.21 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -64.67 -72.6 0.14 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.127 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 210' ' ' GLU . . . . . 0.47 ' OE1' ' HA ' ' A' ' 391' ' ' THR . 31.1 mm-40 -109.02 109.51 20.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.768 0.318 . . . . 10.0 110.82 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.685 HG11 HD12 ' A' ' 99' ' ' ILE . 34.0 m -69.32 -20.96 24.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.944 0.402 . . . . 10.0 110.653 179.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.98 -46.05 82.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.58 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.33 -39.4 8.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.745 0.646 . . . . 10.0 112.745 -178.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 58.6 mt -74.34 -30.33 26.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 113.225 0.824 . . . . 10.0 113.225 -177.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 215' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 219' ' ' ALA . 42.5 mt -112.7 -45.58 3.21 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.925 0.713 . . . . 10.0 112.925 -178.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 37.8 mm -79.02 -65.92 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.736 0.643 . . . . 10.0 112.736 -178.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.72 -61.22 2.75 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.734 0.642 . . . . 10.0 112.734 -177.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -90.78 74.85 6.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.983 0.421 . . . . 10.0 110.724 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 215' ' ' LEU . . . -109.47 -51.38 2.88 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.251 -0.432 . . . . 10.0 111.575 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.31 3.14 36.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.036 -178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 1.5 m -67.85 112.72 11.35 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.54 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -91.91 126.77 0.93 Allowed 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 122.918 2.412 . . . . 10.0 113.15 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 223' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 374' ' ' SER . 58.1 mt -82.81 88.7 6.76 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.894 -0.593 . . . . 10.0 109.428 178.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 18.3 mt -94.6 113.28 28.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.88 -179.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 4.0 mt . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.426 -179.903 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.225 0 N-CA-C 107.868 -1.16 . . . . 10.0 107.868 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 374' ' ' SER . . . . . 0.45 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 20.1 m -151.23 148.69 28.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.214 0.53 . . . . 10.0 112.228 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.403 HG22 HD11 ' A' ' 187' ' ' LEU . 16.6 tt -162.03 141.12 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.135 -0.939 . . . . 10.0 109.274 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 5.7 p -96.7 148.39 22.93 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.845 -0.428 . . . . 10.0 109.845 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -58.06 -42.08 84.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 10.0 111.094 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 378' ' ' GLN . . . . . 0.538 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 0.0 OUTLIER -60.95 -29.72 69.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.263 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -95.78 -8.66 33.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.763 0.316 . . . . 10.0 111.011 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -83.52 -50.0 8.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.191 0.519 . . . . 10.0 109.719 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -73.91 -4.92 37.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.636 0.731 . . . . 10.0 110.007 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 15.9 ttt180 -82.96 -4.24 58.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.102 -0.953 . . . . 10.0 109.829 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.469 HD11 HH21 ' A' ' 656' ' ' ARG . 29.5 mt -106.87 4.3 27.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.597 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . 0.538 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 17.3 m-85 -97.58 143.46 28.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.053 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -70.74 -74.36 0.15 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.295 0.569 . . . . 10.0 110.721 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -95.0 102.89 14.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.734 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 46.5 tp -109.96 118.49 36.59 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.99 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -132.15 161.6 32.94 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.324 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -162.75 163.05 35.02 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.41 -0.9 . . . . 10.0 112.371 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 390' ' ' MET . . . . . 0.632 ' O ' ' HB ' ' A' ' 391' ' ' THR . 27.8 mtm -124.48 178.85 5.19 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 110.096 -0.335 . . . . 10.0 110.096 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 391' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' A' ' 390' ' ' MET . 1.4 t 167.52 -177.75 0.02 OUTLIER 'General case' 0 C--O 1.234 0.276 0 O-C-N 123.774 0.671 . . . . 10.0 109.914 178.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -92.04 143.5 16.58 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.389 -0.684 . . . . 10.0 111.389 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 393' ' ' THR . . . . . 0.418 HG23 ' HB3' ' A' ' 101' ' ' GLU . 0.2 OUTLIER -55.4 108.28 0.41 Allowed 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.562 0.345 . . . . 10.0 111.671 -179.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -145.86 -19.75 0.46 Allowed 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.062 0.393 . . . . 10.0 112.062 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 31.6 t70 59.41 -101.27 0.12 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 396' ' ' THR . . . . . 0.512 HG23 ' HB3' ' A' ' 565' ' ' ARG . 5.2 m 54.52 -104.28 0.21 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.946 0.498 . . . . 10.0 112.29 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -81.51 32.36 0.35 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.969 0.414 . . . . 10.0 111.518 -179.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 398' ' ' ALA . . . . . 0.563 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -67.1 -18.83 65.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.99 0.424 . . . . 10.0 110.781 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -74.11 -15.29 61.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.883 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -84.74 -24.6 28.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.979 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 401' ' ' PHE . . . . . 0.563 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 22.5 m-85 -56.57 -54.49 45.36 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.741 0.305 . . . . 10.0 111.629 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.7 m -76.47 -8.81 57.94 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 40.7 m -95.47 -47.46 6.26 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -178.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 20.0 mt -86.13 -74.13 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.264 0.468 . . . . 10.0 112.264 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 405' ' ' TYR . . . . . 0.538 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 68.7 m-85 -78.95 -8.04 58.55 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.482 0.549 . . . . 10.0 112.482 -177.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm 62.13 58.82 1.75 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.12 0.486 . . . . 10.0 110.763 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 407' ' ' LEU . . . . . 0.48 HD13 HD11 ' A' ' 99' ' ' ILE . 2.4 mt -114.29 156.56 24.15 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.429 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 408' ' ' ASP . . . . . 0.469 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . 20.3 t0 -95.46 147.06 23.94 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.61 -0.885 . . . . 10.0 108.61 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 1.8 m -109.13 104.5 13.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.888 0.375 . . . . 10.0 111.324 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 5.9 t -114.71 129.01 71.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.667 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 61.5 t -90.48 123.59 42.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 110.04 -0.355 . . . . 10.0 110.04 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 50.1 t -90.73 126.65 55.17 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.842 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.17 150.39 88.42 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.556 2.171 . . . . 10.0 111.966 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 16.4 p -77.23 164.24 25.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.015 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -68.63 -35.59 77.5 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.764 -0.828 . . . . 10.0 108.764 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 55.7 mmt-85 -134.69 143.21 45.51 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 114.944 -1.025 . . . . 10.0 108.829 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -60.64 136.63 68.17 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.662 2.241 . . . . 10.0 112.896 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 73.8 mtm -84.92 130.35 34.66 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.324 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.1 mt -111.51 36.13 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.364 0.602 . . . . 10.0 109.962 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 420' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 420' ' ' ARG . 35.4 ttp180 -71.38 123.39 22.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.031 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 14.4 mttm -83.11 99.6 10.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.29 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 422' ' ' ASP . . . . . 0.537 ' OD1' ' HD2' ' A' ' 572' ' ' ARG . 9.0 m-20 -86.46 110.57 19.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.496 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 43.9 mt -94.61 157.28 37.35 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.358 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -71.42 176.29 8.21 Favored 'Trans proline' 0 C--O 1.238 0.489 0 C-N-CA 122.739 2.293 . . . . 10.0 112.894 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -86.63 115.76 24.3 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.445 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . 0.502 ' HA ' HD23 ' A' ' 426' ' ' LEU . 9.9 mt -89.7 87.36 6.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.13 0.49 . . . . 10.0 109.792 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 427' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 588' ' ' LEU . 8.9 t -86.3 126.55 40.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.748 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 428' ' ' TYR . . . . . 0.417 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 5.3 m-85 -112.14 177.49 4.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.234 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 84.9 mmm -71.76 -77.04 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.633 0.254 . . . . 10.0 111.396 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 67.0 p -88.12 157.51 18.82 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.96 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -61.27 -30.45 70.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.468 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -60.13 -39.96 88.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.221 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -64.84 -41.2 95.92 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.034 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 434' ' ' LYS . . . . . 0.505 ' O ' HG13 ' A' ' 438' ' ' ILE . 38.8 ttpt -59.19 -51.47 69.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.061 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 435' ' ' ILE . . . . . 0.454 ' O ' HG12 ' A' ' 439' ' ' ILE . 46.5 mm -63.1 -44.25 99.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.593 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . 0.483 ' O ' ' HG2' ' A' ' 440' ' ' GLU . 24.7 tp60 -57.65 -45.17 85.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.866 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -63.11 -37.65 88.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.805 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 438' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 434' ' ' LYS . 88.8 mt -59.67 -44.25 93.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.097 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 439' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 435' ' ' ILE . 30.3 mm -62.09 -38.87 81.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.013 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 436' ' ' GLN . 5.9 mm-40 -65.05 -42.44 94.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.871 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . 0.6 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 15.2 t70 -67.71 -42.45 81.96 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 179.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.513 HG12 HG11 ' A' ' 452' ' ' VAL . 56.1 mt -58.07 -41.38 80.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.694 179.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -59.97 -40.9 90.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.15 0.5 . . . . 10.0 110.596 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.95 -28.12 69.3 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.564 -0.744 . . . . 10.0 111.074 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 14.3 mmt180 -86.11 -43.11 13.33 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.908 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.54 -42.49 98.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.619 -0.264 . . . . 10.0 111.362 -179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -71.83 -9.93 59.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.471 -0.332 . . . . 10.0 111.232 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 4.1 ttmm -104.69 -4.48 22.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.642 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 79.3 30.15 46.97 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.837 -0.697 . . . . 10.0 112.418 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 450' ' ' GLN . . . . . 0.457 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 63.8 tt0 -108.33 131.28 21.86 Favored Pre-proline 0 C--N 1.327 -0.391 0 O-C-N 122.796 -0.238 . . . . 10.0 111.027 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -69.63 143.71 52.36 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.684 2.256 . . . . 10.0 111.442 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 452' ' ' VAL . . . . . 0.513 HG11 HG12 ' A' ' 442' ' ' ILE . 49.0 t -120.42 125.46 74.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.874 0.369 . . . . 10.0 111.676 -178.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 32.5 tp -113.1 105.82 13.92 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 39.6 t -93.4 122.66 45.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.452 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -105.24 91.64 0.78 Allowed Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.14 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.32 140.08 29.9 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.363 -0.236 . . . . 10.0 110.363 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 20.9 pt -77.76 -35.94 21.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 112.506 0.558 . . . . 10.0 112.506 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 7.4 p -122.99 159.45 28.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.95 0.405 . . . . 10.0 112.023 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 74.5 mt -64.72 -36.98 78.96 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -56.52 -46.63 80.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.988 -1.005 . . . . 10.0 110.327 178.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.13 -32.89 72.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.439 179.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 17.2 m -64.39 -44.44 91.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.134 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -68.85 -40.44 79.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.322 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.9 -53.83 54.02 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.417 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.63 -31.59 54.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-O 120.92 0.39 . . . . 10.0 110.877 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 35.4 t -68.63 -41.05 80.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.119 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -59.86 -48.85 80.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.592 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -64.24 -39.51 94.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.866 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 19.8 mt -62.92 -34.43 77.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.986 0.422 . . . . 10.0 110.628 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 7.9 m -71.83 -42.73 66.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.734 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -61.75 -39.5 91.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.372 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -72.76 -18.27 61.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.855 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 79.72 47.93 6.95 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.062 -0.589 . . . . 10.0 112.706 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 65.9 mt -118.77 128.43 75.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 110.396 -0.224 . . . . 10.0 110.396 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 21.5 mmtm -62.24 129.75 42.22 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 54.9 p-80 -161.0 149.49 16.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.759 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -127.53 157.72 39.37 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.209 -0.451 . . . . 10.0 109.842 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.6 t -121.6 130.76 74.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.662 0.268 . . . . 10.0 111.027 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 90.3 mt -83.5 90.08 7.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.599 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -85.16 126.65 33.81 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.433 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -61.23 -22.83 65.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.692 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -85.93 -2.45 58.28 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.066 0.46 . . . . 10.0 110.57 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -130.49 59.41 1.65 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.312 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -61.68 -33.82 74.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.056 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.49 74.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.864 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' ASN . . . . . 0.424 ' O ' HG13 ' A' ' 490' ' ' ILE . 0.2 OUTLIER -88.54 -33.48 17.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.891 179.48 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.5 -57.38 9.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.6 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -54.2 -39.78 66.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.585 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -66.13 -35.75 81.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.246 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 486' ' ' ASN . 47.9 mt -74.66 -41.99 48.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.493 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 95.6 t -60.41 -34.83 59.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.746 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -59.6 -28.4 67.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.634 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -124.39 26.94 7.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.922 0.391 . . . . 10.0 110.57 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -74.55 -21.9 59.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.17 0.51 . . . . 10.0 110.655 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -94.82 16.23 61.7 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.98 -0.629 . . . . 10.0 111.737 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -74.28 138.01 75.16 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 110.115 -0.328 . . . . 10.0 110.115 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.05 125.84 19.6 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.661 2.24 . . . . 10.0 112.952 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.5 22.33 6.43 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.067 0.766 . . . . 10.0 113.067 178.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -100.95 122.73 44.0 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 121.122 -0.231 . . . . 10.0 110.491 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 35.3 t -97.95 115.64 38.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.912 0.387 . . . . 10.0 110.44 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.9 m -115.33 121.88 44.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.572 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 47.7 mt -101.19 124.36 54.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.271 -0.422 . . . . 10.0 109.94 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -114.44 116.54 29.03 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.817 0.342 . . . . 10.0 111.182 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 21.4 m -81.13 113.94 19.63 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.586 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 63.83 81.46 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.326 -0.852 . . . . 10.0 110.883 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 53.4 tpp -60.95 122.46 14.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.248 -0.887 . . . . 10.0 110.957 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -87.69 166.73 14.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.886 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -65.56 157.7 47.4 Favored Glycine 0 N--CA 1.453 -0.187 0 C-N-CA 121.219 -0.515 . . . . 10.0 112.471 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 68.98 -93.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.977 0.511 . . . . 10.0 110.861 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 88.8 132.78 4.42 Favored Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 121.1 -0.572 . . . . 10.0 111.843 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.62 143.28 25.24 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.499 0.32 . . . . 10.0 110.926 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -64.67 98.6 0.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.646 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 70.4 mt -73.6 101.94 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.129 0.49 . . . . 10.0 109.819 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 514' ' ' VAL . . . . . 0.425 ' HB ' ' O ' ' A' ' 517' ' ' GLY . 6.3 t -71.67 132.02 33.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.865 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.468 HD11 ' OD1' ' A' ' 580' ' ' ASP . 34.0 mt -66.37 125.83 26.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.591 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 93.36 -0.81 68.81 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.101 -0.571 . . . . 10.0 111.847 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' GLY . . . . . 0.425 ' O ' ' HB ' ' A' ' 514' ' ' VAL . . . 106.2 -167.91 14.58 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 110.986 -0.846 . . . . 10.0 110.986 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.9 p -127.06 98.18 5.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 117.278 0.539 . . . . 10.0 110.991 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 52.9 p-90 -58.51 -29.47 66.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.877 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -62.25 -30.01 70.81 Favored 'General case' 0 C--N 1.334 -0.077 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.783 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -86.25 -34.42 20.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.467 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -65.89 -43.95 86.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.612 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . 0.406 HG12 HD12 ' A' ' 537' ' ' ILE . 34.1 m -70.48 -20.07 22.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.94 0.4 . . . . 10.0 110.593 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -91.87 -0.1 57.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -90.29 -10.79 42.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.573 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 44.2 mt -96.04 154.0 17.47 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.834 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -72.62 -57.11 4.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.85 0.357 . . . . 10.0 110.152 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -119.2 88.6 37.76 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.975 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.05 103.3 1.16 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.996 2.464 . . . . 10.0 111.515 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 18.8 p -81.56 173.39 12.43 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.358 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.75 -43.23 80.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.484 0.183 . . . . 10.0 111.446 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 532' ' ' GLU . 1.6 mp0 -62.28 -41.02 98.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.887 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -68.24 -44.43 75.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.952 0.406 . . . . 10.0 110.408 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 90.3 mt -64.33 -42.48 95.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.254 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -64.89 -42.52 94.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.481 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -58.32 -51.6 69.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.344 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . 0.406 HD12 HG12 ' A' ' 523' ' ' VAL . 96.7 mt -64.83 -37.31 79.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.29 -0.413 . . . . 10.0 110.665 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -62.18 -47.68 83.41 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.977 0.418 . . . . 10.0 110.303 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -69.54 -37.82 77.24 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.504 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . 0.576 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 13.2 t70 -61.31 -49.13 78.28 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.238 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -60.43 -39.81 88.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.867 -1.061 . . . . 10.0 110.337 179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 -52.05 -48.61 64.52 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.308 0.38 . . . . 10.0 110.914 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 26.0 t -60.09 -47.44 91.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.91 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 544' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 6.2 mtm180 -67.99 -35.73 78.82 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.925 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -64.29 -48.55 75.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.474 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.37 -31.23 71.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.458 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.5 94.76 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.434 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 548' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 544' ' ' ARG . 99.4 t -65.43 -37.64 80.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.464 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.23 -45.82 89.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.048 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -70.18 -18.41 63.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.022 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 551' ' ' ALA . . . . . 0.457 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -82.92 -28.46 29.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.961 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 129.97 6.34 4.06 Favored Glycine 0 CA--C 1.519 0.324 0 C-N-CA 120.445 -0.883 . . . . 10.0 113.302 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 84.12 -167.6 43.78 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.67 -0.776 . . . . 10.0 112.43 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 36.6 tp -71.67 119.56 16.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.908 0.385 . . . . 10.0 110.879 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -91.45 118.94 30.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.748 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 25.3 mm -103.22 134.99 42.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.289 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 40.6 mt -126.48 121.59 59.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.018 0.437 . . . . 10.0 110.691 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.38 115.71 4.99 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.115 -0.794 . . . . 10.0 111.115 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 20.5 p -71.51 -40.3 70.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.021 0.439 . . . . 10.0 111.266 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -137.55 151.27 48.21 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.036 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 561' ' ' ARG . . . . . 0.588 ' HB2' HD22 ' A' ' 594' ' ' LEU . 3.5 mmt85 -90.88 150.7 21.42 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -94.94 146.24 24.37 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.806 -0.358 . . . . 10.0 110.588 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -59.46 -51.95 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . 0.408 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.1 OUTLIER -75.05 117.27 16.71 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.233 -0.894 . . . . 10.0 110.127 179.039 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 565' ' ' ARG . . . . . 0.532 ' HA ' ' HB3' ' A' ' 568' ' ' ASP . 17.1 tpt180 -66.33 -26.62 67.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.125 -0.488 . . . . 10.0 110.216 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -58.87 -36.84 75.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.526 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 59.9 mt -92.75 -34.78 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.646 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 568' ' ' ASP . . . . . 0.532 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 2.2 t70 -60.89 -44.81 96.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.101 0.477 . . . . 10.0 110.693 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -69.55 -24.82 63.77 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.933 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -66.52 -26.83 67.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.747 0.308 . . . . 10.0 110.49 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.405 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 57.2 tp -73.13 -33.94 65.82 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 572' ' ' ARG . . . . . 0.537 ' HD2' ' OD1' ' A' ' 422' ' ' ASP . 13.5 ttp180 -76.66 -30.68 56.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.078 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.82 27.77 3.34 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 121.011 -0.614 . . . . 10.0 113.525 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 574' ' ' ARG . . . . . 0.405 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 0.3 OUTLIER -77.46 -54.92 5.85 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 179.075 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.78 172.63 10.65 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.994 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 85.11 47.39 5.27 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.692 -0.766 . . . . 10.0 111.573 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 577' ' ' ARG . . . . . 0.584 ' H ' ' HB3' ' A' ' 580' ' ' ASP . 54.4 mtt180 -108.53 121.16 44.39 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.185 -0.302 . . . . 10.0 110.185 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 59.46 28.99 18.5 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.701 0.63 . . . . 10.0 112.701 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 104.75 4.47 42.54 Favored Glycine 0 N--CA 1.454 -0.111 0 C-N-CA 120.292 -0.956 . . . . 10.0 113.866 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 580' ' ' ASP . . . . . 0.584 ' HB3' ' H ' ' A' ' 577' ' ' ARG . 0.9 OUTLIER -67.79 157.8 33.93 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.942 0.371 . . . . 10.0 110.253 179.23 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -92.7 -103.99 0.12 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.572 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 97.75 175.61 33.78 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.696 -0.764 . . . . 10.0 112.3 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -153.8 120.63 5.63 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.328 -0.249 . . . . 10.0 110.328 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.97 119.64 34.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.818 0.342 . . . . 10.0 110.864 -179.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -117.51 113.54 22.15 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.136 -0.483 . . . . 10.0 109.959 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -102.87 147.0 27.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.897 0.379 . . . . 10.0 111.035 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 587' ' ' TYR . . . . . 0.489 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 31.4 m-85 -135.33 158.14 45.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.474 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 588' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 427' ' ' VAL . 10.1 tp -165.78 163.26 18.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.239 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 589' ' ' SER . . . . . 0.517 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.6 OUTLIER -124.1 159.48 29.88 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.558 -0.292 . . . . 10.0 110.33 179.275 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 590' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 77.9 mmm -74.7 -17.95 60.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.222 0.534 . . . . 10.0 110.282 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -111.03 24.17 13.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.275 -0.875 . . . . 10.0 109.088 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 592' ' ' ASP . . . . . 0.517 ' HB2' ' O ' ' A' ' 589' ' ' SER . 0.9 OUTLIER -76.32 176.82 7.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.127 -0.942 . . . . 10.0 111.954 -178.71 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -82.32 -28.65 31.54 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.661 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 594' ' ' LEU . . . . . 0.588 HD22 ' HB2' ' A' ' 561' ' ' ARG . 9.3 tp -70.62 -13.42 62.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.142 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 16.3 mmt -76.06 12.08 1.26 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.969 0.414 . . . . 10.0 111.559 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.516 ' NH1' ' HA ' ' A' ' 596' ' ' ARG . 10.9 mmm180 -110.87 -4.03 15.4 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.572 -0.286 . . . . 10.0 111.059 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 597' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 594' ' ' LEU . 28.0 pt -82.82 -10.16 11.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 121.22 0.533 . . . . 10.0 110.459 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -87.8 3.85 46.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.53 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.42 -83.2 0.03 OUTLIER 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.281 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 3.2 m -69.96 125.47 26.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.864 0.364 . . . . 10.0 110.825 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -69.36 -15.95 63.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.984 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 602' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 602' ' ' ARG . 4.5 mmt180 -64.94 -32.48 74.22 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.051 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.5 t -61.95 -55.35 24.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.21 0.528 . . . . 10.0 109.69 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 3.6 m -66.19 -35.52 80.65 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.675 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -65.57 -38.01 94.24 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.453 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 29.9 tpp -73.13 -26.07 61.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.098 0.475 . . . . 10.0 110.757 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 51.9 mtt -72.35 -12.6 61.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.73 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -76.13 -7.19 54.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.019 0.438 . . . . 10.0 110.725 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -83.25 9.37 10.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.085 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 6.3 mp -80.9 -16.01 54.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.014 0.435 . . . . 10.0 110.478 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 89.97 -48.61 3.25 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.0 -0.619 . . . . 10.0 112.562 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 69.3 -66.65 0.25 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.394 0.677 . . . . 10.0 111.387 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt 66.32 94.23 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.249 0 O-C-N 123.527 0.517 . . . . 10.0 110.686 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 614' ' ' PRO . . . . . 0.417 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 65.1 Cg_exo -50.29 107.85 0.19 Allowed 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 123.26 2.64 . . . . 10.0 112.994 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 118.82 -17.47 10.88 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.734 -0.746 . . . . 10.0 112.288 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -93.8 132.68 37.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.953 0.406 . . . . 10.0 110.788 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -102.9 91.6 4.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.475 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 6.4 tp -66.75 -35.69 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.548 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 47.45 66.7 0.95 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.576 -0.738 . . . . 10.0 112.193 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 3.3 m170 -109.04 114.73 57.88 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.606 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.86 -15.88 40.85 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.158 2.572 . . . . 10.0 114.207 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -63.58 -29.02 70.33 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.75 -0.38 . . . . 10.0 110.494 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 23.4 t -69.44 -46.16 76.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 87.9 m -59.21 -44.08 92.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.015 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.47 -31.7 72.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.97 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -70.9 -40.84 71.94 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.944 -0.391 . . . . 10.0 109.944 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 97.2 mt -66.53 -49.11 77.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.434 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -58.66 -35.88 73.27 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.968 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -64.92 -41.05 95.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.935 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -69.53 -40.63 76.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.894 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -60.17 -44.17 95.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.314 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 52.9 ttt85 -65.67 -32.6 74.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.35 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 55.4 mttt -65.27 -35.95 82.6 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.649 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.47 -44.17 98.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 109.253 -0.647 . . . . 10.0 109.253 178.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.408 ' OE2' ' HA ' ' A' ' 564' ' ' SER . 6.8 mm-40 -66.0 -39.12 90.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.383 -0.826 . . . . 10.0 110.096 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 19.7 m -64.62 -33.52 76.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.048 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -66.94 -36.5 82.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.28 0.562 . . . . 10.0 109.532 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -64.7 -36.83 85.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.309 -0.86 . . . . 10.0 110.007 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -59.04 -40.29 84.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.467 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -61.28 -41.35 96.81 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.077 0.465 . . . . 10.0 110.185 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 43.2 mt -66.35 -42.46 90.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.986 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 642' ' ' ARG . . . . . 0.606 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 2.1 mmm180 -62.68 -42.06 99.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.98 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -59.64 -40.7 88.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.336 -0.847 . . . . 10.0 110.687 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -63.17 -39.31 94.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.281 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 78.6 mt -69.5 -38.62 77.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.38 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 646' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 89.9 mt -60.1 -36.33 77.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.881 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -68.13 -20.65 64.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.494 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -96.02 -44.15 7.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.19 0.519 . . . . 10.0 110.361 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -69.18 -27.86 65.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.839 -0.619 . . . . 10.0 112.026 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -65.28 -30.92 71.83 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.146 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 651' ' ' VAL . . . . . 0.557 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 30.1 t -62.7 -46.7 95.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.57 -30.44 68.23 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.152 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 653' ' ' ASN . . . . . 0.472 ' HA ' ' NH1' ' A' ' 656' ' ' ARG . 13.9 t30 -66.67 -48.0 70.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.539 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.81 -47.24 85.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.869 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 655' ' ' GLN . . . . . 0.557 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 41.4 mt-30 -64.51 -38.69 91.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.257 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 656' ' ' ARG . . . . . 0.472 ' NH1' ' HA ' ' A' ' 653' ' ' ASN . 18.9 ttp-105 -63.7 -48.46 77.0 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.506 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -61.83 -43.92 97.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.537 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -62.93 -50.89 69.06 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.869 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 659' ' ' ILE . . . . . 0.455 HG13 HD21 ' A' ' 771' ' ' LEU . 7.5 tp -69.49 -34.97 64.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 111.984 0.364 . . . . 10.0 111.984 -178.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -68.1 -36.35 79.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.567 0.222 . . . . 10.0 110.584 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 51.3 m -62.0 -48.09 81.89 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -63.6 -45.24 91.27 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.675 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 34.6 ttt-85 -60.4 -35.47 75.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.821 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -71.04 -38.02 72.55 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.686 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -61.93 -49.4 76.3 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 666' ' ' LEU . . . . . 0.471 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 49.4 mt -66.78 -18.25 65.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.795 -0.638 . . . . 10.0 110.713 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 39.5 tp -81.28 -41.57 21.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.008 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -78.65 -40.08 35.19 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.563 0.579 . . . . 10.0 112.563 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 27.4 m -59.68 140.0 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 121.403 0.621 . . . . 10.0 111.58 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 4.1 m -92.8 -10.08 38.14 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.823 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -130.28 160.97 32.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.946 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.01 14.41 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.877 0.37 . . . . 10.0 111.017 -178.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 5.7 m -54.21 -58.73 6.26 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.851 0.358 . . . . 10.0 111.827 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 674' ' ' GLU . . . . . 0.415 ' HA ' ' OE2' ' A' ' 674' ' ' GLU . 5.0 mm-40 -63.52 -34.83 78.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 10.0 112.018 -179.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -45.92 87.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.794 0.331 . . . . 10.0 110.272 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 676' ' ' ILE . . . . . 0.493 ' O ' ' HB2' ' A' ' 680' ' ' ARG . 36.0 mm -67.43 -37.68 79.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.142 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -63.71 -47.75 79.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.216 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 44.8 m -55.42 -48.29 74.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.745 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 679' ' ' ILE . . . . . 0.435 ' O ' HG23 ' A' ' 683' ' ' VAL . 42.5 pt -75.71 -25.49 17.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.732 -0.387 . . . . 10.0 111.291 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 680' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 676' ' ' ILE . 27.4 ttm-85 -61.66 -45.51 93.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.989 0.423 . . . . 10.0 110.396 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 681' ' ' GLU . . . . . 0.54 ' HG2' HD21 ' A' ' 740' ' ' LEU . 30.0 mt-10 -68.14 -26.89 66.0 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.644 -0.707 . . . . 10.0 111.0 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -80.45 -48.42 12.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.026 -0.533 . . . . 10.0 111.35 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 683' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 679' ' ' ILE . 79.1 t -59.84 -47.93 89.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.44 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -60.86 -39.72 90.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.17 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -61.71 -48.93 78.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.413 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.84 -39.72 82.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.158 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 10.5 m -64.72 -39.47 93.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.374 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -70.47 -48.02 62.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.621 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 689' ' ' ASP . . . . . 0.409 ' HA ' ' O ' ' A' ' 692' ' ' ILE . 4.5 m-20 -58.36 -29.08 65.7 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.873 -179.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -65.13 -26.97 68.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.806 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -115.81 -17.23 11.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.824 0.345 . . . . 10.0 111.457 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 692' ' ' ILE . . . . . 0.506 HG23 ' CD1' ' A' ' 701' ' ' TRP . 67.0 mt -128.21 105.53 19.84 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.432 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.16 138.64 52.5 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.46 2.107 . . . . 10.0 111.422 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -51.18 108.69 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 123.056 2.504 . . . . 10.0 113.465 -179.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 59.17 80.78 0.18 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.678 -0.692 . . . . 10.0 111.482 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 3.5 p -137.23 -164.35 1.57 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.434 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 89.9 mt -85.69 146.79 26.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.709 -0.223 . . . . 10.0 110.917 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . 0.452 ' HA ' ' CE3' ' A' ' 701' ' ' TRP . 19.5 tt0 -58.07 -39.11 77.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.434 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.17 -16.93 64.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.957 0.408 . . . . 10.0 111.422 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 24.2 ttt -87.0 -14.47 41.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.229 0.538 . . . . 10.0 110.115 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 701' ' ' TRP . . . . . 0.506 ' CD1' HG23 ' A' ' 692' ' ' ILE . 43.8 m0 -84.5 120.22 26.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.617 -0.719 . . . . 10.0 110.28 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -85.9 81.72 8.43 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 703' ' ' ILE . . . . . 0.482 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.9 mm -60.98 -48.82 91.45 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.872 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 704' ' ' PRO . . . . . 0.482 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.9 Cg_exo -54.94 -49.12 17.73 Favored 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 122.091 1.861 . . . . 10.0 112.192 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -63.9 -43.18 97.91 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.89 -0.671 . . . . 10.0 112.223 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.517 ' O ' ' HG ' ' A' ' 710' ' ' LEU . 54.0 tp -63.94 -42.13 97.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.547 0.213 . . . . 10.0 110.847 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 707' ' ' GLN . . . . . 0.48 ' O ' ' HD3' ' A' ' 711' ' ' LYS . 9.3 mt-30 -62.03 -50.73 70.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.759 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.98 -36.17 78.74 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -62.31 -48.23 80.75 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.278 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 710' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 706' ' ' LEU . 88.0 mt -64.33 -34.69 78.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.787 0.327 . . . . 10.0 111.219 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 707' ' ' GLN . 8.6 mtpp -74.89 -14.91 60.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.261 -0.427 . . . . 10.0 112.125 -179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -110.15 -45.17 3.63 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.743 0.306 . . . . 10.0 111.618 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -73.06 -41.99 63.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.322 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -109.66 -8.51 14.95 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.988 -0.285 . . . . 10.0 111.7 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 715' ' ' ASP . . . . . 0.485 ' HB2' ' HA ' ' A' ' 828' ' ' LYS . 0.2 OUTLIER 61.64 29.74 18.3 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.098 179.741 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 36.7 tp -117.01 127.73 54.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.861 0.362 . . . . 10.0 110.721 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -90.1 106.38 18.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.39 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 41.7 mt -118.26 119.58 33.09 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.918 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.13 71.38 6.71 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.948 2.432 . . . . 10.0 112.254 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 58.0 mt -64.34 -42.37 95.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.843 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -63.38 -27.88 69.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.963 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -73.69 -47.24 41.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.309 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -66.7 -40.44 88.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.18 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 35.5 tp -58.94 -24.24 62.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.506 -0.77 . . . . 10.0 112.88 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.17 -28.95 13.87 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.814 0.302 . . . . 10.0 111.814 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -86.8 -36.82 18.32 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.178 0.436 . . . . 10.0 112.178 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -120.83 90.07 46.15 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-O 120.739 0.304 . . . . 10.0 110.916 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.31 -14.57 34.48 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.506 2.138 . . . . 10.0 111.663 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.17 -6.59 53.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.388 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 50.0 mt -68.79 -37.56 79.36 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.801 0.334 . . . . 10.0 110.458 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 54.57 -101.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.461 -0.791 . . . . 10.0 111.806 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.84 -55.35 0.77 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.322 . . . . 10.0 111.296 -178.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -56.4 -54.91 40.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.542 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 1.8 m -63.11 -28.61 70.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.996 0.426 . . . . 10.0 110.982 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 5.5 tp -65.24 -43.23 92.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 179.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -60.57 -46.92 88.41 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.441 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -58.44 -46.0 87.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.535 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 26.4 mmm-85 -56.92 -41.46 78.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.071 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 96.3 mt -66.9 -47.32 82.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.723 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 740' ' ' LEU . . . . . 0.54 HD21 ' HG2' ' A' ' 681' ' ' GLU . 60.1 tp -62.8 -51.4 67.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.815 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -60.49 -44.19 96.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.739 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -59.82 -35.62 75.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.626 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 20.3 m -69.16 -40.57 78.07 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.454 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 744' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 740' ' ' LEU . 76.3 mt -64.46 -38.59 82.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.312 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.18 -53.79 54.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.756 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 48.5 t -61.45 -37.29 77.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.422 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -60.63 -46.01 91.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.624 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -61.52 -39.84 92.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.847 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -62.1 -37.13 83.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.615 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -70.41 -39.56 74.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.096 0.474 . . . . 10.0 110.1 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 51.2 tt0 -59.89 -37.98 80.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.41 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -61.19 -24.61 66.44 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.888 0.329 . . . . 10.0 111.888 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 34.1 t -88.44 -46.08 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.84 0.352 . . . . 10.0 111.374 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.0 -39.17 50.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.91 0.386 . . . . 10.0 111.327 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.64 138.24 5.14 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.169 -0.772 . . . . 10.0 111.169 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 756' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -58.51 -60.63 3.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.86 0.362 . . . . 10.0 111.811 -178.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -66.71 -34.24 77.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.908 0.385 . . . . 10.0 110.74 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 8.4 tpt -63.68 -42.52 98.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.484 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 59.3 mmm -62.75 -41.72 99.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.331 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.3 mmp_? -58.2 -39.03 77.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.084 0.469 . . . . 10.0 110.3 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.89 -37.11 72.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.175 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -66.7 -48.81 68.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.024 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -58.42 -46.3 86.73 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.155 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 764' ' ' LYS . . . . . 0.471 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 79.2 tttt -59.48 -45.17 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.989 -0.551 . . . . 10.0 110.108 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.53 -43.28 99.25 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.758 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.1 -42.96 97.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.615 0.245 . . . . 10.0 110.416 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 31.3 mtp -61.43 -50.79 71.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.363 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 97.2 mt -61.04 -45.15 95.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.897 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -59.53 -52.18 66.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.025 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 13.5 m -58.6 -45.94 88.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.758 0.313 . . . . 10.0 111.024 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . 0.455 HD21 HG13 ' A' ' 659' ' ' ILE . 7.1 tt -62.11 -46.05 90.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.466 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -62.75 -45.67 91.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.094 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 15.7 m -63.44 -44.41 94.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.718 -0.674 . . . . 10.0 111.094 -179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 22.8 mt -65.73 -40.07 91.79 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.841 0.353 . . . . 10.0 110.838 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -59.9 -39.25 84.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.927 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 25.1 mttp -61.39 -48.67 80.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.289 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 12.6 tm-20 -65.87 -44.23 85.99 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -57.32 -33.5 67.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.471 -0.786 . . . . 10.0 111.426 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.6 mt -61.91 -53.67 52.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.745 0.307 . . . . 10.0 110.593 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -66.91 -40.31 87.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.801 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.04 -43.95 91.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.762 -0.654 . . . . 10.0 111.495 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 63.2 mmm -61.38 -49.25 77.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.427 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 783' ' ' ASP . . . . . 0.539 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 10.4 t70 -66.19 -39.11 89.43 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.924 -0.31 . . . . 10.0 111.099 -179.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -61.05 -34.52 75.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.87 0.367 . . . . 10.0 110.92 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.3 tp -79.52 -33.98 41.58 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 178.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -62.68 -40.77 98.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.921 -1.036 . . . . 10.0 110.999 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 787' ' ' GLN . . . . . 0.539 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 10.7 pt20 . . . . . 0 C--N 1.325 -0.482 0 CA-C-O 121.148 0.499 . . . . 10.0 110.474 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo . . . . . 0 C--O 1.233 0.266 0 CA-C-O 120.937 0.307 . . . . 10.0 112.074 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.76 154.56 33.91 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 74.87 -52.58 0.67 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.945 0.498 . . . . 10.0 109.786 -178.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -62.03 -51.37 68.27 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.157 -0.474 . . . . 10.0 109.955 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -62.31 -31.41 72.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.378 0.608 . . . . 10.0 109.972 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -67.4 -32.69 73.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.72 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 38.2 mtm105 -57.3 -47.52 81.28 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.251 0.548 . . . . 10.0 109.734 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.48 -43.69 76.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.389 -0.823 . . . . 10.0 110.756 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 17.2 m -60.29 -44.19 95.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.737 -0.665 . . . . 10.0 112.01 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -69.27 -43.17 74.45 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.159 -0.216 . . . . 10.0 110.89 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 19.4 m -61.73 -39.06 90.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.946 0.403 . . . . 10.0 110.261 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 37.4 ttm -64.01 -40.38 96.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.168 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -68.02 -40.35 82.95 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.387 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.19 91.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.369 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -63.03 -36.12 82.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.368 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 12.8 ttt -62.9 -45.47 92.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.446 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.9 -42.43 97.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.541 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -63.84 -37.39 87.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.432 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 37.4 m -72.3 -30.7 65.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.617 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 24.6 tp -56.97 -57.61 11.76 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.99 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 40.9 pttt -65.26 -32.48 74.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.959 0.409 . . . . 10.0 110.513 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -61.82 -58.4 8.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.934 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -62.9 -36.62 83.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.852 -178.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 39.9 t -61.58 -54.62 32.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 120.643 0.259 . . . . 10.0 110.655 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 41.1 mm -63.42 -38.99 83.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.698 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 40.7 t -60.23 -50.69 72.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.738 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 28.5 m -59.43 -45.76 90.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.703 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 92.8 mt -62.32 -24.86 67.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 10.0 112.047 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 6.6 m -94.59 -37.86 11.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.687 0.279 . . . . 10.0 111.403 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 828' ' ' LYS . . . . . 0.485 ' HA ' ' HB2' ' A' ' 715' ' ' ASP . 29.4 mtpp -69.29 -25.42 64.24 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.536 0.569 . . . . 10.0 112.536 -178.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.08 115.34 9.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.43 0.634 . . . . 10.0 110.404 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -100.97 140.15 35.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.898 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 C--N 1.324 -0.523 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.081 -179.804 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.6 t80 . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 120.892 0.377 . . . . 10.0 110.728 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 142.43 163.26 9.6 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.804 -0.713 . . . . 10.0 112.157 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.94 160.57 9.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.795 0.331 . . . . 10.0 110.692 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.566 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 3.9 mmp_? -77.05 146.52 37.26 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 60.63 -89.88 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.93 -1.032 . . . . 10.0 113.685 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -46.22 -62.9 1.14 Allowed 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.905 1.076 . . . . 10.0 113.905 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 16' ' ' ARG . 4.9 tpt180 -66.17 -31.67 72.66 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -178.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.403 ' O ' ' HG3' ' A' ' 21' ' ' MET . 0.2 OUTLIER -66.46 -48.77 68.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.726 0.298 . . . . 10.0 110.899 -179.835 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.92 -36.18 78.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.364 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -47.01 87.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.86 0.362 . . . . 10.0 110.375 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 20' ' ' ARG . 2.6 ttp85 -67.21 -33.85 76.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.095 0.474 . . . . 10.0 110.354 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.683 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 62.1 mtt -69.86 -37.4 76.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.334 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.7 tpp180 -62.07 -33.73 74.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.111 -0.495 . . . . 10.0 109.996 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -63.21 -41.14 99.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.766 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.6 t -68.2 -36.65 76.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.659 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.434 HG13 HD12 ' A' ' 88' ' ' LEU . 46.2 t -60.24 -37.59 74.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.078 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -62.55 -38.92 91.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.581 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.9 mt -68.12 -42.54 85.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.938 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 79.1 mt -60.78 -39.55 82.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.288 0.565 . . . . 10.0 109.843 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -67.86 -21.97 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.819 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -86.45 -23.1 26.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.58 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.9 mmt -84.77 -23.01 29.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.616 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.61 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 16.3 tt0 -55.84 -52.11 75.0 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 112.423 0.527 . . . . 10.0 112.423 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 75.8 Cg_exo -52.23 -37.41 70.24 Favored 'Trans proline' 0 C--N 1.361 1.195 0 C-N-CA 121.957 1.771 . . . . 10.0 112.399 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -72.32 -39.06 68.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.393 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 22.7 mmt -65.42 -39.29 91.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.593 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.61 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 28.7 mt-10 -63.92 -25.22 68.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.257 0.551 . . . . 10.0 110.06 178.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -82.33 -30.68 30.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.078 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.3 mp -73.25 148.42 43.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.474 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.6 p -75.45 167.42 21.93 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.387 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.9 -37.51 87.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.53 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -68.92 -32.52 72.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.511 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -66.37 -33.72 76.35 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.508 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.32 -46.12 88.15 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.7 ttpt -61.92 -34.13 75.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.08 -0.964 . . . . 10.0 109.481 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.06 -34.37 86.47 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.684 -0.689 . . . . 10.0 111.421 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -66.54 -36.2 82.09 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.024 -0.362 . . . . 10.0 110.024 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.7 m -61.7 -45.68 92.93 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.158 0.504 . . . . 10.0 109.647 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.11 -33.41 75.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.775 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -60.7 -47.7 85.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.292 -0.867 . . . . 10.0 110.284 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -61.42 -41.12 96.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.976 0.417 . . . . 10.0 109.979 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -59.06 -40.27 84.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.529 -0.759 . . . . 10.0 110.402 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -77.59 -36.47 51.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.368 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.42 HH12 ' CD ' ' A' ' 66' ' ' GLU . 63.2 mtp180 -64.68 -31.19 72.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.519 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.1 mt -60.4 -31.99 70.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.844 0.354 . . . . 10.0 110.8 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.5 -28.43 66.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.502 . . . . 10.0 110.479 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -76.23 -14.53 60.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.658 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 110.32 22.36 6.51 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.805 -0.712 . . . . 10.0 112.287 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -73.22 144.43 46.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.785 0.326 . . . . 10.0 110.153 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.0 t -86.86 136.72 22.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.164 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.42 HD11 ' O ' ' A' ' 118' ' ' LEU . 13.9 tp -62.34 -39.64 93.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.108 0.48 . . . . 10.0 110.1 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -69.87 -16.48 63.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.21 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -90.9 -15.3 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.403 0.62 . . . . 10.0 110.259 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.0 mt -86.42 -11.98 50.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.104 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.504 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 85.0 mt -50.38 -51.89 59.72 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 113.459 0.911 . . . . 10.0 113.459 -178.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.504 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 52.2 Cg_exo -53.12 -35.89 74.62 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 122.164 1.91 . . . . 10.0 113.488 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.488 ' O ' HG23 ' A' ' 70' ' ' VAL . 44.5 mt-10 -89.74 -45.45 9.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.724 0.297 . . . . 10.0 111.507 -179.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.496 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -60.1 -47.88 84.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.232 -0.44 . . . . 10.0 112.142 -178.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -64.12 -30.67 71.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.721 0.296 . . . . 10.0 110.67 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.13 -43.95 81.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 10.0 109.965 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 66' ' ' GLU . 47.5 t -61.33 -43.58 96.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.827 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 67' ' ' ALA . 45.9 t -62.01 -46.19 97.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.318 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.438 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 11.6 ttm180 -60.64 -41.54 95.14 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.18 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.511 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 18.9 tp10 -63.95 -50.87 66.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.575 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.49 -33.33 71.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.035 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 46.3 m -59.32 -42.82 92.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.282 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.511 ' HE2' ' HA ' ' A' ' 73' ' ' GLU . 40.1 mtmt -73.19 -16.98 61.41 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.299 0.481 . . . . 10.0 112.299 -178.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 -100.13 -37.13 9.08 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.993 -0.283 . . . . 10.0 111.636 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 85.5 t -82.96 -51.45 14.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 120.785 0.326 . . . . 10.0 111.796 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -99.71 -38.31 8.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.928 0.394 . . . . 10.0 111.206 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.39 4.43 49.95 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.94 -0.648 . . . . 10.0 111.517 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 63.9 mtt -111.26 138.13 48.11 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -90.48 135.32 33.77 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.857 0.36 . . . . 10.0 110.673 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.68 112.15 4.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.854 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -59.14 152.83 19.47 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.25 0.547 . . . . 10.0 111.778 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -61.82 -36.55 81.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.286 -0.87 . . . . 10.0 111.644 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.6 m -64.67 -31.62 54.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.06 0.457 . . . . 10.0 110.894 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -73.21 -27.9 61.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.281 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.434 HD12 HG13 ' A' ' 25' ' ' VAL . 97.7 mt -66.28 -33.88 76.73 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.718 -0.475 . . . . 10.0 109.718 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.91 -50.07 67.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.471 178.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -62.56 -32.5 83.48 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.317 -0.856 . . . . 10.0 112.066 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -60.21 -36.4 90.62 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 121.06 -0.591 . . . . 10.0 112.196 179.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.683 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 25.0 ttm -74.9 -36.15 62.23 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.4 t -64.41 -41.74 93.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.152 0.501 . . . . 10.0 109.958 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 91.4 mt -73.95 -4.43 35.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.672 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -91.43 -21.36 21.0 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.242 0.544 . . . . 10.0 109.948 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -105.47 -174.26 2.49 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.827 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -83.56 67.59 9.46 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.135 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 74.2 m -149.2 166.86 27.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.138 0.494 . . . . 10.0 111.731 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.586 HD12 HG11 ' A' ' 211' ' ' VAL . 35.8 mm -113.26 135.5 52.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.173 178.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -110.3 124.8 52.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.923 0.392 . . . . 10.0 111.824 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.31 129.26 36.56 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 108' ' ' LYS . 2.9 ttt -136.12 135.98 39.73 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.895 0.378 . . . . 10.0 111.082 -179.134 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.435 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 13.6 mmm180 -67.96 152.37 45.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.088 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.68 96.33 1.58 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.762 -0.653 . . . . 10.0 111.509 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 138.88 -15.5 3.31 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.382 -0.913 . . . . 10.0 113.537 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -84.23 27.22 0.7 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.978 0.362 . . . . 10.0 111.978 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.71 56.06 16.79 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.561 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.458 ' HA ' ' SD ' ' A' ' 102' ' ' MET . 50.6 tttm -55.38 -50.83 68.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.853 0.358 . . . . 10.0 111.745 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -24.65 63.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.947 0.403 . . . . 10.0 111.829 -179.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 21.2 tp -72.52 -31.64 65.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.867 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 19.0 m -71.41 -28.56 64.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.851 0.358 . . . . 10.0 111.7 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.81 66.13 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.771 1.026 . . . . 10.0 113.771 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 17.0 p -75.46 -22.39 57.32 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.319 0.489 . . . . 10.0 112.319 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 48.4 mt -68.26 -57.68 8.59 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 112.338 0.496 . . . . 10.0 112.338 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -64.63 -28.39 60.85 Favored 'Trans proline' 0 C--N 1.356 0.965 0 C-N-CA 122.055 1.837 . . . . 10.0 112.032 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.34 -49.26 67.54 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.458 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -62.43 -45.88 91.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.896 0.379 . . . . 10.0 110.685 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.42 ' O ' HD11 ' A' ' 60' ' ' LEU . 25.8 tp -59.45 -50.27 74.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.788 -0.642 . . . . 10.0 111.842 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -75.71 -19.13 59.3 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.897 0.332 . . . . 10.0 111.897 -178.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.7 -26.73 65.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.889 0.376 . . . . 10.0 110.942 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 47.6 mt -61.2 -23.02 65.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.561 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.2 p -69.74 -24.22 63.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.869 0.366 . . . . 10.0 110.831 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.35 9.7 81.49 Favored Glycine 0 C--N 1.333 0.389 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.656 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -86.59 -11.78 50.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.702 0.287 . . . . 10.0 111.525 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.08 110.84 2.6 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.5 -0.857 . . . . 10.0 113.834 178.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 62.1 t -84.59 114.56 25.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -93.11 104.07 16.3 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.943 0.402 . . . . 10.0 111.034 -178.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 39.2 t -93.48 123.9 45.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.204 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 96.3 t -105.2 121.92 57.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.993 -179.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 2.7 p -108.83 165.36 11.62 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.459 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 15.5 m -75.9 -29.83 20.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.85 0.357 . . . . 10.0 111.529 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -145.04 168.54 20.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.405 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.08 -23.09 63.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.166 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -58.73 -52.5 65.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.569 -0.741 . . . . 10.0 110.646 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 30.5 mt -69.47 -35.68 75.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.716 0.293 . . . . 10.0 110.461 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.43 -50.89 71.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.05 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.29 -36.41 61.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.018 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.44 HH21 ' CG ' ' A' ' 139' ' ' ASP . 5.9 ttp85 -56.33 -58.88 6.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.523 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . 0.44 ' CG ' HH21 ' A' ' 138' ' ' ARG . 1.5 m-20 -69.36 -31.97 70.73 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.08 -0.509 . . . . 10.0 112.019 -178.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.493 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -60.87 -37.89 83.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.762 0.315 . . . . 10.0 111.214 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.2 mm-40 -91.59 -28.86 17.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.486 -0.325 . . . . 10.0 111.487 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -74.59 -43.86 53.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.827 0.346 . . . . 10.0 111.383 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 40.3 m-20 -88.41 -0.89 57.68 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.072 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 53.3 ttm-85 -61.69 -49.93 84.26 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.591 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' PRO . . . . . 0.47 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 17.2 Cg_exo -68.86 5.02 1.51 Allowed 'Trans proline' 0 C--N 1.361 1.218 0 C-N-CA 122.353 2.035 . . . . 10.0 112.504 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.6 tp -105.93 -52.45 2.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.726 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -73.86 -46.48 44.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.499 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.428 ' HA ' ' O ' ' A' ' 152' ' ' LEU . 82.3 mt-10 -68.91 -19.65 64.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.883 0.373 . . . . 10.0 111.047 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -73.39 -24.24 60.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.302 0.573 . . . . 10.0 109.556 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 71.4 mt -96.56 -11.18 25.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.938 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 114.99 -6.63 21.83 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.509 -0.853 . . . . 10.0 113.592 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 148' ' ' GLU . 92.4 mt -80.89 144.95 31.58 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.167 0.484 . . . . 10.0 110.733 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.1 p -95.39 133.15 39.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.508 -0.315 . . . . 10.0 111.108 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 35.2 t -108.97 130.73 61.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.441 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -124.98 145.53 15.74 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 111.665 -0.574 . . . . 10.0 111.665 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 4.2 tp -119.08 129.16 75.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.962 0.41 . . . . 10.0 110.511 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -114.26 112.67 23.48 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.162 -0.472 . . . . 10.0 109.999 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 49.3 mt -109.46 148.98 39.19 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.384 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' PRO . . . . . 0.486 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 19.0 Cg_endo -58.3 121.24 9.65 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.753 2.302 . . . . 10.0 112.539 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.2 6.74 62.79 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.928 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . 0.449 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 44.2 ttm -67.31 139.07 94.56 Favored Pre-proline 0 C--N 1.325 -0.473 0 C-N-CA 122.049 0.14 . . . . 10.0 110.96 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . 0.408 ' HD2' ' HG3' ' A' ' 161' ' ' MET . 71.9 Cg_exo -52.69 147.32 31.65 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.885 2.39 . . . . 10.0 112.367 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . 0.459 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -54.47 -48.75 94.04 Favored Pre-proline 0 CA--C 1.54 0.563 0 N-CA-C 112.785 0.661 . . . . 10.0 112.785 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.459 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.8 Cg_exo -57.65 -42.33 61.36 Favored 'Trans proline' 0 C--N 1.358 1.062 0 C-N-CA 121.946 1.764 . . . . 10.0 112.346 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -64.96 -41.7 95.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.836 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.449 ' HE2' ' O ' ' A' ' 161' ' ' MET . 60.8 mttm -58.91 -43.5 91.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.137 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -58.13 -40.61 81.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.932 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -68.48 -40.65 80.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.682 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -65.86 -43.01 89.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.351 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' TYR . . . . . 0.431 ' HD2' ' O ' ' A' ' 166' ' ' LYS . 42.1 m-85 -74.34 -22.79 59.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.998 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.19 -14.37 59.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.654 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -71.58 173.14 8.43 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.305 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -74.72 -39.43 61.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.286 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.0 mp -127.61 121.35 56.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.883 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 6.4 m -112.36 111.98 23.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.847 0.356 . . . . 10.0 111.359 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -91.34 133.34 35.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.101 -0.5 . . . . 10.0 109.692 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -167.72 179.55 41.03 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.347 -0.93 . . . . 10.0 112.838 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.09 152.16 21.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.541 0.21 . . . . 10.0 110.549 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -60.47 -41.38 94.07 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.953 0.353 . . . . 10.0 111.953 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -56.46 -50.95 70.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.709 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.486 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 3.8 tp10 -70.71 -38.49 73.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.91 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -56.81 -39.44 74.17 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.861 0.363 . . . . 10.0 111.152 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -70.72 -44.33 57.18 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.821 -0.704 . . . . 10.0 112.242 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -67.17 -35.28 79.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.915 0.388 . . . . 10.0 110.738 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 185' ' ' ASP . . . . . 0.435 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 6.8 m-20 -59.16 -44.62 92.14 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.689 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -62.85 -38.22 89.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.466 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 187' ' ' LEU . . . . . 0.471 HD22 ' HB1' ' A' ' 373' ' ' ALA . 54.2 mt -62.65 -47.19 84.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.514 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 188' ' ' ARG . 42.4 mtm-85 -67.27 -40.7 86.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 10.0 110.491 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.11 -49.12 78.88 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.395 -0.821 . . . . 10.0 111.608 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.66 -3.6 47.98 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.784 -0.644 . . . . 10.0 112.656 -178.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 23.0 ttp -104.21 4.0 33.44 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.879 0.371 . . . . 10.0 110.966 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -69.72 174.01 5.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.82 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -109.34 -21.59 12.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.053 0.454 . . . . 10.0 110.601 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.05 142.33 45.2 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.871 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 195' ' ' PRO . . . . . 0.409 ' HD3' ' O ' ' A' ' 667' ' ' LEU . 13.2 Cg_endo -57.72 -30.18 88.19 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.811 2.341 . . . . 10.0 112.721 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -69.91 -17.5 63.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.963 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -83.14 -13.03 56.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.302 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -56.09 157.74 4.43 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.382 0.426 . . . . 10.0 111.426 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 8.2 m -128.57 -25.26 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.228 -0.442 . . . . 10.0 112.007 -179.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -92.77 -178.2 4.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.065 0.459 . . . . 10.0 111.361 -179.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -134.03 -178.2 4.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.765 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 17.4 ttmm -57.32 131.8 51.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.274 0.559 . . . . 10.0 111.593 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 12.5 mt -82.65 74.57 9.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.158 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -84.33 -63.45 1.34 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.94 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -128.3 137.28 51.88 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.065 0.459 . . . . 10.0 111.731 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.468 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -129.71 127.59 40.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.364 -0.835 . . . . 10.0 109.984 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 61.8 tp -119.79 108.9 14.96 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.08 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.3 p -98.75 131.26 46.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 CA-C-O 121.048 0.452 . . . . 10.0 110.776 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -59.05 -66.21 0.54 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.614 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 210' ' ' GLU . . . . . 0.521 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 34.3 tt0 -112.3 111.05 21.64 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.833 0.349 . . . . 10.0 110.577 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.586 HG11 HD12 ' A' ' 99' ' ' ILE . 34.3 m -82.34 -18.59 10.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.844 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 212' ' ' ASP . . . . . 0.418 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.0 OUTLIER -51.82 -57.49 9.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.173 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . 0.408 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 4.9 p -88.61 -59.17 2.3 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.965 -0.561 . . . . 10.0 112.051 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 69.2 mt -52.73 -38.31 27.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 113.913 1.079 . . . . 10.0 113.913 -177.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 215' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 211' ' ' VAL . 8.0 mt -96.47 -53.79 3.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.933 0.716 . . . . 10.0 112.933 -178.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 216' ' ' ILE . . . . . 0.418 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 46.7 mm -75.91 -57.15 6.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 113.064 0.764 . . . . 10.0 113.064 -177.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 217' ' ' ASP . . . . . 0.408 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 67.0 m-20 -64.22 -42.7 96.48 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.035 0.383 . . . . 10.0 112.035 -178.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -90.09 16.65 8.04 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 -178.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.88 -38.69 91.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.883 0.373 . . . . 10.0 111.071 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 220' ' ' ARG . . . . . 0.412 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 3.5 mtp-105 -106.13 31.68 4.95 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.308 -0.406 . . . . 10.0 111.488 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 33.9 m -105.12 102.99 39.56 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 222' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 72.5 Cg_endo -94.95 129.38 0.48 Allowed 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.095 2.53 . . . . 10.0 113.473 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 223' ' ' LEU . . . . . 0.475 ' O ' ' HA ' ' A' ' 374' ' ' SER . 86.9 mt -82.91 110.87 18.27 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 77.0 mt -108.33 125.95 65.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 65.8 mt . . . . . 0 C--N 1.326 -0.434 0 N-CA-C 108.578 -0.897 . . . . 10.0 108.578 177.602 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 373' ' ' ALA . . . . . 0.471 ' HB1' HD22 ' A' ' 187' ' ' LEU . . . . . . . . 0 CA--C 1.52 -0.186 0 N-CA-C 110.638 -0.134 . . . . 10.0 110.638 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 374' ' ' SER . . . . . 0.475 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 41.6 m -155.13 135.59 13.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.495 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.415 ' HB ' HD21 ' A' ' 187' ' ' LEU . 18.9 tt -149.73 136.8 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.165 0.507 . . . . 10.0 110.62 178.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.64 143.73 26.45 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.855 -0.612 . . . . 10.0 109.715 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -55.5 -48.42 74.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.835 0.35 . . . . 10.0 110.522 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -57.59 -40.24 78.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.643 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 62.7 m-20 -73.99 -14.94 61.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.981 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -88.63 -42.53 11.96 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.319 -0.622 . . . . 10.0 109.319 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -70.05 -18.41 63.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.769 -0.651 . . . . 10.0 110.7 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -74.3 -11.39 60.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.407 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 43.1 mt -93.49 0.44 56.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.564 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . 0.468 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 26.1 m-85 -94.52 142.33 27.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.591 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -75.1 -61.51 1.87 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.196 0.522 . . . . 10.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -102.34 107.68 18.78 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 44.8 tp -120.72 120.02 34.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.971 -0.558 . . . . 10.0 109.911 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -143.04 166.49 24.49 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.524 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.89 173.92 46.06 Favored Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.083 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 13.6 mtm -110.93 146.88 35.8 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.707 0.289 . . . . 10.0 110.232 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 6.7 t -126.63 160.13 31.59 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -84.7 163.11 38.25 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.489 -0.863 . . . . 10.0 111.985 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 393' ' ' THR . . . . . 0.435 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 3.2 m -71.08 73.1 0.62 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.196 0.522 . . . . 10.0 110.482 179.214 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -135.44 -30.54 1.01 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.778 -0.646 . . . . 10.0 111.8 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 19.9 t70 61.51 -114.55 0.56 Allowed 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 14.0 m 65.52 -86.39 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.898 0.703 . . . . 10.0 112.898 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -84.03 30.51 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 10.0 111.456 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -58.13 -45.6 87.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.456 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -65.61 -23.15 66.76 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.628 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -75.86 -29.3 58.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.633 0.254 . . . . 10.0 110.443 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -60.02 -42.52 94.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.994 0.426 . . . . 10.0 110.524 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.4 m -81.84 -5.76 58.49 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.963 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 17.8 m -106.14 -40.85 5.52 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.855 -0.338 . . . . 10.0 111.795 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 53.9 mt -85.99 -46.31 16.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.554 -0.293 . . . . 10.0 111.593 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -108.51 -6.11 16.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.625 0.25 . . . . 10.0 111.316 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 58.96 44.76 15.98 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.017 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 407' ' ' LEU . . . . . 0.431 HD13 HD11 ' A' ' 99' ' ' ILE . 36.1 mt -112.02 138.13 49.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.776 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 408' ' ' ASP . . . . . 0.566 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 28.7 t0 -82.47 142.62 31.75 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.729 -0.471 . . . . 10.0 109.729 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 1.8 m -100.79 106.31 17.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.931 0.396 . . . . 10.0 111.487 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 83.9 t -107.05 132.81 53.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.205 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 60.2 t -96.76 126.55 49.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.52 -0.309 . . . . 10.0 110.398 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 44.8 t -95.73 131.56 29.06 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.548 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -65.17 154.42 73.56 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.645 2.23 . . . . 10.0 112.757 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.5 p -79.91 168.68 18.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.034 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -78.9 -33.41 45.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.436 0.636 . . . . 10.0 109.407 179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -124.22 151.07 65.39 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.401 -0.818 . . . . 10.0 109.557 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.68 110.4 1.44 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.502 2.135 . . . . 10.0 111.999 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 58.8 ttp -72.92 102.52 3.47 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.112 0.482 . . . . 10.0 110.545 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.8 pt -96.14 60.72 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.238 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 -86.25 128.53 34.92 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -93.81 97.97 10.77 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.832 0.348 . . . . 10.0 111.136 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -90.14 122.19 32.88 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.068 -0.715 . . . . 10.0 109.068 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 22.4 mt -104.65 150.78 38.95 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.734 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.98 141.77 98.65 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.945 2.43 . . . . 10.0 112.56 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -60.26 131.91 52.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.976 -0.557 . . . . 10.0 110.907 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.27 106.4 17.59 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.951 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 72.8 t -103.93 123.19 57.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.834 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 428' ' ' TYR . . . . . 0.434 ' HB3' ' HB2' ' A' ' 433' ' ' GLU . 2.5 m-85 -105.91 -175.18 2.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.625 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.54 -77.42 0.25 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.438 -0.505 . . . . 10.0 110.27 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 76.0 p -83.77 156.39 22.56 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.2 -0.296 . . . . 10.0 110.2 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -62.93 -27.07 69.13 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.024 -0.361 . . . . 10.0 110.024 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.12 -45.15 87.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.796 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 433' ' ' GLU . . . . . 0.434 ' HB2' ' HB3' ' A' ' 428' ' ' TYR . 18.8 mt-10 -65.73 -42.22 91.31 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.492 178.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -57.82 -51.59 68.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.803 -1.09 . . . . 10.0 111.344 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 45.7 mm -67.87 -38.46 80.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.682 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.82 -39.59 92.31 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.813 0.34 . . . . 10.0 110.459 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -61.57 -38.11 86.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.24 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 438' ' ' ILE . . . . . 0.427 HG23 HG21 ' A' ' 557' ' ' ILE . 84.4 mt -63.37 -44.46 99.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.648 178.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.99 -43.77 96.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.262 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -60.48 -43.04 97.37 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.44 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . 0.616 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 30.2 t70 -66.47 -42.93 86.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.108 179.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 75.3 mt -61.14 -39.36 82.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.451 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -59.07 -39.98 83.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.999 0.428 . . . . 10.0 110.44 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.25 -39.69 82.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.221 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.616 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 10.7 mmt180 -66.91 -46.73 73.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.246 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -36.41 82.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.883 0.373 . . . . 10.0 110.597 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.39 -32.9 74.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.33 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -89.89 -5.51 56.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.179 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 77.98 29.17 54.99 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.821 -0.704 . . . . 10.0 111.719 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 450' ' ' GLN . . . . . 0.557 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 62.4 tt0 -99.38 126.96 35.84 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-O 120.401 0.143 . . . . 10.0 111.015 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.15 142.62 56.42 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 122.592 2.195 . . . . 10.0 111.307 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 52.3 t -119.86 131.45 72.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.569 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 43.3 tp -120.18 104.25 9.93 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.396 -0.594 . . . . 10.0 109.396 178.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 32.2 t -90.23 124.07 42.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.789 -0.642 . . . . 10.0 110.256 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -104.37 81.58 0.34 Allowed Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.799 -0.715 . . . . 10.0 111.977 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.13 104.82 13.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.886 0.374 . . . . 10.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 33.9 pt -72.41 -21.52 20.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.194 0.521 . . . . 10.0 110.166 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 458' ' ' SER . . . . . 0.488 ' HB2' ' HB2' ' A' ' 461' ' ' LYS . 1.1 m -99.27 118.98 37.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.483 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 57.2 mt -59.09 -41.35 83.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.945 0.402 . . . . 10.0 111.865 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 27.6 mp0 -63.93 -24.63 67.8 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.186 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 458' ' ' SER . 0.1 OUTLIER -77.69 -31.42 52.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.426 -0.352 . . . . 10.0 110.607 -179.488 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 49.1 m -60.49 -38.91 85.82 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.126 0.488 . . . . 10.0 109.939 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.46 -42.98 82.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.342 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 55.1 tp -64.13 -52.1 60.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.663 -0.698 . . . . 10.0 111.498 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.0 -30.34 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 120.672 0.272 . . . . 10.0 111.013 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 9.1 t -66.75 -40.97 88.48 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.36 -47.02 83.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.121 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -60.97 -40.49 93.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.141 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 17.0 mt -65.92 -35.81 81.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.951 0.405 . . . . 10.0 110.586 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.0 m -75.04 -33.83 61.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.091 0.472 . . . . 10.0 109.803 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -64.4 -41.17 96.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.111 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -75.86 -31.51 59.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.306 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 94.82 41.38 4.12 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.014 -0.613 . . . . 10.0 112.497 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 35.1 mt -110.53 137.81 41.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 CA-C-O 120.664 0.269 . . . . 10.0 110.999 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -61.57 134.98 57.46 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.477 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -163.68 156.47 18.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.78 0.324 . . . . 10.0 111.177 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -140.33 133.36 29.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . 0.559 HG22 HD12 ' A' ' 502' ' ' ILE . 20.1 t -105.0 133.69 48.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.857 0.36 . . . . 10.0 111.426 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.428 ' HB3' ' OE2' ' A' ' 487' ' ' GLU . 80.0 mt -84.93 138.83 32.26 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -144.34 135.94 25.79 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.293 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -59.2 -24.32 63.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 10.0 112.018 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -78.7 -9.27 59.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.605 0.24 . . . . 10.0 110.963 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' PHE . . . . . 0.49 ' O ' ' HG3' ' A' ' 487' ' ' GLU . 59.2 m-85 -131.79 49.95 2.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.992 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' HIS . . . . . 0.447 ' HA ' ' OE1' ' A' ' 487' ' ' GLU . 3.3 m80 -57.46 -33.64 68.16 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.912 0.387 . . . . 10.0 111.26 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.92 -33.57 76.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.103 0.478 . . . . 10.0 110.468 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -77.83 -36.68 49.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.647 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' A' ' 483' ' ' PHE . 49.4 mt-10 -59.29 -39.01 81.64 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.661 -0.7 . . . . 10.0 110.523 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -59.61 -27.13 66.05 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.297 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -88.51 -38.24 15.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.861 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.87 -48.09 72.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.393 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 81.3 t -60.63 -30.95 47.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.828 0.347 . . . . 10.0 111.062 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -61.83 -28.37 69.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.312 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -120.36 21.58 11.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.824 0.345 . . . . 10.0 110.846 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -67.71 -20.03 65.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.996 0.427 . . . . 10.0 110.911 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -98.01 11.97 64.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.876 -0.678 . . . . 10.0 112.068 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -73.39 140.13 79.03 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 110.088 -0.338 . . . . 10.0 110.088 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -52.3 123.16 12.04 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.701 2.267 . . . . 10.0 113.047 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 73.68 15.99 3.94 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 123.948 0.78 . . . . 10.0 112.921 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -91.56 119.88 31.88 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.567 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 40.2 t -100.15 107.99 22.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.067 0.461 . . . . 10.0 110.374 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 8.0 m -107.39 129.84 54.87 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.528 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 502' ' ' ILE . . . . . 0.559 HD12 HG22 ' A' ' 478' ' ' VAL . 61.1 mt -109.54 114.18 46.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.219 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -97.37 114.93 26.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.817 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 16.0 m -86.48 112.45 21.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.203 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 65.8 t30 58.75 77.18 0.31 Allowed 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.667 0.604 . . . . 10.0 111.204 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.35 141.11 55.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.942 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -91.66 -171.09 2.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.404 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -75.73 153.8 44.5 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.695 -0.764 . . . . 10.0 112.475 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.521 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 59.2 mtt180 66.6 -80.83 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.293 0.637 . . . . 10.0 112.104 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.57 144.76 13.65 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.114 -0.565 . . . . 10.0 111.928 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.03 154.13 41.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.63 0.252 . . . . 10.0 111.206 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -75.71 120.58 21.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.883 0.373 . . . . 10.0 110.961 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 93.4 mt -99.58 108.76 23.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.788 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 6.8 t -78.79 131.07 35.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.92 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 48.9 mt -65.85 127.38 31.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.321 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 95.97 -9.44 68.05 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.084 -0.579 . . . . 10.0 111.672 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 113.72 -176.67 17.39 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.864 -0.894 . . . . 10.0 110.864 -179.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 5.3 p -121.75 93.37 3.98 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.147 0.498 . . . . 10.0 110.642 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 17.9 p-90 -60.35 -27.04 67.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.443 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -62.5 -36.37 82.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.226 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.36 -35.15 35.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.061 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 522' ' ' GLU . . . . . 0.413 ' O ' ' HG ' ' A' ' 526' ' ' LEU . 47.8 mt-10 -62.62 -44.96 94.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.822 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 28.1 m -71.65 -25.95 25.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-O 120.994 0.426 . . . . 10.0 110.809 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -73.7 -25.51 60.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.151 0.5 . . . . 10.0 110.171 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -87.18 -0.83 57.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.491 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 522' ' ' GLU . 88.4 mt -84.24 148.57 26.64 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.886 0.374 . . . . 10.0 111.21 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -69.3 -39.92 77.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.9 -0.591 . . . . 10.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -152.85 88.66 3.85 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.21 104.11 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.057 2.504 . . . . 10.0 112.359 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.17 148.71 29.43 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.722 -0.672 . . . . 10.0 109.875 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -52.41 -50.85 61.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.951 0.405 . . . . 10.0 111.669 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 51.0 mp0 -64.69 -31.87 73.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.629 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -68.99 -44.09 73.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.029 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 79.1 mt -61.59 -42.72 95.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.183 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -61.21 -42.06 97.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.378 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -63.57 -47.33 81.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.552 . . . . 10.0 110.167 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 61.2 mt -63.95 -37.51 79.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.254 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -61.78 -43.29 99.15 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -68.63 -43.43 76.37 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.449 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.67 -47.18 86.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.582 -0.736 . . . . 10.0 109.868 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 61.3 t90 -63.83 -39.5 94.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.335 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -54.04 -48.46 70.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.579 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 39.0 t -61.85 -43.88 98.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.607 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -65.72 -44.11 87.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.95 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -58.94 -50.86 72.47 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.373 -0.83 . . . . 10.0 111.167 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.49 -24.02 63.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.347 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -67.48 -36.82 81.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.273 0.559 . . . . 10.0 109.716 178.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.16 -32.06 55.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.549 -0.75 . . . . 10.0 110.008 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 84.3 mt -64.33 -39.95 94.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.188 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -69.97 -36.26 75.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.918 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 551' ' ' ALA . . . . . 0.557 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -64.94 -49.16 71.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.465 -0.789 . . . . 10.0 110.793 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 141.42 23.43 0.24 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.399 -0.905 . . . . 10.0 113.609 179.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 74.47 -166.78 54.81 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.502 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 30.5 tp -75.44 125.84 29.81 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.17 -0.307 . . . . 10.0 110.17 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -98.53 110.61 23.18 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.391 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 27.4 mm -90.24 133.89 30.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.818 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 557' ' ' ILE . . . . . 0.427 HG21 HG23 ' A' ' 438' ' ' ILE . 14.0 mt -124.82 121.34 60.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.264 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -107.42 134.29 12.12 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.834 -0.698 . . . . 10.0 111.496 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 17.3 p -92.57 -57.32 2.71 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.112 0.482 . . . . 10.0 111.362 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -114.31 133.05 55.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.438 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 561' ' ' ARG . . . . . 0.523 ' H ' HD21 ' A' ' 588' ' ' LEU . 16.6 mmt180 -77.36 134.62 38.42 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 178.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -78.26 139.4 38.89 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.201 -0.296 . . . . 10.0 110.201 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -57.14 -48.09 79.52 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . 0.468 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.3 OUTLIER -77.53 114.94 16.88 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.186 178.121 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -65.8 -24.08 66.84 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.535 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -61.42 -48.86 79.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.961 0.41 . . . . 10.0 110.463 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 69.0 mt -75.83 -34.83 28.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.118 0.485 . . . . 10.0 110.205 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -63.31 -41.1 98.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.35 -0.841 . . . . 10.0 110.621 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -75.59 -35.27 60.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.831 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -62.68 -27.42 69.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.909 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 20.4 tp -71.35 -28.59 64.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.1 0.476 . . . . 10.0 110.218 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -81.25 -30.43 34.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.248 0.547 . . . . 10.0 109.905 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.34 7.41 17.88 Favored Glycine 0 CA--C 1.52 0.382 0 CA-C-N 115.627 -0.715 . . . . 10.0 113.446 -179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -74.16 -30.59 62.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.988 0.394 . . . . 10.0 109.989 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 2.4 t -93.65 162.96 13.73 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.191 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 66.46 51.98 38.64 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.869 -0.681 . . . . 10.0 112.161 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -88.71 146.24 25.17 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.266 -0.272 . . . . 10.0 110.266 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 60.61 20.51 10.4 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 123.544 0.528 . . . . 10.0 110.438 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 75.5 40.4 32.79 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.995 -0.548 . . . . 10.0 112.641 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.33 -163.72 1.01 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.73 0.265 . . . . 10.0 110.963 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -92.33 177.32 6.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.266 0.555 . . . . 10.0 111.981 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 153.42 173.51 22.71 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.583 -0.735 . . . . 10.0 111.664 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 2.6 p -146.96 148.45 31.76 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.005 -0.369 . . . . 10.0 110.005 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.6 137.42 31.89 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.621 0.248 . . . . 10.0 111.137 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -158.91 147.88 18.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.735 178.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -115.19 147.62 40.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.266 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -130.02 111.62 12.68 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 588' ' ' LEU . . . . . 0.523 HD21 ' H ' ' A' ' 561' ' ' ARG . 4.9 mp -122.18 179.39 4.56 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.115 0.483 . . . . 10.0 111.594 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 51.9 p -132.3 179.91 5.83 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.059 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 71.4 mmm -83.46 -8.32 59.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.857 0.361 . . . . 10.0 111.151 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.12 9.74 40.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.196 0.522 . . . . 10.0 110.062 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.67 149.2 38.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.659 -0.7 . . . . 10.0 110.533 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -59.94 -28.17 67.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.164 -0.471 . . . . 10.0 111.603 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 594' ' ' LEU . . . . . 0.654 ' O ' HG12 ' A' ' 597' ' ' ILE . 7.2 tp -63.8 -26.41 68.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.415 -179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 22.4 mmt -77.44 -2.74 36.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.875 0.369 . . . . 10.0 111.286 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -101.92 -1.51 31.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.231 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 597' ' ' ILE . . . . . 0.654 HG12 ' O ' ' A' ' 594' ' ' LEU . 16.6 pt -94.36 4.6 8.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.965 0.412 . . . . 10.0 110.807 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -86.17 19.76 2.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.953 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.44 -59.29 0.55 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.733 0.813 . . . . 10.0 111.997 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 1.7 m -122.1 139.28 53.91 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.304 -0.258 . . . . 10.0 110.304 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -64.93 -26.16 68.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.09 0.471 . . . . 10.0 110.336 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.2 -32.56 70.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.461 179.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.8 t -67.35 -45.56 85.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.67 -0.492 . . . . 10.0 109.67 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.01 -22.97 63.06 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.404 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -59.92 -25.95 62.42 Favored Glycine 0 C--N 1.332 0.331 0 CA-C-N 115.912 -0.585 . . . . 10.0 112.715 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -65.41 -18.55 65.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.666 0.269 . . . . 10.0 111.047 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -94.99 -14.57 24.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.907 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -69.01 -30.42 68.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.893 0.378 . . . . 10.0 110.747 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm -98.28 30.2 3.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.912 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 38.8 tp -84.99 -8.47 58.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.618 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 91.42 -57.01 3.13 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.711 -0.756 . . . . 10.0 111.808 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 69.88 -69.26 0.17 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.352 0.661 . . . . 10.0 111.795 179.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp 66.57 93.58 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.277 0 O-C-N 123.563 0.539 . . . . 10.0 110.858 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 614' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.29 101.94 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.96 2.44 . . . . 10.0 112.472 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 123.18 -18.81 7.81 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.036 -0.602 . . . . 10.0 111.86 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -98.55 136.96 37.9 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.123 -0.325 . . . . 10.0 110.123 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -80.45 104.9 11.3 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.331 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -61.8 -35.9 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.046 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 40.22 65.91 0.68 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.72 0.808 . . . . 10.0 112.942 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -117.77 108.97 42.02 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.44 -23.2 44.22 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 123.062 2.508 . . . . 10.0 114.447 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 65.6 p-90 -68.13 -18.93 64.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.749 -0.38 . . . . 10.0 111.433 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 87.5 t -64.5 -49.29 81.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.05 -33.68 75.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.616 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -69.14 -44.72 71.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.51 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -63.17 -43.57 97.87 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.591 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 89.8 mt -63.51 -44.78 98.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.559 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -61.32 -37.58 83.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.988 0.423 . . . . 10.0 110.677 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -66.13 -45.56 80.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.042 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -62.89 -45.71 91.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.638 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 631' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 635' ' ' GLU . 44.1 mt-30 -60.64 -48.63 80.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.778 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -60.92 -34.2 74.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.189 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -64.71 -42.57 95.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.998 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 634' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 637' ' ' ARG . 70.1 t -62.81 -42.39 96.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.025 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.602 ' HA ' ' ND2' ' A' ' 638' ' ' ASN . 4.5 mm-40 -68.26 -28.98 67.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.743 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 51.1 m -67.37 -28.47 67.98 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.461 0.648 . . . . 10.0 109.339 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 637' ' ' ARG . . . . . 0.506 ' HB3' ' O ' ' A' ' 634' ' ' VAL . 16.8 ttp180 -67.31 -38.18 84.55 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.137 -0.938 . . . . 10.0 109.64 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . 0.602 ' ND2' ' HA ' ' A' ' 635' ' ' GLU . 12.2 m-20 -60.26 -45.42 93.34 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.579 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -57.53 -46.02 84.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.125 -0.943 . . . . 10.0 111.533 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.51 -43.81 98.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.618 0.247 . . . . 10.0 110.801 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 73.9 mt -64.57 -46.81 91.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.372 -0.377 . . . . 10.0 110.275 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 642' ' ' ARG . . . . . 0.444 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 12.2 mtm-85 -61.1 -42.41 98.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.061 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -58.05 -44.13 87.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.602 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.42 -44.88 95.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.621 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 71.7 mt -66.54 -40.76 89.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.005 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 646' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' A' ' 650' ' ' ASP . 82.6 mt -61.68 -27.92 69.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.115 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -69.0 -20.69 64.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.96 0.41 . . . . 10.0 110.682 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -101.52 -39.7 7.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.658 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -67.19 -34.21 77.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.653 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 650' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 4.4 t0 -65.94 -26.93 67.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.91 0.386 . . . . 10.0 111.153 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 24.3 t -63.07 -44.47 99.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.158 0.504 . . . . 10.0 110.1 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -71.7 -29.13 64.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.701 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -66.91 -46.68 74.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.379 -0.828 . . . . 10.0 110.43 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -57.23 -48.71 78.14 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.516 0.51 . . . . 10.0 110.533 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 655' ' ' GLN . . . . . 0.453 HE22 ' HB2' ' A' ' 807' ' ' SER . 74.2 mt-30 -62.23 -42.53 99.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.792 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 9.8 ttp-105 -63.31 -42.58 99.03 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 120.974 0.416 . . . . 10.0 109.984 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 46.1 ttp180 -59.87 -47.09 87.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.769 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -66.37 -46.66 75.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.046 -179.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 659' ' ' ILE . . . . . 0.41 HD12 ' HA ' ' A' ' 659' ' ' ILE . 10.1 tp -69.07 -33.47 58.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 121.126 -0.23 . . . . 10.0 111.61 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -68.11 -31.42 71.0 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.182 -0.303 . . . . 10.0 110.182 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.3 m -67.55 -45.87 74.4 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.769 -0.456 . . . . 10.0 109.769 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -65.58 -44.84 85.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.442 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -61.27 -37.14 82.09 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.35 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -73.98 -35.94 64.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.203 -0.453 . . . . 10.0 111.19 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -63.5 -49.25 74.31 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.688 -0.486 . . . . 10.0 109.688 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 666' ' ' LEU . . . . . 0.451 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 88.1 mt -59.76 -28.98 67.86 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.169 0.509 . . . . 10.0 110.282 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.409 ' O ' ' HD3' ' A' ' 195' ' ' PRO . 0.9 OUTLIER -74.73 -46.56 36.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.507 -0.77 . . . . 10.0 110.594 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.68 -49.34 59.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.757 -0.656 . . . . 10.0 112.051 -178.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 9.8 m -73.28 150.94 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.065 0.459 . . . . 10.0 111.055 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 11.1 m -101.92 -36.8 8.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.238 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -79.96 90.18 5.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.866 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 672' ' ' VAL . . . . . 0.498 ' O ' HG12 ' A' ' 676' ' ' ILE . 9.6 p -92.87 -9.97 9.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.543 0.687 . . . . 10.0 109.477 178.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.63 -42.35 67.67 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 114.829 -1.078 . . . . 10.0 111.838 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -56.22 -51.44 68.07 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.341 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 675' ' ' THR . . . . . 0.487 ' O ' HG12 ' A' ' 679' ' ' ILE . 2.4 m -60.94 -45.81 93.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.084 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 676' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 672' ' ' VAL . 48.1 mm -55.13 -47.32 77.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.474 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -70.65 -39.72 73.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.586 -0.279 . . . . 10.0 111.436 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 50.0 m -60.99 -46.58 90.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.47 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 679' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 675' ' ' THR . 38.0 pt -76.24 -21.22 15.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.234 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 23.5 ttm-85 -60.01 -46.91 87.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.799 0.333 . . . . 10.0 110.77 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -62.28 -45.16 94.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.64 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -62.05 -52.01 65.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.592 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 683' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 679' ' ' ILE . 88.7 t -57.81 -45.36 87.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.236 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -63.79 -46.04 86.99 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.929 -0.308 . . . . 10.0 110.592 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -61.38 -47.68 84.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.667 -0.242 . . . . 10.0 110.704 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.25 -39.24 78.65 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.195 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 26.8 m -69.42 -39.09 78.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.428 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -67.97 -46.96 80.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.545 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 689' ' ' ASP . . . . . 0.498 ' HA ' ' O ' ' A' ' 692' ' ' ILE . 85.4 m-20 -59.81 -20.84 59.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.959 -178.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -69.46 -41.87 75.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.505 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -105.47 -14.62 15.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.947 0.403 . . . . 10.0 111.489 -179.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 692' ' ' ILE . . . . . 0.502 HG23 ' CD1' ' A' ' 701' ' ' TRP . 35.3 mt -132.67 97.66 17.12 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.678 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.12 130.76 37.83 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.333 2.022 . . . . 10.0 111.389 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 694' ' ' PRO . . . . . 0.46 ' HA ' ' NH2' ' A' ' 736' ' ' ARG . 12.1 Cg_endo -56.1 118.44 5.23 Favored 'Trans proline' 0 C--O 1.238 0.499 0 C-N-CA 122.614 2.209 . . . . 10.0 112.508 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 62.12 72.09 0.51 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.438 -0.801 . . . . 10.0 111.257 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 52.0 p -141.84 -167.38 2.43 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.994 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 78.8 mt -83.58 142.79 30.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.473 -0.331 . . . . 10.0 110.578 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . 0.505 ' HA ' ' CD2' ' A' ' 701' ' ' TRP . 24.5 tt0 -61.11 -26.32 67.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.212 0.53 . . . . 10.0 111.153 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -71.08 -16.39 62.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.905 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 14.6 mmt -97.35 6.3 48.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.657 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 701' ' ' TRP . . . . . 0.505 ' CD2' ' HA ' ' A' ' 698' ' ' GLU . 49.7 m0 -98.49 114.5 26.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.088 -178.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -86.15 77.74 9.52 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 703' ' ' ILE . . . . . 0.497 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 36.9 mm -53.52 -48.75 91.86 Favored Pre-proline 0 CA--C 1.537 0.459 0 CA-C-N 115.193 -0.912 . . . . 10.0 112.13 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 704' ' ' PRO . . . . . 0.497 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 47.6 Cg_exo -56.44 -37.4 97.26 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 121.805 1.67 . . . . 10.0 112.303 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -69.45 -40.26 79.35 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 121.246 -0.502 . . . . 10.0 112.344 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 37.8 tp -67.15 -44.59 79.43 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -63.65 -37.2 86.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.966 -0.561 . . . . 10.0 109.926 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.93 -48.49 75.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.516 -0.765 . . . . 10.0 110.611 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -74.77 -34.84 62.53 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.869 -0.605 . . . . 10.0 111.664 -178.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 51.3 mt -68.14 -50.77 52.51 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.729 0.27 . . . . 10.0 111.729 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -66.38 -31.84 72.86 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.028 0.381 . . . . 10.0 112.028 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -87.7 -71.19 0.58 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.748 0.647 . . . . 10.0 112.748 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.28 -58.53 6.83 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.214 0.82 . . . . 10.0 113.214 -176.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -79.06 -11.8 60.0 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.478 0.918 . . . . 10.0 113.478 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 2.2 t70 63.13 24.59 14.5 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.537 0.684 . . . . 10.0 110.051 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . 0.438 ' HG ' ' HG ' ' A' ' 718' ' ' LEU . 18.9 tp -104.71 98.74 8.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.34 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -82.99 97.16 8.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.124 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.438 ' HG ' ' HG ' ' A' ' 716' ' ' LEU . 80.3 mt -129.12 119.75 19.87 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.074 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 719' ' ' PRO . . . . . 0.425 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 92.2 Cg_endo -82.09 79.06 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.627 2.218 . . . . 10.0 111.399 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 720' ' ' ILE . . . . . 0.404 HG23 HD11 ' A' ' 735' ' ' LEU . 57.9 mt -60.96 -39.29 81.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.51 -179.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -66.04 -13.97 60.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.103 0.478 . . . . 10.0 111.162 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 722' ' ' GLU . . . . . 0.498 ' O ' ' HD2' ' A' ' 726' ' ' LYS . 4.4 tp10 -92.96 -10.4 36.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.701 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 45.2 m0 -96.97 -48.62 5.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.745 0.307 . . . . 10.0 111.643 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 63.2 mt -56.78 -22.63 37.4 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.269 0.84 . . . . 10.0 113.269 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.47 -19.75 21.69 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.794 0.294 . . . . 10.0 111.794 -179.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 726' ' ' LYS . . . . . 0.498 ' HD2' ' O ' ' A' ' 722' ' ' GLU . 36.3 mttp -99.93 -38.43 8.61 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.702 0.26 . . . . 10.0 111.702 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -128.74 86.41 57.62 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-O 121.162 0.506 . . . . 10.0 110.796 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -65.93 -13.27 39.08 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.925 2.417 . . . . 10.0 111.749 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 40.2 mp0 -66.02 -15.2 62.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.344 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 35.6 mt -71.74 -40.24 69.51 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 110.078 -0.341 . . . . 10.0 110.078 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 53.35 -88.27 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.053 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -144.31 -49.94 0.28 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.901 -0.32 . . . . 10.0 111.817 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -59.25 -58.89 6.66 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.781 0.325 . . . . 10.0 110.688 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.0 -26.35 68.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.554 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . 0.404 HD11 HG23 ' A' ' 720' ' ' ILE . 27.7 tp -65.57 -47.45 75.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.58 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 736' ' ' ARG . . . . . 0.46 ' NH2' ' HA ' ' A' ' 694' ' ' PRO . 73.8 mtt-85 -64.87 -44.9 88.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.266 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -57.08 -40.34 76.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.359 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 15.3 mmm-85 -61.25 -40.19 93.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.937 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 79.6 mt -64.99 -43.71 96.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.399 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 52.1 tp -71.02 -37.45 72.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.415 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -66.87 -40.89 87.99 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.984 0.421 . . . . 10.0 110.599 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 742' ' ' GLN . . . . . 0.414 ' O ' HG23 ' A' ' 746' ' ' VAL . 2.2 tp60 -66.67 -36.08 81.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.361 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.44 -41.57 88.96 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 82.1 mt -65.8 -35.87 76.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 178.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.19 -55.28 26.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.98 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 749' ' ' ARG . 88.1 t -58.24 -35.87 55.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.328 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -59.24 -51.01 71.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.304 179.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -64.5 -38.2 90.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.617 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 749' ' ' ARG . . . . . 0.415 ' HD3' ' HA ' ' A' ' 746' ' ' VAL . 77.2 mtp180 -61.07 -36.75 80.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.403 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -80.34 -36.93 33.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.589 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -60.32 -42.84 96.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.597 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -65.22 -12.63 53.36 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 84.3 t -79.58 -43.34 23.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.725 0.298 . . . . 10.0 111.326 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 15.1 m -99.54 -20.21 5.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 112.066 0.395 . . . . 10.0 112.066 -179.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 110.04 144.35 10.23 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.707 -0.759 . . . . 10.0 112.002 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 756' ' ' ALA . . . . . 0.44 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -60.16 -43.75 95.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.732 0.301 . . . . 10.0 110.899 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -58.99 -43.72 91.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.843 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.9 tpt -65.2 -44.25 88.96 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.383 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 50.9 mmm -63.02 -46.95 85.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.621 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -56.48 -39.73 73.72 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.916 0.389 . . . . 10.0 110.8 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -70.94 -40.8 71.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.142 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -63.69 -44.31 94.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.869 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -57.35 -45.47 84.31 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.028 0.442 . . . . 10.0 110.503 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 764' ' ' LYS . . . . . 0.451 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 72.4 tttt -62.17 -45.47 93.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.005 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -61.72 -44.18 98.26 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.833 -0.621 . . . . 10.0 112.309 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 65.3 t -63.47 -44.59 98.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.392 0.139 . . . . 10.0 110.906 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.69 -49.05 77.79 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.838 0.351 . . . . 10.0 110.583 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 73.3 mt -64.85 -39.93 94.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.15 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -58.89 -57.57 12.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.199 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 770' ' ' THR . . . . . 0.489 HG21 ' HB3' ' A' ' 821' ' ' GLU . 17.1 m -60.4 -41.05 93.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.369 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.45 -47.15 85.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.924 0.393 . . . . 10.0 109.991 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 772' ' ' ASP . . . . . 0.461 ' O ' ' HD3' ' A' ' 776' ' ' LYS . 9.9 t70 -64.82 -41.67 95.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.773 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 23.2 m -62.04 -45.03 95.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.129 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 35.8 mt -69.53 -32.34 71.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.737 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -63.1 -40.01 96.39 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 772' ' ' ASP . 14.4 mptt -63.2 -42.79 99.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.861 -0.608 . . . . 10.0 110.268 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 14.2 tm-20 -65.58 -49.5 68.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.712 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 778' ' ' HIS . . . . . 0.535 ' O ' ' HG2' ' A' ' 782' ' ' MET . 43.3 t60 -58.48 -34.23 70.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.339 -0.846 . . . . 10.0 111.276 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.5 mt -62.08 -42.12 98.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.882 0.372 . . . . 10.0 110.275 179.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -73.05 -41.45 64.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.447 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.18 -32.01 71.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.695 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 782' ' ' MET . . . . . 0.535 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 84.8 mmm -62.68 -35.2 78.89 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.08 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -63.25 -50.55 69.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.854 0.359 . . . . 10.0 110.086 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -62.13 -27.07 68.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.24 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 9.5 mt -75.21 -45.86 37.64 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.28 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -60.69 -51.96 67.15 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.628 -179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.235 0.333 0 CA-C-O 120.778 0.323 . . . . 10.0 110.375 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo . . . . . 0 CA--C 1.533 0.448 0 N-CA-C 112.869 0.296 . . . . 10.0 112.869 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 800' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 801' ' ' GLN . 34.3 mtmm -79.59 162.58 25.24 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 801' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 800' ' ' LYS . 8.4 mm100 72.62 -53.53 0.7 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.536 0.522 . . . . 10.0 110.803 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -59.92 -47.87 84.03 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -54.91 -35.51 64.23 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.738 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -69.3 -47.01 65.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.373 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -61.16 -41.35 96.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.538 -0.301 . . . . 10.0 111.026 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.82 -51.05 68.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.266 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 807' ' ' SER . . . . . 0.453 ' HB2' HE22 ' A' ' 655' ' ' GLN . 6.2 p -67.6 -38.71 84.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.395 -0.366 . . . . 10.0 111.742 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -63.34 -34.23 77.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.538 0.209 . . . . 10.0 110.814 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 57.9 m -62.53 -38.41 89.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.138 0.494 . . . . 10.0 110.19 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 46.8 ttm -71.95 -34.14 68.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.112 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -62.63 -41.28 98.92 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.539 -0.541 . . . . 10.0 109.539 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -66.21 -44.33 84.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.166 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -64.16 -32.09 73.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.5 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 28.7 ttp -63.18 -41.88 99.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.467 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 49.1 mt -68.06 -35.55 78.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.915 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -65.13 -45.3 85.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.059 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 7.3 m -71.75 -27.95 63.32 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.002 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 29.4 tp -54.76 -58.81 6.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.348 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 12.9 pttp -67.99 -26.35 65.87 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.348 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -61.17 -48.25 82.44 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.862 0.363 . . . . 10.0 110.364 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . 0.489 ' HB3' HG21 ' A' ' 770' ' ' THR . 0.8 OUTLIER -70.83 -46.69 62.3 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.332 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 54.1 t -51.08 -52.52 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.807 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 823' ' ' ILE . . . . . 0.444 HD11 HG13 ' A' ' 679' ' ' ILE . 27.8 mm -64.65 -43.79 96.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.591 -0.277 . . . . 10.0 111.427 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 30.9 m -62.88 -45.9 90.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.735 0.302 . . . . 10.0 110.859 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 95.1 m -61.61 -41.87 98.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.606 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 57.0 mt -71.96 -37.19 69.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.433 -0.348 . . . . 10.0 111.816 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 15.6 m -75.41 -32.83 60.87 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.81 0.338 . . . . 10.0 110.908 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -86.47 15.47 5.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.401 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.2 p -62.46 128.79 24.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -93.82 96.11 9.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.957 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 23.3 m . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.489 179.664 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.8 t80 . . . . . 0 C--O 1.234 0.268 0 N-CA-C 110.157 -0.312 . . . . 10.0 110.157 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 98.67 -151.2 19.5 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.869 -0.682 . . . . 10.0 111.617 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.96 175.33 10.14 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.585 0.231 . . . . 10.0 110.406 179.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.437 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 15.7 mmt85 -116.24 172.49 7.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.731 0.301 . . . . 10.0 111.286 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.6 t30 62.95 -90.1 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.391 -0.822 . . . . 10.0 111.36 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -59.39 -50.4 74.09 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.124 0.487 . . . . 10.0 111.4 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -68.15 -35.31 77.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.537 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.416 ' OG1' ' HA ' ' A' ' 13' ' ' ARG . 18.5 m -62.13 -46.63 88.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.814 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.2 mt -59.72 -40.73 88.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.879 0.371 . . . . 10.0 110.797 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.7 OUTLIER -65.28 -49.61 68.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.006 -179.801 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -63.4 -38.22 90.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.947 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.546 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -66.6 -42.11 87.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.711 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -58.39 -37.11 74.61 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.555 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -62.64 -37.35 86.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.355 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.3 t -75.48 -37.57 37.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.739 179.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.424 ' HA ' HD12 ' A' ' 28' ' ' ILE . 46.8 t -58.49 -36.59 59.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.927 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -59.42 -41.21 89.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.801 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.5 mt -65.2 -43.41 95.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.876 -0.602 . . . . 10.0 109.954 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.424 HD12 ' HA ' ' A' ' 25' ' ' VAL . 64.1 mt -61.94 -41.77 92.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.204 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -63.39 -36.1 82.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.733 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.37 -24.26 50.67 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.33 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 35.6 mtt -86.2 -16.51 37.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.45 -0.341 . . . . 10.0 111.382 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.486 ' OE1' ' HD2' ' A' ' 82' ' ' ARG . 3.9 tt0 -57.88 -53.56 64.52 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-O 119.485 -0.293 . . . . 10.0 111.537 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.455 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 31.2 Cg_exo -60.52 -25.89 81.62 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.647 1.565 . . . . 10.0 111.86 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -71.84 -45.35 61.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.243 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.2 mmt -66.06 -26.01 67.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.663 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -67.95 -15.2 63.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.004 -0.543 . . . . 10.0 110.994 179.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -93.07 -5.0 51.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.322 0.582 . . . . 10.0 110.038 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.7 mp -98.1 145.15 26.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.29 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.5 p -77.66 170.55 16.38 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.171 -0.468 . . . . 10.0 109.862 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.83 -43.5 90.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.149 0.5 . . . . 10.0 110.364 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -65.55 -30.53 71.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.652 -0.704 . . . . 10.0 111.043 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -70.05 -33.91 72.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.622 0.249 . . . . 10.0 110.409 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 73.3 mt -65.45 -42.24 92.58 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -64.81 -31.3 72.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.261 -0.881 . . . . 10.0 109.417 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.6 -34.47 89.11 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.412 -0.813 . . . . 10.0 112.144 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -65.3 -36.16 83.21 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.979 -0.378 . . . . 10.0 109.979 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.9 m -61.74 -43.67 98.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.269 0.557 . . . . 10.0 109.66 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.9 -30.29 68.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.774 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -68.2 -45.89 72.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.592 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -58.53 -42.84 88.68 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.178 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -60.51 -46.63 89.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.914 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.21 -32.72 73.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.352 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 43.4 mtp180 -68.24 -49.35 61.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.857 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 82.6 mt -61.05 -31.96 71.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.006 0.432 . . . . 10.0 110.535 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -62.22 -44.99 95.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.902 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -83.08 -48.99 9.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.07 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 163.53 111.48 0.26 Allowed Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.51 -0.636 . . . . 10.0 111.51 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -166.66 154.68 9.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 43.9 t -99.83 131.67 46.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 118' ' ' LEU . 14.8 tp -60.09 -42.72 95.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.193 0.521 . . . . 10.0 110.269 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.6 mp0 -65.4 -19.68 66.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.014 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -87.21 -18.58 29.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.356 0.598 . . . . 10.0 110.176 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.7 mt -83.06 -13.68 55.3 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.951 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 89.3 mt -48.69 -53.41 36.69 Favored Pre-proline 0 CA--C 1.542 0.652 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -178.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.1 Cg_exo -53.38 -47.34 27.93 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.021 1.814 . . . . 10.0 113.098 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.49 ' O ' HG23 ' A' ' 70' ' ' VAL . 42.0 mt-10 -74.9 -46.45 35.9 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.813 -178.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.47 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -58.83 -49.97 75.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.977 -178.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -62.18 -34.73 76.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.85 -179.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.8 -44.38 85.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.192 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 66' ' ' GLU . 95.7 t -62.44 -45.69 98.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.237 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 67' ' ' ALA . 59.1 t -61.8 -44.94 99.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.127 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.7 ttm180 -60.26 -42.87 96.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.116 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.411 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 30.1 tp10 -61.36 -48.67 80.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.379 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.97 73.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.911 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.7 m -62.08 -35.11 77.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.952 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 73' ' ' GLU . 24.5 mtmt -78.36 -18.2 55.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.527 -179.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -98.42 -45.9 5.97 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 111.782 0.29 . . . . 10.0 111.782 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 76.5 t -76.05 -54.92 12.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.687 0.28 . . . . 10.0 111.639 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -90.11 -43.05 10.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.714 0.292 . . . . 10.0 111.205 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.2 16.62 24.75 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.806 -0.711 . . . . 10.0 111.591 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.6 mtm -131.04 124.18 30.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.754 0.311 . . . . 10.0 110.191 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.486 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 9.5 ttp180 -71.07 133.35 46.21 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.875 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.95 117.5 7.09 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.422 ' HB2' ' HG3' ' A' ' 87' ' ' GLN . 33.1 m-85 -56.66 149.56 17.52 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.451 0.469 . . . . 10.0 111.278 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -61.71 -34.08 75.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.037 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.55 ' HA ' HD12 ' A' ' 89' ' ' LEU . 20.6 m -68.1 -29.96 46.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 10.0 110.79 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.458 HE22 HD23 ' A' ' 110' ' ' LEU . 96.3 mt-30 -70.64 -31.09 67.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.07 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 74.6 mt -64.29 -34.19 77.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.793 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.55 HD12 ' HA ' ' A' ' 86' ' ' VAL . 14.5 mt -66.85 -49.75 64.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.684 178.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -63.58 -46.25 92.72 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.629 -0.714 . . . . 10.0 112.501 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.29 -31.93 78.92 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.996 -0.621 . . . . 10.0 112.213 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . 0.546 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 14.9 ttm -72.6 -35.44 67.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.993 0.425 . . . . 10.0 110.44 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 89' ' ' LEU . 58.7 t -70.31 -36.33 66.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.127 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 93.8 mt -72.92 3.08 5.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.713 -0.676 . . . . 10.0 112.091 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -80.04 -30.08 39.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.336 0.589 . . . . 10.0 109.485 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -104.75 -167.22 1.32 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.409 -0.814 . . . . 10.0 111.051 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 -86.38 57.58 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.065 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 408' ' ' ASP . 31.4 m -127.9 147.79 50.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.957 -0.565 . . . . 10.0 112.05 -178.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.565 HD11 HD13 ' A' ' 407' ' ' LEU . 43.5 mm -100.16 123.85 53.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 108.745 -0.835 . . . . 10.0 108.745 177.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.69 134.45 51.96 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.05 0.452 . . . . 10.0 112.056 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 102' ' ' MET . 0.0 OUTLIER -97.21 158.72 15.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.61 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.449 ' SD ' ' HB2' ' A' ' 106' ' ' GLU . 49.2 ttm -171.69 134.97 0.84 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.836 -0.801 . . . . 10.0 108.836 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -62.06 151.6 34.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.239 0.542 . . . . 10.0 111.476 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.0 m -71.51 92.74 1.14 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.929 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 152.7 -28.85 0.84 Allowed Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.783 -0.722 . . . . 10.0 112.205 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.449 ' HB2' ' SD ' ' A' ' 102' ' ' MET . 5.5 mm-40 -66.96 -17.26 64.83 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.769 0.319 . . . . 10.0 111.135 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.28 67.21 0.64 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.744 -0.741 . . . . 10.0 112.429 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -61.07 -58.84 6.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.84 0.352 . . . . 10.0 111.049 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.1 -36.29 81.26 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.969 -179.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.458 HD23 HE22 ' A' ' 87' ' ' GLN . 31.6 tp -67.81 -27.2 66.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.271 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 95.7 m -80.19 -30.4 38.72 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.013 0.435 . . . . 10.0 111.252 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.554 ' HB1' HD21 ' A' ' 207' ' ' LEU . . . -67.29 -12.3 59.76 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.072 0.767 . . . . 10.0 113.072 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 31.8 p -75.63 -24.41 56.45 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.02 0.378 . . . . 10.0 112.02 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.406 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 52.4 mt -65.95 -56.23 18.29 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.098 0.407 . . . . 10.0 112.098 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 38.3 Cg_endo -65.06 -26.16 58.25 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.891 1.727 . . . . 10.0 111.881 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.28 -52.71 44.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.526 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.412 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 68.8 t80 -60.41 -43.9 96.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.082 0.467 . . . . 10.0 110.688 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.43 ' O ' HD11 ' A' ' 60' ' ' LEU . 34.7 tp -60.55 -51.07 71.0 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.638 -0.71 . . . . 10.0 112.009 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -73.31 -24.11 60.36 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.839 0.311 . . . . 10.0 111.839 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.457 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -67.12 -24.07 65.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.711 0.291 . . . . 10.0 110.975 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 71.6 mt -59.9 -26.46 65.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.609 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.0 p -66.48 -29.39 69.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.895 0.378 . . . . 10.0 111.171 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.96 14.14 67.78 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.782 -0.723 . . . . 10.0 112.602 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -93.06 -12.5 30.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.838 0.351 . . . . 10.0 111.165 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 88.85 119.49 1.67 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.783 -0.723 . . . . 10.0 113.012 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.1 t -80.41 115.54 23.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -86.16 92.0 8.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.004 0.43 . . . . 10.0 110.339 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 28.3 t -84.65 122.97 38.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.153 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 208' ' ' VAL . 87.1 t -109.7 122.47 64.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.363 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.22 148.16 39.45 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.831 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.599 ' HA ' HD11 ' A' ' 214' ' ' ILE . 4.1 m -54.17 -37.84 36.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 O-C-N 123.486 0.492 . . . . 10.0 112.029 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -141.44 168.53 19.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.561 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -75.17 -26.74 59.3 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.145 -0.48 . . . . 10.0 111.532 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -56.66 -52.88 63.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.892 0.377 . . . . 10.0 110.544 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 98.3 mt -70.76 -34.64 72.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.582 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.61 -52.6 64.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.687 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -67.81 -35.54 78.8 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.999 0.428 . . . . 10.0 110.339 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 138' ' ' ARG . 4.5 ttp180 -58.0 -59.03 5.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.061 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . 0.405 ' CG ' HH21 ' A' ' 138' ' ' ARG . 2.2 m-20 -70.86 -27.98 64.23 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.597 0.592 . . . . 10.0 112.597 -178.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -59.81 -44.28 94.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.861 0.362 . . . . 10.0 110.906 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -88.89 -25.44 22.13 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.429 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -71.86 -46.92 56.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.916 0.388 . . . . 10.0 111.241 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -89.36 0.34 56.89 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.438 -0.347 . . . . 10.0 111.046 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 58.3 ttm-85 -60.69 -49.67 88.66 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' PRO . . . . . 0.485 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 28.0 Cg_exo -62.96 -10.57 20.88 Favored 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 122.178 1.919 . . . . 10.0 112.888 -179.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.0 tp -92.66 -50.17 5.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.052 0.453 . . . . 10.0 110.288 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -71.79 -45.87 60.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.007 -0.542 . . . . 10.0 112.004 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.94 -24.75 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.982 0.42 . . . . 10.0 110.792 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -70.37 -33.15 71.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.764 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 60.1 mt -84.29 -14.91 48.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.811 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 109.94 16.97 10.01 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.798 -0.715 . . . . 10.0 112.951 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 37.2 mt -102.58 134.08 46.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.795 0.331 . . . . 10.0 110.435 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.03 126.69 34.34 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.567 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 46.9 t -106.06 128.63 60.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.908 0.385 . . . . 10.0 110.828 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -124.13 146.99 16.49 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.075 -0.583 . . . . 10.0 111.773 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.6 tp -118.56 125.8 74.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.062 0.458 . . . . 10.0 110.44 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -101.68 113.38 26.49 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.054 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 36.0 mt -100.37 141.71 23.23 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.742 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' PRO . . . . . 0.462 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 24.0 Cg_endo -61.07 107.21 0.44 Allowed 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.962 2.441 . . . . 10.0 112.854 -179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.69 16.3 46.17 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.021 -0.609 . . . . 10.0 113.372 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 12.4 ptm -77.64 159.58 76.54 Favored Pre-proline 0 CA--C 1.535 0.393 0 CA-C-N 117.26 0.53 . . . . 10.0 109.9 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -52.06 143.52 40.74 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.062 2.508 . . . . 10.0 113.291 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . 0.483 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -57.89 -49.11 95.53 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.794 -0.639 . . . . 10.0 112.422 -179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 41.9 Cg_exo -58.69 -36.31 97.36 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.599 1.533 . . . . 10.0 112.046 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.02 -39.25 90.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.513 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.411 ' HZ2' ' CG ' ' A' ' 185' ' ' ASP . 57.5 mttm -60.95 -43.58 98.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.155 179.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -59.8 -39.37 84.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.667 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -68.16 -39.32 82.63 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.988 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -73.08 -38.87 66.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.011 -0.541 . . . . 10.0 111.501 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -75.54 -26.29 57.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.686 0.279 . . . . 10.0 111.564 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' ALA . . . . . 0.403 ' HA ' ' NE ' ' A' ' 201' ' ' ARG . . . -80.34 1.48 28.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.048 0.452 . . . . 10.0 110.756 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -81.61 176.32 9.75 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.802 -0.636 . . . . 10.0 109.722 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' ASP . . . . . 0.457 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 16.0 m-20 -78.24 -33.42 49.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.881 0.372 . . . . 10.0 110.522 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 88.0 mt -136.79 122.16 26.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.121 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.1 m -115.51 122.73 46.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.833 0.349 . . . . 10.0 111.194 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -97.95 136.2 38.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.898 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.81 170.32 43.08 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.441 -0.885 . . . . 10.0 112.817 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.5 m -88.48 151.12 22.75 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 122.43 0.292 . . . . 10.0 110.679 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -57.62 -42.31 83.09 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 -179.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -58.21 -54.26 48.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.615 -0.266 . . . . 10.0 111.421 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' GLU . . . . . 0.462 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.4 tp10 -65.27 -37.67 87.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.091 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.81 -39.24 80.56 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.897 0.379 . . . . 10.0 110.701 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -76.13 -42.64 23.57 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.85 -0.69 . . . . 10.0 111.596 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -37.97 86.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.89 0.376 . . . . 10.0 110.429 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 185' ' ' ASP . . . . . 0.411 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 8.3 m-20 -59.5 -44.06 93.21 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.429 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.64 -38.78 91.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.47 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 187' ' ' LEU . . . . . 0.462 HD11 HG22 ' A' ' 375' ' ' ILE . 47.5 mt -64.58 -46.62 81.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.819 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 28.3 mtm180 -69.68 -35.86 75.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.124 0.488 . . . . 10.0 110.545 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.03 -50.65 71.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.483 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.3 -0.9 30.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.732 -0.667 . . . . 10.0 112.438 -178.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 25.7 ttp -105.39 10.77 33.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.193 0.521 . . . . 10.0 110.403 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 192' ' ' ALA . . . . . 0.441 ' HB1' ' HB2' ' A' ' 197' ' ' GLU . . . -78.05 166.07 23.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.254 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -103.83 -26.24 12.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.078 0.466 . . . . 10.0 110.227 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -118.05 138.52 25.56 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.49 -23.94 76.59 Favored 'Trans proline' 0 CA--C 1.53 0.284 0 C-N-CA 122.614 2.209 . . . . 10.0 112.534 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 37.8 mp0 -78.44 -13.01 60.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.464 -0.334 . . . . 10.0 111.079 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 197' ' ' GLU . . . . . 0.441 ' HB2' ' HB1' ' A' ' 192' ' ' ALA . 67.6 mt-10 -82.39 -4.99 58.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.549 -0.296 . . . . 10.0 110.902 -179.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 198' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' A' ' 198' ' ' ARG . 45.6 mtt85 -62.68 157.78 20.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.284 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 12.2 m -133.29 -14.63 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.057 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -91.79 163.79 13.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.179 0.514 . . . . 10.0 111.558 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 201' ' ' ARG . . . . . 0.403 ' NE ' ' HA ' ' A' ' 171' ' ' ALA . 4.6 mtm180 -122.76 174.86 6.86 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.679 -0.86 . . . . 10.0 108.679 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -55.23 124.67 17.74 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.122 0.487 . . . . 10.0 111.182 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 10.4 mt -79.82 72.32 6.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.307 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 9.7 t-160 -88.49 -53.57 4.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.733 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -128.78 138.68 52.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.916 0.388 . . . . 10.0 111.789 -178.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 206' ' ' ALA . . . . . 0.575 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -129.97 135.84 48.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.552 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 207' ' ' LEU . . . . . 0.554 HD21 ' HB1' ' A' ' 112' ' ' ALA . 35.7 tp -131.69 109.92 10.52 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.354 -179.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 208' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 2.9 p -104.97 140.55 22.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.67 0.272 . . . . 10.0 110.98 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.34 -40.59 70.6 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 210' ' ' GLU . . . . . 0.425 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 7.5 tt0 -135.27 113.72 11.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.036 0.446 . . . . 10.0 111.029 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 211' ' ' VAL . . . . . 0.495 HG11 HD12 ' A' ' 99' ' ' ILE . 34.2 m -84.54 -14.88 11.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.111 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 212' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 0.9 OUTLIER -55.53 -71.13 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.729 -179.18 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.1 m -76.13 -38.09 57.23 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.473 0.546 . . . . 10.0 112.473 -178.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 214' ' ' ILE . . . . . 0.599 HD11 ' HA ' ' A' ' 131' ' ' VAL . 45.5 mt -71.55 -43.54 71.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 113.993 1.108 . . . . 10.0 113.993 -177.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 215' ' ' LEU . . . . . 0.407 HD22 ' CE2' ' A' ' 405' ' ' TYR . 17.0 mt -93.74 -50.68 5.26 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.929 0.714 . . . . 10.0 112.929 -177.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 216' ' ' ILE . . . . . 0.421 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 48.6 mm -73.14 -56.68 8.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -70.97 -39.49 72.48 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 218' ' ' GLU . . . . . 0.51 ' HB2' ' O ' ' A' ' 214' ' ' ILE . 6.0 mm-40 -91.61 19.27 6.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.89 -51.4 69.44 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 220' ' ' ARG . . . . . 0.433 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -96.85 32.36 2.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.96 0.409 . . . . 10.0 111.392 -178.571 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 17.4 m -101.86 105.02 39.24 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-O 120.92 0.39 . . . . 10.0 110.197 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 222' ' ' PRO . . . . . 0.433 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 73.1 Cg_endo -91.33 132.25 1.44 Allowed 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.939 2.426 . . . . 10.0 112.778 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 223' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 374' ' ' SER . 69.2 mt -78.22 105.65 9.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.156 -0.474 . . . . 10.0 109.768 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 59.0 mt -86.49 122.88 39.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.775 -0.648 . . . . 10.0 112.18 -178.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 59.8 mt . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.273 178.223 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.394 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 374' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 58.1 m -156.01 146.13 21.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.009 0.433 . . . . 10.0 111.478 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 375' ' ' ILE . . . . . 0.462 HG22 HD11 ' A' ' 187' ' ' LEU . 16.5 tt -145.96 141.0 21.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.752 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.63 145.43 25.68 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.318 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -56.8 -41.14 77.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.774 0.321 . . . . 10.0 110.314 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 378' ' ' GLN . . . . . 0.518 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.4 tm0? -55.96 -41.9 75.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.902 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -78.06 -30.66 49.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.054 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -68.1 -49.05 63.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.989 0.423 . . . . 10.0 110.304 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -72.78 -17.31 61.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.758 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.63 -25.27 63.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.348 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 73.9 mt -78.92 -12.87 60.05 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.806 -0.633 . . . . 10.0 111.753 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 384' ' ' TYR . . . . . 0.575 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 30.1 m-85 -80.81 138.75 36.25 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.799 0.333 . . . . 10.0 110.875 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -72.95 -73.48 0.2 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.186 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -91.41 90.55 7.73 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.47 HD23 HD21 ' A' ' 407' ' ' LEU . 66.2 tp -99.46 106.34 18.37 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.58 -0.737 . . . . 10.0 109.705 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -122.74 161.44 23.92 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.801 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -179.3 172.64 44.66 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.136 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 65.2 mtm -112.71 152.46 29.04 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.951 0.405 . . . . 10.0 110.576 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 9.6 t -122.04 -176.69 3.4 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.076 -0.713 . . . . 10.0 109.076 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -106.43 165.18 13.53 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.623 -0.799 . . . . 10.0 111.584 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 4.7 m -71.08 74.52 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.399 0.618 . . . . 10.0 109.99 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 394' ' ' ALA . . . . . 0.468 ' HB1' ' HA ' ' A' ' 566' ' ' ARG . . . -131.39 -48.72 0.99 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.992 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 395' ' ' ASP . . . . . 0.461 ' CG ' ' H ' ' A' ' 396' ' ' THR . 21.0 t70 66.38 -140.54 0.16 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 -178.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 396' ' ' THR . . . . . 0.461 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 4.8 m 70.0 -77.72 0.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 122.777 0.431 . . . . 10.0 111.652 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -81.72 15.15 2.28 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.2 0.524 . . . . 10.0 111.191 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 398' ' ' ALA . . . . . 0.448 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -66.99 -23.43 65.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.714 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -75.74 -10.92 59.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.906 0.384 . . . . 10.0 111.091 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 400' ' ' GLU . . . . . 0.445 ' HG2' ' CD1' ' A' ' 639' ' ' PHE . 43.0 mt-10 -89.27 -14.27 36.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.506 -0.316 . . . . 10.0 111.085 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 401' ' ' PHE . . . . . 0.448 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 18.7 m-85 -60.9 -51.7 68.17 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.961 0.41 . . . . 10.0 110.553 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 402' ' ' SER . . . . . 0.411 ' O ' ' HA ' ' A' ' 406' ' ' LYS . 0.7 OUTLIER -75.62 -21.0 58.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.418 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 29.1 m -81.84 -47.17 13.16 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.5 mt -88.68 -60.2 2.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 112.709 0.633 . . . . 10.0 112.709 -177.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 405' ' ' TYR . . . . . 0.518 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 68.8 m-85 -90.98 -4.78 56.18 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.635 0.606 . . . . 10.0 112.635 -177.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 406' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 402' ' ' SER . 67.4 mmtt 59.82 53.6 4.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.072 0.463 . . . . 10.0 110.205 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 407' ' ' LEU . . . . . 0.565 HD13 HD11 ' A' ' 99' ' ' ILE . 34.9 mt -111.47 144.17 41.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.257 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 408' ' ' ASP . . . . . 0.571 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . 36.8 t0 -78.87 167.95 20.42 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.884 -0.784 . . . . 10.0 108.884 178.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 19.6 m -138.72 121.82 16.84 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 121.963 -0.46 . . . . 10.0 112.123 -178.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 85.7 t -132.39 131.31 60.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.934 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.2 t -94.11 119.62 42.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.222 -0.288 . . . . 10.0 110.222 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 41.1 t -93.56 132.66 29.61 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 116.405 -0.362 . . . . 10.0 110.587 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -67.96 159.25 53.78 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.763 2.309 . . . . 10.0 112.548 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 15.2 p -82.84 166.5 18.92 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.914 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -63.11 -37.23 86.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.421 0.629 . . . . 10.0 109.685 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 416' ' ' ARG . . . . . 0.404 ' HB2' ' HA3' ' A' ' 579' ' ' GLY . 26.4 mtm180 -136.86 147.88 60.93 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.913 178.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.52 135.6 50.27 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 122.297 1.998 . . . . 10.0 111.942 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 56.8 mtm -71.86 138.65 48.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.869 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.3 mt -104.17 10.74 8.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.61 0.719 . . . . 10.0 109.431 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 15.7 ttp-105 -66.62 124.99 24.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.095 -0.957 . . . . 10.0 110.928 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.543 ' O ' ' HA ' ' A' ' 583' ' ' SER . 89.4 mttt -105.89 136.25 45.87 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -104.82 148.98 26.05 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.864 0.364 . . . . 10.0 111.014 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 423' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 424' ' ' PRO . 72.5 mt -125.25 148.04 59.44 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.941 179.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 424' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 423' ' ' LEU . 39.4 Cg_exo -61.47 164.31 15.75 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.914 2.409 . . . . 10.0 113.986 -178.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -84.24 116.96 23.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.018 -0.992 . . . . 10.0 109.608 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 59.0 mt -96.22 102.72 14.55 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.3 0.571 . . . . 10.0 110.256 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 427' ' ' VAL . . . . . 0.483 HG22 ' HB2' ' A' ' 588' ' ' LEU . 42.9 t -93.19 129.44 43.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.199 -0.909 . . . . 10.0 110.772 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 428' ' ' TYR . . . . . 0.469 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 79.3 m-85 -112.39 -178.6 3.45 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.078 179.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 429' ' ' MET . . . . . 0.572 ' HB2' ' OE2' ' A' ' 433' ' ' GLU . 20.1 mmt -74.21 -76.7 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.879 0.371 . . . . 10.0 111.112 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 59.4 p -89.72 160.45 16.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.162 -0.472 . . . . 10.0 111.052 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 431' ' ' GLU . . . . . 0.451 ' OE1' ' HD3' ' A' ' 434' ' ' LYS . 9.5 tp10 -60.85 -27.26 67.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.717 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -59.47 -48.47 81.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.895 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 433' ' ' GLU . . . . . 0.572 ' OE2' ' HB2' ' A' ' 429' ' ' MET . 14.3 mt-10 -62.68 -39.17 93.12 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.079 0.466 . . . . 10.0 110.29 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 434' ' ' LYS . . . . . 0.513 ' O ' HG13 ' A' ' 438' ' ' ILE . 63.9 tttt -60.67 -51.45 69.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.311 -0.859 . . . . 10.0 110.798 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 435' ' ' ILE . . . . . 0.497 ' O ' HG12 ' A' ' 439' ' ' ILE . 49.4 mm -66.4 -42.79 91.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.982 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -60.3 -37.39 80.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.78 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.99 -37.4 85.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.444 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 438' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 434' ' ' LYS . 76.8 mt -62.95 -42.95 98.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.922 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 439' ' ' ILE . . . . . 0.497 HG12 ' O ' ' A' ' 435' ' ' ILE . 41.6 mm -56.89 -42.36 78.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.674 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -64.54 -47.28 79.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.165 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -59.89 -39.09 84.16 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.079 0.466 . . . . 10.0 110.411 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.504 HG12 HG11 ' A' ' 452' ' ' VAL . 78.7 mt -71.38 -45.74 67.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.547 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -50.03 -49.68 50.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.836 -0.62 . . . . 10.0 111.468 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -58.93 -44.04 91.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.672 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.44 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 38.3 mtt-85 -75.17 -22.0 58.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.316 -178.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 29.7 m -68.34 -36.62 79.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.128 0.49 . . . . 10.0 110.163 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.9 -25.55 30.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.999 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 34.8 mttp -79.14 -31.36 44.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.209 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 101.57 35.64 4.03 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.429 -0.891 . . . . 10.0 112.698 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 450' ' ' GLN . . . . . 0.646 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 59.7 tt0 -112.8 125.6 29.63 Favored Pre-proline 0 C--N 1.323 -0.561 0 O-C-N 122.673 -0.31 . . . . 10.0 110.825 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -65.36 136.88 48.93 Favored 'Trans proline' 0 C--O 1.237 0.447 0 C-N-CA 122.497 2.131 . . . . 10.0 111.153 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 452' ' ' VAL . . . . . 0.504 HG11 HG12 ' A' ' 442' ' ' ILE . 60.9 t -123.04 122.96 66.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.505 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 45.7 tp -109.7 112.22 24.15 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 41.5 t -96.06 121.31 46.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.13 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -103.93 105.01 2.55 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.713 -0.756 . . . . 10.0 112.175 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 17.2 p -103.02 139.51 38.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.754 0.312 . . . . 10.0 110.529 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' ILE . . . . . 0.444 HG12 ' HB2' ' A' ' 560' ' ' GLU . 7.5 pt -100.88 3.89 10.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.378 0.609 . . . . 10.0 110.051 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 3.5 p -133.82 128.8 35.48 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.978 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 28.8 mt -62.12 -36.7 75.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.025 0.44 . . . . 10.0 110.587 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.417 ' H ' ' CD ' ' A' ' 460' ' ' GLU . 1.6 mp0 -57.95 -41.59 83.17 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.582 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -36.74 77.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.844 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 3.8 m -58.98 -46.07 89.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.951 0.405 . . . . 10.0 110.402 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -71.86 -32.32 67.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.66 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 61.4 tp -68.43 -54.88 14.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.616 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.9 p -63.48 -30.16 49.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.904 0.383 . . . . 10.0 110.336 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 10.5 t -64.5 -43.91 92.6 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -65.45 -42.43 92.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.33 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -63.28 -43.51 97.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.619 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 47.0 mt -62.88 -42.03 99.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.246 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 35.3 m -64.41 -34.89 79.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.045 0.45 . . . . 10.0 110.017 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -63.29 -39.8 95.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.049 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.09 -4.88 56.75 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.295 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 75.88 26.78 63.92 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.025 -0.607 . . . . 10.0 112.378 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 71.3 mt -94.35 116.13 34.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.916 0.388 . . . . 10.0 110.803 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -64.2 131.67 48.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.202 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -155.93 157.89 37.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.992 -178.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -121.41 134.54 55.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.933 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 11.0 t -110.6 132.63 58.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.681 0.277 . . . . 10.0 110.809 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.09 164.66 22.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.529 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -157.1 117.9 3.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.144 -0.48 . . . . 10.0 109.834 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -59.57 -21.31 60.13 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.911 -0.586 . . . . 10.0 112.27 -179.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -76.38 -19.78 57.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.684 0.278 . . . . 10.0 111.113 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -127.18 64.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.473 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -59.59 -30.4 68.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.232 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.55 -28.89 69.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.583 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -84.56 -33.9 23.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.02 0.438 . . . . 10.0 109.898 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -58.37 -36.91 74.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.723 -0.672 . . . . 10.0 110.966 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -53.62 -35.6 61.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 10.0 111.974 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -83.01 -35.16 26.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.917 0.389 . . . . 10.0 110.675 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 75.8 mt -66.86 -54.0 29.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.297 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 49.4 t -61.54 -30.67 48.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.16 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -60.69 -29.96 69.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.607 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 71.4 mm-40 -114.27 21.38 14.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.773 0.321 . . . . 10.0 110.942 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.68 -17.63 62.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.028 0.442 . . . . 10.0 111.069 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -101.27 15.27 57.82 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.046 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -79.33 142.09 58.18 Favored Pre-proline 0 C--N 1.324 -0.542 0 N-CA-C 110.075 -0.342 . . . . 10.0 110.075 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.93 123.3 12.14 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.539 2.16 . . . . 10.0 112.789 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 71.5 16.68 5.88 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.615 -0.721 . . . . 10.0 112.751 178.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.74 110.23 21.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.984 0.421 . . . . 10.0 110.605 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 20.4 t -92.74 114.44 29.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.983 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 2.0 m -115.95 134.3 55.12 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.02 -179.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 62.7 mt -110.61 120.75 62.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 120.85 0.357 . . . . 10.0 110.069 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -111.29 124.25 51.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.605 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 14.5 m -103.56 119.65 39.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.54 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 14.1 m120 54.98 48.14 20.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.619 -0.718 . . . . 10.0 111.956 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 49.2 ttm -74.72 121.2 21.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.099 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -69.66 -174.16 0.69 Allowed 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.608 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -73.89 -178.13 37.2 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.065 -0.588 . . . . 10.0 112.587 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.425 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 52.6 mtt180 63.98 -95.52 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.83 0.452 . . . . 10.0 110.504 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 81.21 167.04 37.4 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.929 -0.653 . . . . 10.0 113.096 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.59 167.81 21.2 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.618 0.247 . . . . 10.0 111.087 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -85.53 106.76 17.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.747 0.308 . . . . 10.0 110.339 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 65.9 mt -80.62 108.95 14.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.257 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 19.6 t -88.12 127.78 40.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.638 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 50.3 mt -71.6 132.3 44.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.162 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 90.72 11.52 61.9 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.743 -0.741 . . . . 10.0 111.751 -179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 94.68 179.45 37.7 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.891 -0.671 . . . . 10.0 111.774 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 2.6 p -117.45 96.0 5.21 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.805 0.336 . . . . 10.0 110.976 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 18.0 p-90 -59.84 -25.81 65.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.795 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -66.72 -34.26 77.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.656 -0.702 . . . . 10.0 110.48 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.34 -31.15 38.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.262 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.14 -46.08 75.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.686 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.0 m -69.02 -27.2 34.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.846 0.355 . . . . 10.0 110.754 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -78.84 -9.11 59.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.982 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -93.56 -7.54 43.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.144 0.497 . . . . 10.0 110.483 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 60.3 mt -99.01 134.65 41.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.936 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -65.63 -49.7 67.74 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.191 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -126.63 88.55 54.14 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.703 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -83.29 112.99 2.01 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.972 2.448 . . . . 10.0 111.591 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 530' ' ' THR . . . . . 0.547 ' H ' ' NE2' ' A' ' 533' ' ' GLN . 16.7 p -87.82 176.52 7.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.581 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -58.96 -44.93 91.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.947 0.403 . . . . 10.0 111.054 -179.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.485 ' OE1' ' HB ' ' A' ' 530' ' ' THR . 1.2 mp0 -63.61 -36.23 83.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.651 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . 0.547 ' NE2' ' H ' ' A' ' 530' ' ' THR . 31.9 mt-30 -65.97 -49.87 66.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.953 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 74.2 mt -60.33 -45.32 96.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.605 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -64.54 -44.13 91.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.795 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -60.43 -50.02 75.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.691 -0.231 . . . . 10.0 110.811 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 85.0 mt -62.64 -45.07 99.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.607 -0.27 . . . . 10.0 110.67 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 5.5 ttmt -60.75 -45.16 95.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.887 0.375 . . . . 10.0 110.782 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.18 95.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.259 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 540' ' ' ASP . . . . . 0.59 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 0.1 OUTLIER -67.64 -40.43 84.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.389 -0.368 . . . . 10.0 110.057 179.617 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 44.3 t90 -59.8 -42.15 92.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.142 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -53.37 -44.0 68.23 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.79 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 59.6 t -65.47 -47.61 86.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.739 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 544' ' ' ARG . . . . . 0.59 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 13.4 mtm180 -63.72 -33.27 75.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.346 0.593 . . . . 10.0 110.272 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -65.52 -50.59 64.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.186 -0.915 . . . . 10.0 111.063 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.79 -26.81 64.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.298 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.2 -39.45 92.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.189 0.519 . . . . 10.0 109.88 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 86.2 t -65.85 -37.34 79.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.994 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 98.5 mt -66.09 -32.74 74.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.202 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -69.97 -38.98 76.22 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.275 179.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 551' ' ' ALA . . . . . 0.646 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -69.0 -44.24 73.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.125 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 145.26 18.56 0.17 Allowed Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.075 -1.06 . . . . 10.0 113.684 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 77.54 -169.75 54.85 Favored Glycine 0 C--N 1.328 0.13 0 C-N-CA 120.668 -0.777 . . . . 10.0 112.352 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 63.8 tp -72.2 125.53 27.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.0 0.428 . . . . 10.0 110.409 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -94.31 123.62 37.83 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.786 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 40.8 mm -105.43 128.19 59.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.343 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 557' ' ' ILE . . . . . 0.408 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.2 mt -120.77 123.2 69.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 120.989 0.423 . . . . 10.0 110.49 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.53 122.08 7.05 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 111.321 -0.712 . . . . 10.0 111.321 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 18.3 p -82.51 -56.27 3.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.143 0.497 . . . . 10.0 111.113 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 560' ' ' GLU . . . . . 0.444 ' HB2' HG12 ' A' ' 457' ' ' ILE . 14.4 mp0 -110.73 141.46 44.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.617 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 561' ' ' ARG . . . . . 0.484 ' HG2' HD21 ' A' ' 588' ' ' LEU . 15.1 mmt180 -87.13 123.49 32.24 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.149 -0.685 . . . . 10.0 109.149 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -67.19 143.72 56.4 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.704 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -57.15 -66.12 0.51 Allowed 'General case' 0 N--CA 1.462 0.154 0 O-C-N 123.431 0.457 . . . . 10.0 109.99 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.58 121.62 20.01 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 565' ' ' ARG . . . . . 0.442 ' HB2' ' HB3' ' A' ' 631' ' ' GLN . 16.9 tpt180 -60.5 -21.2 62.16 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 123.457 0.473 . . . . 10.0 111.659 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 566' ' ' ARG . . . . . 0.468 ' HA ' ' HB1' ' A' ' 394' ' ' ALA . 11.2 ttm180 -55.43 -61.4 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.962 0.41 . . . . 10.0 110.749 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 30.0 mt -71.31 -24.51 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.032 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 568' ' ' ASP . . . . . 0.426 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 4.8 t70 -63.08 -49.34 74.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.485 0.659 . . . . 10.0 109.523 178.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 569' ' ' ASN . . . . . 0.439 ' HB3' ' HA ' ' A' ' 394' ' ' ALA . 50.2 t30 -67.58 -38.55 84.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.954 -1.021 . . . . 10.0 110.676 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 570' ' ' GLN . . . . . 0.452 ' HG3' ' HB2' ' A' ' 394' ' ' ALA . 94.3 mt-30 -67.12 -30.95 71.1 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.799 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.532 HD12 HH21 ' A' ' 574' ' ' ARG . 44.4 tp -66.82 -32.78 74.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.988 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -85.64 -33.77 21.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.485 -0.78 . . . . 10.0 110.995 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.63 54.81 2.49 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 121.235 -0.507 . . . . 10.0 113.902 -179.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 574' ' ' ARG . . . . . 0.532 HH21 HD12 ' A' ' 571' ' ' LEU . 29.9 mmt180 -92.15 -51.46 5.17 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.46 -167.87 2.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.173 179.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 73.92 39.11 47.58 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.475 -0.869 . . . . 10.0 112.238 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 577' ' ' ARG . . . . . 0.549 ' H ' ' HB3' ' A' ' 580' ' ' ASP . 51.3 mtt180 -97.58 122.45 40.65 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 58.73 41.17 22.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.015 0.436 . . . . 10.0 111.793 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 579' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 416' ' ' ARG . . . 82.16 32.33 29.14 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 121.039 -0.601 . . . . 10.0 113.096 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 580' ' ' ASP . . . . . 0.549 ' HB3' ' H ' ' A' ' 577' ' ' ARG . 6.1 t70 -81.11 163.65 22.98 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -89.47 -139.49 0.13 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.905 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 120.65 167.41 13.36 Favored Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 120.666 -0.778 . . . . 10.0 112.326 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 583' ' ' SER . . . . . 0.543 ' HA ' ' O ' ' A' ' 421' ' ' LYS . 1.3 p -149.19 122.27 8.86 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.442 0.163 . . . . 10.0 110.619 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.49 125.81 39.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.721 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 585' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 4.3 tpm_? -132.99 124.83 28.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.539 -0.3 . . . . 10.0 110.192 179.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -116.43 140.01 49.82 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.9 0.381 . . . . 10.0 111.114 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -132.18 122.97 26.12 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.104 -0.702 . . . . 10.0 109.104 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 588' ' ' LEU . . . . . 0.484 HD21 ' HG2' ' A' ' 561' ' ' ARG . 5.3 mt -130.39 179.25 6.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.829 0.347 . . . . 10.0 111.286 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 38.8 p -142.55 178.6 7.5 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.803 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 74.7 mmm -85.31 -4.32 59.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.09 0.471 . . . . 10.0 110.271 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -105.33 0.58 27.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.507 -0.769 . . . . 10.0 109.9 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.57 154.86 41.08 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.76 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -69.59 -24.71 63.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.256 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 594' ' ' LEU . . . . . 0.62 ' O ' HG12 ' A' ' 597' ' ' ILE . 10.1 tp -59.42 -34.23 72.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.295 -0.411 . . . . 10.0 111.342 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 14.8 mmt -64.38 -16.72 62.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.764 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -82.73 -10.66 58.79 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 597' ' ' ILE . . . . . 0.62 HG12 ' O ' ' A' ' 594' ' ' LEU . 17.2 pt -82.15 -8.85 11.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.225 -0.59 . . . . 10.0 110.201 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -84.39 -13.9 50.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.26 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.85 -68.36 0.16 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.419 -0.81 . . . . 10.0 111.954 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 28.1 m -71.52 115.78 11.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.35 -0.386 . . . . 10.0 111.233 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -68.45 -19.71 64.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.138 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -38.4 79.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.188 179.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.7 t -63.08 -51.84 66.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.011 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 604' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 1.2 m -63.08 -34.5 77.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.446 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -63.21 -39.14 97.56 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.138 -0.553 . . . . 10.0 111.756 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 14.1 tpt -70.02 -29.04 66.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.134 0.492 . . . . 10.0 110.267 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 63.0 mtt -70.66 -21.47 62.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.784 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 608' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 604' ' ' SER . 48.9 mtt180 -73.1 -6.46 45.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.101 0.477 . . . . 10.0 110.409 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -79.97 -4.07 50.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.501 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 31.3 tp -65.75 -39.31 90.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.109 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 109.73 -40.77 2.43 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.916 -0.659 . . . . 10.0 111.458 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 612' ' ' MET . . . . . 0.463 ' CG ' ' HA ' ' A' ' 428' ' ' TYR . 1.7 mpt? 60.63 -106.47 0.26 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.028 0.531 . . . . 10.0 111.677 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.94 109.88 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.326 0 O-C-N 123.666 0.603 . . . . 10.0 111.283 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 614' ' ' PRO . . . . . 0.469 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 37.8 Cg_endo -66.3 85.5 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.61 2.207 . . . . 10.0 112.491 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 162.44 -44.2 0.36 Allowed Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.902 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.43 54.71 3.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.118 0.485 . . . . 10.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -81.47 84.89 6.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.578 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 14.9 tt -86.56 1.87 5.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.936 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 71.75 141.47 0.05 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.435 0.694 . . . . 10.0 111.462 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -147.36 92.89 4.76 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.122 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -61.49 -28.33 83.34 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 123.407 2.738 . . . . 10.0 114.115 -178.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 37.8 p-90 -61.0 -25.3 66.79 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 111.852 0.316 . . . . 10.0 111.852 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.94 -50.12 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.725 0.298 . . . . 10.0 110.232 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 68.0 m -59.6 -38.5 81.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.859 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -63.84 -39.54 94.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.862 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -69.57 -43.61 72.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.175 179.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.13 -44.02 99.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.585 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -61.28 -40.4 94.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.596 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -66.21 -45.04 82.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.199 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 630' ' ' ALA . . . . . 0.456 ' O ' HG23 ' A' ' 634' ' ' VAL . . . -61.67 -46.64 88.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.993 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 631' ' ' GLN . . . . . 0.442 ' HB3' ' HB2' ' A' ' 565' ' ' ARG . 56.5 mt-30 -58.83 -43.15 90.63 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.961 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 51.2 mtp85 -71.08 -33.85 70.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.279 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -63.29 -38.79 92.52 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.007 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 634' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 630' ' ' ALA . 69.6 t -58.63 -47.67 88.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.241 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -73.21 -23.5 60.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.704 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.0 m -67.66 -29.65 69.0 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -78.12 -32.63 50.56 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.846 -1.07 . . . . 10.0 108.526 177.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -60.3 -49.92 75.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.128 -0.942 . . . . 10.0 109.802 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 639' ' ' PHE . . . . . 0.445 ' CD1' ' HG2' ' A' ' 400' ' ' GLU . 32.2 t80 -56.62 -38.22 71.79 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.56 179.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 640' ' ' ASP . . . . . 0.472 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 32.4 t70 -59.34 -35.49 73.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.602 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 24.9 mt -82.75 -38.97 15.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.119 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 642' ' ' ARG . . . . . 0.501 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 5.5 mtm180 -61.03 -39.16 88.72 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.666 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 643' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 18.8 pttm -66.31 -25.32 66.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.016 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 644' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 15.8 mm100 -66.95 -39.65 87.33 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.621 -0.511 . . . . 10.0 109.621 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 33.1 mt -66.94 -39.69 87.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.629 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 646' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 46.9 mt -63.42 -35.55 80.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.733 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -63.62 -24.11 67.66 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.115 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 648' ' ' TYR . . . . . 0.423 ' CZ ' ' HG3' ' A' ' 800' ' ' LYS . 48.1 m-85 -97.28 -39.95 8.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.132 0.491 . . . . 10.0 110.979 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -75.21 -27.02 59.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.713 0.634 . . . . 10.0 112.713 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 650' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 5.4 t0 -68.16 -21.56 64.89 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.216 0.531 . . . . 10.0 110.368 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 17.8 t -68.23 -49.45 66.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -68.49 -25.51 65.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.054 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -61.5 -54.24 45.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 10.0 111.043 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -61.9 -42.98 99.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.912 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -64.89 -38.66 91.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.652 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 14.0 ttp-105 -65.25 -45.88 82.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.788 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -61.35 -40.28 93.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.487 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.4 -54.18 36.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.764 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.2 tp -67.09 -35.29 74.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 116.64 -0.255 . . . . 10.0 111.603 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -64.27 -41.71 96.78 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 110.356 -0.239 . . . . 10.0 110.356 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 15.0 t -61.9 -50.3 72.73 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -57.56 -45.95 84.53 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.779 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 19.3 ttt-85 -62.19 -36.98 83.56 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.931 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -74.36 -37.12 63.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.754 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.01 -41.44 96.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 10.0 110.65 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 77.2 mt -83.15 -5.03 58.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.393 0.616 . . . . 10.0 110.499 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 52.1 tp -91.26 -47.19 7.64 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.351 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -65.69 -41.26 92.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.502 -0.772 . . . . 10.0 112.046 -179.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 34.0 m -73.35 145.59 11.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.9 0.381 . . . . 10.0 111.302 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.66 -27.17 29.28 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.974 0.416 . . . . 10.0 110.055 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -81.48 -178.04 6.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.486 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 672' ' ' VAL . . . . . 0.465 ' O ' HG12 ' A' ' 676' ' ' ILE . 7.4 p -179.82 -24.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.392 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -37.29 63.59 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.412 -0.813 . . . . 10.0 111.329 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.96 -53.98 52.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.641 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 675' ' ' THR . . . . . 0.482 ' O ' HG12 ' A' ' 679' ' ' ILE . 0.2 OUTLIER -62.55 -41.92 99.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.837 -0.619 . . . . 10.0 110.564 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 676' ' ' ILE . . . . . 0.465 HG12 ' O ' ' A' ' 672' ' ' VAL . 29.5 mm -57.91 -51.44 70.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.663 -0.698 . . . . 10.0 111.56 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 -68.68 -32.2 71.85 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 49.8 m -65.8 -49.63 67.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.741 0.305 . . . . 10.0 110.548 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 679' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 675' ' ' THR . 42.8 pt -73.83 -21.49 18.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 120.826 -0.35 . . . . 10.0 111.084 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 49.2 ttm-85 -59.58 -38.67 81.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.795 0.331 . . . . 10.0 110.536 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.99 -34.85 79.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.82 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -80.39 -41.95 23.71 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.457 -178.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 64.7 t -59.63 -47.6 90.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-O 120.941 0.4 . . . . 10.0 110.76 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -64.71 -38.52 91.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.07 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.1 tttm -59.95 -51.48 69.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.504 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.85 -36.86 77.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.232 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 25.8 m -68.81 -43.73 75.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.702 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.4 mt -66.74 -47.24 83.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.412 . . . . 10.0 110.394 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -58.32 -24.46 59.72 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.915 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -74.06 -18.28 60.85 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 691' ' ' TYR . . . . . 0.434 ' OH ' ' HD3' ' A' ' 709' ' ' ARG . 97.5 m-85 -122.53 -25.82 4.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.937 0.399 . . . . 10.0 111.071 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 51.4 mt -126.06 102.46 27.74 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.866 -0.607 . . . . 10.0 109.701 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -60.99 132.49 42.3 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.499 2.132 . . . . 10.0 111.594 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -44.3 104.92 0.06 OUTLIER 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 123.654 2.903 . . . . 10.0 113.653 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 53.75 80.98 0.1 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.008 -0.996 . . . . 10.0 111.802 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 8.8 p -137.27 -163.1 1.37 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.98 -0.554 . . . . 10.0 110.604 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 5.1 mt -78.05 128.79 34.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.278 179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . 0.588 ' HA ' ' CD2' ' A' ' 701' ' ' TRP . 11.4 pm0 -55.57 -28.14 53.29 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.41 -22.52 61.85 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.074 0.464 . . . . 10.0 110.59 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 22.9 ttt -92.87 11.24 27.86 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.181 0.515 . . . . 10.0 110.797 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 701' ' ' TRP . . . . . 0.588 ' CD2' ' HA ' ' A' ' 698' ' ' GLU . 53.8 m0 -97.77 126.18 42.99 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.227 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -85.38 79.44 9.47 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 703' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.3 mm -62.16 -50.39 80.34 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.318 -0.855 . . . . 10.0 111.461 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 704' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 35.6 Cg_exo -58.24 -46.11 27.11 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.886 1.724 . . . . 10.0 112.189 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -61.03 -44.64 97.94 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.007 -0.616 . . . . 10.0 112.583 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 40.0 tp -66.73 -42.63 85.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.511 0.196 . . . . 10.0 111.053 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -60.6 -50.9 71.65 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.473 -0.33 . . . . 10.0 110.651 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -62.92 -37.22 86.14 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.573 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . 0.434 ' HD3' ' OH ' ' A' ' 691' ' ' TYR . 7.1 tpt180 -61.48 -48.64 80.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.502 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 89.4 mt -63.28 -35.59 80.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.292 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -70.49 -41.4 72.75 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.266 0.469 . . . . 10.0 112.266 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -85.31 -44.15 13.08 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 113.051 0.76 . . . . 10.0 113.051 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 713' ' ' ASP . . . . . 0.412 ' O ' ' HE3' ' A' ' 828' ' ' LYS . 1.2 m-20 -83.36 -34.59 25.58 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.444 0.905 . . . . 10.0 113.444 -176.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -115.97 -1.26 12.56 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.735 1.013 . . . . 10.0 113.735 -177.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 33.0 t70 60.72 35.0 19.8 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.672 0.749 . . . . 10.0 109.952 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 13.8 tp -123.2 108.1 12.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.136 -179.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -90.92 103.69 16.37 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.109 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 80.6 mt -122.16 123.84 27.1 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.897 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 719' ' ' PRO . . . . . 0.454 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 87.8 Cg_endo -82.08 70.5 7.08 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.762 2.308 . . . . 10.0 111.233 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 91.7 mt -56.42 -39.6 62.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.295 -0.866 . . . . 10.0 111.649 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -58.49 -47.95 82.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.606 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 722' ' ' GLU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 719' ' ' PRO . 27.0 mm-40 -64.92 -34.59 78.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.428 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -63.19 -49.95 72.22 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.972 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 35.6 tp -75.74 -24.79 56.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.063 0.459 . . . . 10.0 110.736 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -69.17 -50.92 43.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.846 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -81.25 -34.54 32.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.13 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -119.44 90.29 42.21 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.617 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -70.39 -15.68 34.77 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.116 1.877 . . . . 10.0 111.63 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -72.49 -7.88 52.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.303 -0.862 . . . . 10.0 110.918 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 730' ' ' LEU . . . . . 0.45 HD22 ' HA ' ' A' ' 730' ' ' LEU . 0.3 OUTLIER -65.92 -35.56 80.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.301 179.587 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 51.92 -102.18 0.12 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.426 -0.807 . . . . 10.0 111.066 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -141.64 -53.07 0.44 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.017 0.437 . . . . 10.0 110.465 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -56.26 -48.7 76.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.637 -0.71 . . . . 10.0 111.385 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 2.4 m -66.25 -28.4 68.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.239 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 48.1 tp -66.46 -41.95 88.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.462 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 736' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 736' ' ' ARG . 55.9 mtt-85 -60.82 -39.65 89.78 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.815 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -60.75 -42.79 98.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.604 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 738' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 738' ' ' ARG . 7.6 mmm-85 -64.45 -43.41 94.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.561 -0.745 . . . . 10.0 111.388 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 94.1 mt -62.7 -48.71 86.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.976 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 34.3 tp -64.42 -46.23 84.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.054 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.71 88.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 10.0 111.433 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -66.06 -36.06 82.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.554 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 54.1 p -63.79 -37.72 88.41 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.814 0.34 . . . . 10.0 110.2 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 744' ' ' ILE . . . . . 0.409 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 30.6 mt -72.58 -38.21 58.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.079 -0.51 . . . . 10.0 109.882 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -58.97 -49.66 77.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.131 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 60.3 t -66.57 -36.07 76.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.102 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -60.08 -48.2 82.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.414 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 748' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 27.2 mt-30 -60.61 -40.82 93.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.806 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 749' ' ' ARG . . . . . 0.431 HH11 ' HD3' ' A' ' 749' ' ' ARG . 19.8 ttp-105 -63.05 -43.39 98.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.349 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -70.09 -37.33 75.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.134 0.492 . . . . 10.0 109.988 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.9 -42.08 98.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.64 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -62.33 -19.95 63.85 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.235 0.458 . . . . 10.0 112.235 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.6 t -82.99 -43.58 18.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.131 0.491 . . . . 10.0 110.68 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 17.4 t -81.84 -37.49 15.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.244 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 119.81 134.25 4.75 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 110.706 -0.957 . . . . 10.0 110.706 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 756' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -54.03 -59.58 4.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.727 0.299 . . . . 10.0 111.789 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 26.3 mp0 -63.51 -36.13 82.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.085 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 16.1 tpt -65.15 -41.46 94.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.688 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 47.3 mmm -62.18 -40.22 95.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.727 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.499 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -59.58 -39.62 84.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.367 0.604 . . . . 10.0 110.027 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -70.59 -36.93 73.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.677 -0.692 . . . . 10.0 109.735 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -66.5 -47.56 72.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.294 -0.866 . . . . 10.0 110.245 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -58.15 -45.33 87.61 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.39 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -60.9 -45.54 94.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.385 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.34 -47.25 90.92 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 121.086 -0.578 . . . . 10.0 112.454 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.28 -44.41 95.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.703 0.287 . . . . 10.0 110.556 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -56.83 -50.4 72.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.119 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.28 -45.94 91.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.579 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.98 -44.25 96.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.591 -0.277 . . . . 10.0 110.979 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 11.1 m -62.64 -38.91 92.1 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.478 -0.328 . . . . 10.0 110.557 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 17.8 mt -59.87 -52.1 66.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.519 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -61.86 -42.02 98.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.718 -0.674 . . . . 10.0 111.303 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 44.1 m -58.95 -54.21 49.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.561 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 6.1 mp -67.7 -27.66 67.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.669 -0.242 . . . . 10.0 111.366 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 15.5 t-105 -62.53 -41.75 99.07 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.47 ' C ' ' HD2' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -61.12 -47.31 86.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.685 -0.688 . . . . 10.0 109.628 178.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -42.62 76.4 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.205 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 778' ' ' HIS . . . . . 0.658 ' O ' ' HG2' ' A' ' 782' ' ' MET . 59.2 t60 -65.01 -46.46 81.27 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.445 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 779' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 779' ' ' LEU . 25.6 mt -59.57 -46.42 88.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.873 0.368 . . . . 10.0 111.01 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.54 90.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.766 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.99 -34.38 76.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.623 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 782' ' ' MET . . . . . 0.658 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 97.3 mmm -58.0 -50.95 71.63 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.176 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 783' ' ' ASP . . . . . 0.539 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 8.1 t70 -73.24 -36.3 66.39 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-O 120.651 0.262 . . . . 10.0 110.417 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -56.98 -36.87 70.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.605 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 57.3 tp -88.62 -30.93 18.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.499 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -56.76 -45.96 81.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.683 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 787' ' ' GLN . . . . . 0.539 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 10.0 pt20 . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.158 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo . . . . . 0 CA--C 1.529 0.253 0 N-CA-C 113.321 0.47 . . . . 10.0 113.321 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 800' ' ' LYS . . . . . 0.475 ' HB2' ' NZ ' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -67.97 -43.5 78.83 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 -179.755 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -64.21 -39.36 93.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.526 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -65.36 -46.53 79.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.929 179.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 803' ' ' TYR . . . . . 0.408 ' CD2' ' HD1' ' A' ' 648' ' ' TYR . 72.6 t80 -59.29 -38.92 81.42 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.125 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -59.24 -46.12 89.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.931 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 34.8 mtm105 -58.9 -46.93 86.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.236 0.541 . . . . 10.0 110.077 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -59.42 -43.86 92.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.563 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 14.3 m -67.36 -38.78 85.34 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.446 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -67.21 -41.04 86.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.732 0.301 . . . . 10.0 110.4 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 10.9 m -65.77 -39.35 90.92 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 22.9 ttm -63.73 -34.9 78.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.278 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -69.54 -45.72 68.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.543 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.8 -50.55 71.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.972 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -60.1 -32.38 70.93 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.074 0.464 . . . . 10.0 110.861 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 40.8 ttp -65.64 -49.22 69.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.029 179.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.26 -40.57 94.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 816' ' ' GLU . . . . . 0.435 ' HA ' ' HE2' ' A' ' 819' ' ' LYS . 34.6 mm-40 -61.11 -41.88 97.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.083 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 4.8 m -75.78 -28.34 58.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.569 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 31.0 tp -61.08 -60.38 3.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.857 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 819' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 816' ' ' GLU . 44.7 pttt -59.16 -32.97 70.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.692 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -62.82 -57.41 10.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.679 -0.692 . . . . 10.0 111.31 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -65.39 -34.11 77.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.911 -178.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 822' ' ' VAL . . . . . 0.417 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 39.6 t -58.62 -53.27 49.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.712 0.291 . . . . 10.0 110.511 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 33.9 mm -64.66 -39.76 86.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.535 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 36.2 m -62.37 -50.64 70.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.05 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 29.0 m -58.26 -41.77 85.0 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 111.961 0.356 . . . . 10.0 111.961 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 826' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 98.9 mt -65.55 -23.98 67.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.936 0.398 . . . . 10.0 111.343 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 4.5 m -95.34 -21.19 18.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.365 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 828' ' ' LYS . . . . . 0.412 ' HE3' ' O ' ' A' ' 713' ' ' ASP . 88.0 mttt -74.49 -9.92 59.05 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.565 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.4 p -56.97 125.79 13.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 121.198 0.523 . . . . 10.0 110.439 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -104.7 115.71 30.79 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.193 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 3.4 m . . . . . 0 C--N 1.321 -0.637 0 CA-C-N 115.322 -0.854 . . . . 10.0 109.089 179.267 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 109.813 -0.44 . . . . 10.0 109.813 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -137.77 144.48 41.62 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.848 0.356 . . . . 10.0 110.191 179.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 114.52 137.27 6.42 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 121.102 -0.57 . . . . 10.0 111.853 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.88 128.2 20.51 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.028 0.442 . . . . 10.0 111.223 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.494 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 1.2 mmp_? -63.19 142.76 58.26 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.668 -0.696 . . . . 10.0 111.492 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.438 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 0.9 OUTLIER 71.89 -81.99 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.302 -0.863 . . . . 10.0 112.232 179.129 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -49.65 -66.16 0.44 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.92 0.711 . . . . 10.0 112.92 -178.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 19' ' ' ARG . 7.8 ttm105 -71.02 -27.63 63.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.679 0.276 . . . . 10.0 111.454 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.9 m -61.88 -38.08 86.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.371 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 14' ' ' ASN . 90.1 mt -59.55 -49.83 76.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.678 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 16' ' ' ARG . 26.8 ptt-85 -75.62 -29.34 59.17 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.813 -0.355 . . . . 10.0 111.383 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -63.93 -40.68 97.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.094 0.473 . . . . 10.0 109.736 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.444 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -68.49 -35.46 77.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.124 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.7 tpp180 -61.26 -35.62 77.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.617 -0.72 . . . . 10.0 110.783 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.89 -40.82 85.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.654 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.0 t -74.78 -39.81 46.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.448 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.8 t -57.57 -37.92 61.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.658 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -62.64 -44.73 95.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.103 -0.498 . . . . 10.0 110.206 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.1 mt -60.77 -45.11 98.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.345 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 61.9 mt -59.56 -43.16 90.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.513 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -66.68 -33.18 75.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.488 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.496 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -76.81 -34.11 57.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.155 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 16.4 ttt -83.18 -9.66 59.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.361 -0.382 . . . . 10.0 111.295 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.435 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 19.3 tt0 -58.72 -51.74 79.67 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-O 119.39 -0.338 . . . . 10.0 111.885 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.496 ' HD2' ' O ' ' A' ' 30' ' ' ALA . 60.3 Cg_exo -53.87 -33.37 71.3 Favored 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 122.082 1.854 . . . . 10.0 111.772 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -71.37 -39.54 71.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.275 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 20.0 mmt -65.73 -33.59 76.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.621 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -66.5 -14.02 61.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.057 0.456 . . . . 10.0 110.813 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -94.81 -8.09 38.46 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.362 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.9 mp -88.45 142.0 28.07 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.675 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 p -75.15 167.07 22.62 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.725 0.297 . . . . 10.0 110.529 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.83 -42.98 90.52 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.384 -179.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -69.8 -19.7 63.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.507 -0.315 . . . . 10.0 111.423 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -75.43 -36.76 60.72 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 110.293 -0.262 . . . . 10.0 110.293 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.7 mt -61.79 -41.41 97.7 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -64.74 -35.11 80.01 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.58 -1.191 . . . . 10.0 109.416 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.63 -28.83 70.36 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.341 -0.845 . . . . 10.0 112.295 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -71.83 -37.19 70.36 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 33.1 m -60.87 -45.25 95.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 10.0 109.959 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.62 -33.09 73.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.011 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -63.34 -43.62 97.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.573 -0.74 . . . . 10.0 110.304 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.7 m-30 -61.38 -37.26 82.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.284 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 9.4 tpp180 -60.54 -45.4 93.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.729 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.57 -44.3 74.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.896 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 65.0 mtp180 -61.09 -37.11 81.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.279 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.0 mt -59.93 -38.04 81.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.389 -0.368 . . . . 10.0 111.077 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -86.56 -14.34 43.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.066 0.46 . . . . 10.0 110.706 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -77.69 -52.57 8.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.943 -0.571 . . . . 10.0 109.71 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 157.45 45.93 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.398 -0.819 . . . . 10.0 111.594 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -117.63 139.01 51.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.706 0.289 . . . . 10.0 110.338 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 42.6 t -85.51 138.66 18.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.813 -0.439 . . . . 10.0 109.813 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.46 HD11 ' O ' ' A' ' 118' ' ' LEU . 22.6 tp -57.74 -45.0 86.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.985 0.421 . . . . 10.0 110.836 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 25.7 mp0 -64.7 -16.97 63.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.835 -0.62 . . . . 10.0 111.433 179.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -91.95 -14.7 29.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.07 0.462 . . . . 10.0 110.298 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.2 mt -87.61 -8.91 55.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.144 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.481 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 69.8 mt -50.16 -50.92 66.97 Favored Pre-proline 0 CA--C 1.543 0.699 0 N-CA-C 113.387 0.884 . . . . 10.0 113.387 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.481 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.7 Cg_exo -52.05 -48.39 21.85 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 122.251 1.967 . . . . 10.0 113.199 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.5 ' O ' HG23 ' A' ' 70' ' ' VAL . 48.1 mt-10 -77.04 -43.99 32.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.621 -179.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.502 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -59.15 -51.6 69.31 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.184 0.438 . . . . 10.0 112.184 -178.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -63.74 -32.38 73.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.661 0.267 . . . . 10.0 111.178 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.23 -43.37 91.64 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.855 -0.424 . . . . 10.0 109.855 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 66' ' ' GLU . 96.9 t -62.36 -43.05 97.72 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.127 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 67' ' ' ALA . 46.2 t -62.01 -44.32 98.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.565 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.427 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 9.8 ttm180 -62.02 -40.87 97.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.393 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -67.57 -52.9 33.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.267 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.72 -41.72 77.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.712 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.1 m -62.59 -31.38 72.19 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -179.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -72.46 -20.43 61.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.662 0.268 . . . . 10.0 111.195 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -100.55 -27.53 13.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.425 -0.352 . . . . 10.0 111.826 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 90.1 t -89.82 -51.45 12.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.688 0.28 . . . . 10.0 111.725 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -104.84 -26.88 12.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.041 0.448 . . . . 10.0 111.124 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 85.66 11.67 73.82 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.862 -0.685 . . . . 10.0 111.499 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 68.3 mtt -112.2 122.02 46.57 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.803 0.335 . . . . 10.0 110.603 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.411 ' HD2' ' OE2' ' A' ' 32' ' ' GLU . 12.7 ttp180 -84.03 134.32 34.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.111 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -70.38 115.66 9.82 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.576 -0.527 . . . . 10.0 109.576 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -60.97 156.21 18.19 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.369 0.418 . . . . 10.0 111.254 -178.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -60.12 -37.14 79.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.144 -179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.3 m -65.13 -32.28 57.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.902 0.382 . . . . 10.0 110.57 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -73.77 -33.54 64.3 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.079 -0.509 . . . . 10.0 109.74 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.0 mt -62.56 -39.03 92.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.016 -0.538 . . . . 10.0 109.57 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.447 ' O ' HG23 ' A' ' 93' ' ' VAL . 67.8 mt -62.2 -53.05 60.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.198 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.76 -45.95 95.18 Favored Glycine 0 N--CA 1.45 -0.395 0 CA-C-N 115.745 -0.661 . . . . 10.0 112.444 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.22 -32.49 82.78 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.284 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.444 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 25.9 ttm -71.88 -38.95 69.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.826 0.346 . . . . 10.0 110.343 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 89' ' ' LEU . 90.7 t -67.6 -30.96 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.398 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.0 mt -69.2 -3.67 14.57 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.675 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -83.26 -20.85 33.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.527 0.68 . . . . 10.0 109.369 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -93.39 -162.92 0.98 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.538 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.7 ttt180 -107.38 58.64 0.62 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.56 -0.904 . . . . 10.0 108.56 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 3.1 m -130.58 164.52 24.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.295 -0.866 . . . . 10.0 111.224 -178.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.513 HD12 HG11 ' A' ' 211' ' ' VAL . 44.4 mm -109.88 127.36 66.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.692 -0.685 . . . . 10.0 109.24 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.83 127.94 53.84 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.995 0.369 . . . . 10.0 111.995 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -82.07 124.49 29.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.64 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 19.0 ttm -120.03 124.32 45.59 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.76 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.589 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 8.8 mmm180 -70.24 152.33 44.34 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.675 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.05 106.12 1.53 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.991 -0.55 . . . . 10.0 111.788 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 124.74 -18.96 7.08 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.618 -0.801 . . . . 10.0 113.884 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.649 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 10.2 mm-40 -58.82 -41.47 86.92 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 117.112 0.456 . . . . 10.0 112.095 -178.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.48 85.87 1.28 Allowed Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.523 -0.846 . . . . 10.0 112.324 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -65.43 -47.76 75.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.7 0.286 . . . . 10.0 111.551 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 55.7 m -63.55 -29.27 70.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.914 0.387 . . . . 10.0 111.559 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.2 tp -87.4 6.92 31.39 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.956 0.408 . . . . 10.0 111.154 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 40.8 m -120.83 -43.09 2.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.877 0.37 . . . . 10.0 110.597 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -67.67 -15.63 63.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.405 0.521 . . . . 10.0 112.405 -179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.6 -21.83 61.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.821 0.343 . . . . 10.0 111.921 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 11.6 mt -74.43 -57.57 2.09 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.58 -28.22 69.82 Favored 'Trans proline' 0 C--N 1.356 0.923 0 C-N-CA 122.005 1.803 . . . . 10.0 112.156 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -64.96 -50.28 67.02 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.505 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.403 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 58.6 t80 -61.87 -44.37 96.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.952 0.405 . . . . 10.0 110.797 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.46 ' O ' HD11 ' A' ' 60' ' ' LEU . 49.6 tp -59.47 -54.31 48.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.83 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -71.0 -22.8 62.12 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.024 -0.27 . . . . 10.0 111.629 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.485 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -67.43 -27.71 67.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.817 0.342 . . . . 10.0 111.121 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 73.7 mt -60.17 -25.16 65.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.605 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.3 p -71.66 -20.46 61.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.018 0.437 . . . . 10.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.47 6.39 76.0 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.161 -0.542 . . . . 10.0 112.986 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 46.2 mmtt -79.2 -24.22 43.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.921 0.36 . . . . 10.0 110.778 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 106.05 117.01 4.24 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.629 -0.796 . . . . 10.0 113.559 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 74.1 t -87.82 115.05 27.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.1 m170 -94.03 101.39 13.43 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.084 0.468 . . . . 10.0 111.17 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 40.7 t -89.94 122.75 41.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.924 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.2 t -101.84 119.98 50.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.669 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.05 158.0 18.73 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.674 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.4 m -72.3 -31.12 37.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.977 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -145.79 172.04 13.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.584 0.231 . . . . 10.0 110.922 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -73.96 -26.81 60.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.198 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -58.67 -58.68 7.52 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.665 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.28 -35.6 80.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.912 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.58 -50.07 74.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.107 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.64 -25.3 49.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.879 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 -66.22 -60.29 2.94 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.754 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -67.58 -29.63 69.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.057 -0.519 . . . . 10.0 111.475 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.52 -49.77 76.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.82 0.343 . . . . 10.0 111.237 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -79.36 -27.86 41.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.151 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . 0.432 ' O ' ' HD2' ' A' ' 145' ' ' PRO . 8.2 t30 -71.55 -45.42 62.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.298 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -86.68 -3.26 59.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.209 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.515 ' HA ' HG21 ' A' ' 154' ' ' VAL . 59.6 ttm-85 -59.81 -50.08 88.42 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' PRO . . . . . 0.496 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 24.5 Cg_exo -64.56 -5.22 9.7 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 122.201 1.934 . . . . 10.0 112.701 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 23.9 tp -96.7 -54.65 3.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.955 0.407 . . . . 10.0 110.224 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -67.81 -44.34 77.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.265 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.462 ' HA ' ' O ' ' A' ' 152' ' ' LEU . 3.7 mt-10 -70.69 -16.7 62.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.918 0.389 . . . . 10.0 111.135 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.468 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 73.3 t80 -73.03 -27.43 61.76 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.422 0.629 . . . . 10.0 109.588 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 30.5 mt -95.55 -8.03 36.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.206 -0.907 . . . . 10.0 110.94 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 112.96 -14.85 23.8 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.559 -0.829 . . . . 10.0 113.454 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 148' ' ' GLU . 85.3 mt -71.41 156.27 39.67 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.951 0.405 . . . . 10.0 111.021 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 16.2 p -107.51 136.41 47.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.336 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.515 HG21 ' HA ' ' A' ' 144' ' ' ARG . 45.1 t -110.27 122.4 64.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.135 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -117.31 139.34 14.91 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 121.119 -0.562 . . . . 10.0 112.002 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 5.5 tp -112.89 130.45 66.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.05 0.452 . . . . 10.0 110.688 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -115.57 107.35 15.03 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.003 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 94.0 mt -102.36 145.44 30.52 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.495 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' PRO . . . . . 0.428 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 19.7 Cg_endo -59.02 113.94 1.79 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.612 2.208 . . . . 10.0 112.049 179.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 105.81 0.45 39.35 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.801 -0.714 . . . . 10.0 112.433 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . 0.599 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 39.4 ttm -66.22 137.87 95.79 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 110.396 -0.224 . . . . 10.0 110.396 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.97 152.38 71.43 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.491 2.128 . . . . 10.0 112.371 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . 0.415 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.45 -47.39 96.45 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.862 0.69 . . . . 10.0 112.862 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.415 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 77.6 Cg_exo -52.26 -49.42 17.46 Favored 'Trans proline' 0 C--N 1.361 1.218 0 C-N-CA 121.831 1.687 . . . . 10.0 112.645 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.59 -38.06 86.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.088 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 161' ' ' MET . 59.1 mttm -59.92 -45.09 93.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.48 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -59.62 -35.32 74.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.845 -0.616 . . . . 10.0 111.124 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -70.15 -39.0 75.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.052 0.453 . . . . 10.0 110.422 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -73.6 -38.43 65.1 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.74 -0.663 . . . . 10.0 111.551 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -74.9 -25.2 58.76 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.524 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -84.34 -1.84 56.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.114 0.483 . . . . 10.0 110.712 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -79.9 168.35 19.35 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.45 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . 0.485 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 18.3 m-20 -71.04 -40.59 71.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.16 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.2 mp -127.01 127.23 69.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.168 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 5.2 m -117.33 125.37 50.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.884 0.373 . . . . 10.0 111.244 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -103.28 129.57 50.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -165.95 172.15 41.27 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.103 -1.046 . . . . 10.0 113.171 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.95 151.84 19.69 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.466 -0.198 . . . . 10.0 110.466 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 29.7 p-10 -61.57 -36.42 80.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.755 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -58.26 -54.91 41.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.487 -0.324 . . . . 10.0 111.255 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.428 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 3.7 tp10 -67.72 -35.71 79.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.959 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -55.03 -40.99 70.8 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.385 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -74.68 -40.97 36.32 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.008 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -63.92 -39.28 93.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.75 0.31 . . . . 10.0 110.573 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . 0.411 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 19.6 m-20 -60.86 -41.98 96.97 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.98 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -62.73 -39.62 94.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.197 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 75.3 mt -66.86 -45.95 76.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.883 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 68.5 mtm-85 -63.82 -38.54 91.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.888 0.375 . . . . 10.0 110.969 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -64.45 -46.39 83.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.616 -0.72 . . . . 10.0 111.087 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -73.24 -20.98 60.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.622 -0.717 . . . . 10.0 112.064 -178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 22.9 ttp -99.87 26.57 6.19 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.112 0.482 . . . . 10.0 110.9 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -87.89 161.53 17.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.537 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -102.56 -29.06 11.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.083 0.468 . . . . 10.0 110.484 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.09 140.56 31.24 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.02 -26.28 81.98 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.693 2.262 . . . . 10.0 112.638 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -75.62 -11.09 59.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.542 -0.299 . . . . 10.0 111.305 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -80.78 -13.81 58.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.629 -0.26 . . . . 10.0 110.672 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 35.1 mtt180 -53.45 155.23 3.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.951 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 14.7 m -130.93 -20.81 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.374 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -89.31 -179.09 5.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.753 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -133.44 -79.87 0.48 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.534 -0.303 . . . . 10.0 110.974 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 19.5 ttmm -151.93 142.27 22.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.8 0.334 . . . . 10.0 110.562 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 9.9 mt -93.04 60.41 3.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.343 0.592 . . . . 10.0 109.752 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -81.01 -56.71 3.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.623 -0.717 . . . . 10.0 112.285 -178.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -132.69 137.36 46.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.033 0.445 . . . . 10.0 111.623 -178.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.497 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -134.01 129.43 36.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.427 -0.806 . . . . 10.0 109.741 178.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 55.0 tp -124.07 108.49 12.4 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.176 -0.465 . . . . 10.0 109.808 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -96.82 132.1 42.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.184 0.516 . . . . 10.0 111.254 -179.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -60.98 -53.84 52.29 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.368 -0.833 . . . . 10.0 112.352 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' GLU . . . . . 0.55 ' HB2' HH21 ' A' ' 509' ' ' ARG . 34.4 tt0 -123.97 108.3 12.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.005 0.431 . . . . 10.0 111.027 -179.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.513 HG11 HD12 ' A' ' 99' ' ' ILE . 32.9 m -84.47 -21.11 8.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.6 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.0 OUTLIER -53.77 -34.56 59.43 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.703 -0.68 . . . . 10.0 111.379 -179.703 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 8.9 p -107.2 -57.16 2.11 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.923 -179.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.66 -37.91 68.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 113.485 0.92 . . . . 10.0 113.485 -177.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 219' ' ' ALA . 10.9 mt -94.19 -28.79 15.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.773 0.657 . . . . 10.0 112.773 -178.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' ILE . . . . . 0.404 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 40.3 mm -92.1 -63.05 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 112.406 0.521 . . . . 10.0 112.406 -178.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -69.65 -47.47 63.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.857 0.317 . . . . 10.0 111.857 -178.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 218' ' ' GLU . . . . . 0.439 ' HA ' ' OG1' ' A' ' 221' ' ' THR . 6.1 mm-40 -80.3 12.31 3.02 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.682 0.623 . . . . 10.0 112.682 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 215' ' ' LEU . . . -63.92 -42.83 97.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.773 0.32 . . . . 10.0 111.515 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 7.1 mtp-105 -102.39 28.24 6.11 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 221' ' ' THR . . . . . 0.439 ' OG1' ' HA ' ' A' ' 218' ' ' GLU . 4.5 m -96.44 110.29 52.0 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 120.712 0.291 . . . . 10.0 110.232 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -90.54 125.53 1.15 Allowed 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.901 2.401 . . . . 10.0 112.795 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 223' ' ' LEU . . . . . 0.603 ' O ' ' HA ' ' A' ' 374' ' ' SER . 80.8 mt -78.79 90.65 4.67 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.343 -0.614 . . . . 10.0 109.343 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.487 HG23 HG22 ' A' ' 371' ' ' THR . 90.1 mt -88.95 117.49 32.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.801 -178.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 58.7 mt -96.44 113.03 29.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 6.3 m -99.33 76.3 2.04 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.212 0.53 . . . . 10.0 110.395 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -114.89 89.16 0.49 Allowed Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.66 -0.781 . . . . 10.0 112.14 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 228' ' ' PRO . . . . . 0.405 ' HB2' ' HB3' ' A' ' 367' ' ' ASN . 74.3 Cg_endo -78.21 169.86 19.55 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.659 2.239 . . . . 10.0 112.216 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -94.74 -2.11 51.67 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.622 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' A' ' 367' ' ' ASN . 94.2 mt-10 58.12 -115.15 0.81 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.581 -0.736 . . . . 10.0 111.168 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 13.6 t70 54.58 -130.7 2.06 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 123.552 0.533 . . . . 10.0 110.483 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 7.0 m -147.84 99.96 3.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.952 0.406 . . . . 10.0 110.3 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.09 65.65 7.31 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.179 0.514 . . . . 10.0 110.76 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . 0.846 ' HA ' HD12 ' A' ' 365' ' ' ILE . 39.3 mm-40 -67.09 -5.91 15.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.666 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -59.51 -32.05 69.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.175 -0.466 . . . . 10.0 111.239 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.07 -32.99 74.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.624 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 237' ' ' LYS . . . . . 0.776 ' HB2' HD11 ' A' ' 365' ' ' ILE . 14.3 ttmt -67.98 -21.13 65.08 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.007 0.432 . . . . 10.0 111.186 -179.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 238' ' ' ARG . . . . . 0.445 ' NH1' ' HB3' ' A' ' 234' ' ' GLU . 1.4 mpt_? -79.58 -18.86 50.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.051 0.453 . . . . 10.0 110.091 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 21.3 t -82.2 -47.99 18.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.035 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 240' ' ' ASN . . . . . 0.464 ' ND2' ' HA ' ' A' ' 360' ' ' LYS . 14.3 t30 -69.06 -13.4 62.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.688 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -66.39 -17.42 64.77 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.198 -179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 12.4 tt -87.93 -16.39 9.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.836 0.35 . . . . 10.0 111.531 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 243' ' ' ILE . . . . . 0.559 ' N ' ' HD2' ' A' ' 244' ' ' PRO . 25.3 mm -67.09 -45.57 52.06 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 113.201 0.815 . . . . 10.0 113.201 -178.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 244' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 243' ' ' ILE . 16.1 Cg_endo -58.77 -6.96 3.8 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 122.426 2.084 . . . . 10.0 113.561 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 19.3 t60 -87.41 -6.06 58.59 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 246' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 252' ' ' GLU . 2.8 mt -113.72 168.7 9.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.02 -178.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 51.8 mt -125.72 129.4 72.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.168 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 248' ' ' ARG . . . . . 0.668 ' HA ' ' O ' ' A' ' 253' ' ' ASP . 2.4 ptm180 -67.0 87.21 0.14 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.539 0.685 . . . . 10.0 111.06 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? 179.45 -41.62 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.223 -1.029 . . . . 10.0 108.223 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 250' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' ' 251' ' ' LYS . 4.2 mt-10 -160.14 157.25 28.08 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 114.692 -1.14 . . . . 10.0 108.738 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 250' ' ' GLU . 62.4 mttm 71.37 82.23 0.15 Allowed 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.871 0.732 . . . . 10.0 110.671 -179.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 252' ' ' GLU . . . . . 0.731 ' OE2' ' HA ' ' A' ' 282' ' ' ILE . 4.9 mm-40 67.75 -85.94 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.165 0.802 . . . . 10.0 113.165 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 253' ' ' ASP . . . . . 0.668 ' O ' ' HA ' ' A' ' 248' ' ' ARG . 43.8 t0 -53.35 104.87 0.11 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.97 0.414 . . . . 10.0 111.93 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 254' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 257' ' ' PHE . 73.7 m -165.28 123.88 1.67 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.754 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . 0.431 ' CD ' HH21 ' A' ' 248' ' ' ARG . 1.0 OUTLIER -73.94 89.2 1.88 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.189 0.519 . . . . 10.0 110.434 179.273 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 5.8 m 74.75 -64.1 0.4 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.244 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 257' ' ' PHE . . . . . 0.408 ' HB2' ' HB3' ' A' ' 254' ' ' SER . 9.8 t80 64.24 -86.68 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 123.299 0.64 . . . . 10.0 111.508 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 56.94 34.15 24.4 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.876 0.369 . . . . 10.0 111.138 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 93.59 -45.94 2.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.808 -0.71 . . . . 10.0 112.435 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -129.25 -76.73 0.55 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.949 0.404 . . . . 10.0 110.941 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 91.74 -71.71 1.74 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.047 -0.597 . . . . 10.0 111.964 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -165.66 175.24 9.02 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.2 165.14 25.68 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.933 -0.395 . . . . 10.0 109.933 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 2.6 m -77.12 68.9 3.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.027 0.442 . . . . 10.0 111.794 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -146.96 71.34 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.033 -0.53 . . . . 10.0 109.954 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 1.2 t70 56.57 68.49 0.85 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.975 0.893 . . . . 10.0 108.816 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . 0.552 ' CD ' ' H ' ' A' ' 267' ' ' GLU . 0.6 OUTLIER -83.46 23.38 0.94 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.354 -1.294 . . . . 10.0 112.955 -177.318 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 268' ' ' LYS . . . . . . . . . . . . . 3.8 ptpp? -65.11 104.82 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.45 0.643 . . . . 10.0 110.838 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 269' ' ' SER . . . . . 0.495 ' HB3' ' OE1' ' A' ' 271' ' ' GLN . 19.7 m -79.62 85.8 5.31 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.464 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 270' ' ' ARG . . . . . 0.589 ' HA ' HD13 ' A' ' 319' ' ' LEU . 43.2 mtm180 -77.66 10.95 2.32 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -178.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 271' ' ' GLN . . . . . 0.495 ' OE1' ' HB3' ' A' ' 269' ' ' SER . 4.2 pm0 -90.79 8.68 33.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.392 0.615 . . . . 10.0 109.785 178.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 13.9 t 63.45 -101.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.129 0 CA-C-N 114.963 -1.017 . . . . 10.0 110.812 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 65.57 -78.18 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.224 0.61 . . . . 10.0 112.13 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 63.6 mt 71.25 141.44 0.05 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.726 0.641 . . . . 10.0 109.983 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 3.7 m -152.14 -75.14 0.14 Allowed 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.416 0.895 . . . . 10.0 113.416 -178.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.91 68.1 0.71 Allowed 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 -176.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.39 14.95 13.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.346 -0.843 . . . . 10.0 110.877 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . -94.63 -33.79 6.59 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.878 -0.889 . . . . 10.0 110.878 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 64.54 26.87 13.39 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.382 0.611 . . . . 10.0 110.341 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 10.9 p -124.78 -15.55 4.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.424 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 64.5 mt -87.89 -43.77 11.56 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 282' ' ' ILE . . . . . 0.731 ' HA ' ' OE2' ' A' ' 252' ' ' GLU . 19.8 tt -60.4 -21.36 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.489 -0.778 . . . . 10.0 111.024 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -68.36 -9.53 48.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.606 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -87.9 -28.95 21.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.584 -0.28 . . . . 10.0 110.906 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.37 -44.89 20.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.96 0.409 . . . . 10.0 109.971 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 286' ' ' LEU . . . . . 0.408 HD21 ' HB2' ' A' ' 298' ' ' LEU . 26.9 mt -65.1 152.62 43.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.585 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 287' ' ' VAL . . . . . 0.554 ' HA ' ' HA ' ' A' ' 293' ' ' ASP . 26.5 t 71.32 151.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 O-C-N 123.642 0.589 . . . . 10.0 111.543 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 288' ' ' LYS . . . . . 0.531 ' N ' ' HB2' ' A' ' 293' ' ' ASP . 0.0 OUTLIER 74.39 163.03 0.26 Allowed 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.893 0.877 . . . . 10.0 112.099 179.063 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 289' ' ' GLU . . . . . 0.476 ' OE2' ' HA ' ' A' ' 289' ' ' GLU . 2.8 mm-40 73.76 -74.82 0.08 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.094 -0.957 . . . . 10.0 111.54 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 290' ' ' GLY . . . . . 0.53 ' O ' ' HB ' ' A' ' 291' ' ' ILE . . . 156.17 131.57 1.41 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.372 -0.918 . . . . 10.0 112.473 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 291' ' ' ILE . . . . . 0.53 ' HB ' ' O ' ' A' ' 290' ' ' GLY . 1.5 mp 78.23 125.95 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 N-CA-C 108.435 -0.95 . . . . 10.0 108.435 -178.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 292' ' ' MET . . . . . 0.558 ' SD ' HD13 ' A' ' 298' ' ' LEU . 48.1 ttp 69.78 21.03 6.61 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.904 -1.147 . . . . 10.0 107.904 -177.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 293' ' ' ASP . . . . . 0.554 ' HA ' ' HA ' ' A' ' 287' ' ' VAL . 0.7 OUTLIER -125.43 4.3 7.66 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.212 -1.358 . . . . 10.0 110.847 -179.209 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -80.21 -29.63 38.59 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.244 0.545 . . . . 10.0 109.842 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 139.75 15.9 0.53 Allowed Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.306 -0.861 . . . . 10.0 111.892 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -83.01 155.66 23.83 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.837 0.351 . . . . 10.0 110.734 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.78 153.54 19.38 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 179.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.558 HD13 ' SD ' ' A' ' 292' ' ' MET . 10.5 tp -89.1 -4.56 58.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.963 0.411 . . . . 10.0 111.122 -179.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 12.7 p90 -110.5 40.3 2.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.551 0.691 . . . . 10.0 110.106 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 43.5 m -124.23 148.4 57.7 Favored Pre-proline 0 C--N 1.32 -0.713 0 CA-C-N 115.357 -0.838 . . . . 10.0 109.776 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -60.66 -16.09 41.14 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.82 2.347 . . . . 10.0 112.73 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -92.93 8.33 40.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.146 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -151.49 35.84 0.57 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.344 0.592 . . . . 10.0 110.35 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 8.5 tp -81.95 -25.7 9.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.042 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . 0.448 ' HG3' ' HG2' ' A' ' 777' ' ' GLU . 8.1 tmm? -66.13 -47.45 74.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.492 -0.322 . . . . 10.0 111.189 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 50.7 mt -68.57 -34.45 75.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.673 0.273 . . . . 10.0 110.553 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 10.5 tpt -57.25 -40.39 77.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.043 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -82.16 -2.05 50.95 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.229 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 43.2 m170 -102.31 -42.24 6.08 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 121.084 -0.246 . . . . 10.0 110.98 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 310' ' ' VAL . . . . . 0.546 HG21 HD21 ' A' ' 298' ' ' LEU . 23.1 m -69.03 -36.51 74.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.84 0.352 . . . . 10.0 111.108 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 3.0 p -67.83 -24.76 65.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.597 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 312' ' ' ALA . . . . . . . . . . . . . . . -65.41 -39.97 92.82 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.176 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -69.08 -33.14 73.06 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.536 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 35.0 tp -69.94 -45.77 66.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.049 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 315' ' ' ARG . . . . . . . . . . . . . 39.8 ptt180 -80.0 18.23 0.86 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.245 0.545 . . . . 10.0 110.866 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -124.78 3.34 8.16 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.459 0.647 . . . . 10.0 109.553 178.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -101.79 -77.69 0.54 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.957 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -88.33 -10.13 50.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.903 0.382 . . . . 10.0 111.275 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 319' ' ' LEU . . . . . 0.589 HD13 ' HA ' ' A' ' 270' ' ' ARG . 0.2 OUTLIER -80.16 -47.32 14.9 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.571 179.87 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -114.06 105.64 13.45 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.903 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 321' ' ' THR . . . . . 0.577 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 0.2 OUTLIER -84.81 136.79 33.53 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.425 0.631 . . . . 10.0 111.304 -179.314 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 322' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 5.2 tpt180 -66.83 140.7 57.83 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.807 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 323' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 0.5 OUTLIER 78.95 -15.39 0.77 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.157 0.983 . . . . 10.0 113.492 177.372 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 324' ' ' VAL . . . . . 0.577 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 2.6 p -115.86 -44.79 3.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 C-N-CA 120.529 -0.468 . . . . 10.0 111.53 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -92.3 -25.45 18.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.335 0.588 . . . . 10.0 110.039 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 37.7 p90 -161.75 154.82 20.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.905 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 17.7 tt -136.71 132.61 48.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.904 0.383 . . . . 10.0 110.238 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 17.5 t -116.25 115.77 50.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.246 -0.65 . . . . 10.0 109.246 179.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 329' ' ' LYS . . . . . 0.42 ' O ' ' HD3' ' A' ' 329' ' ' LYS . 0.0 OUTLIER -124.21 117.47 24.67 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.822 -179.253 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 59.19 34.06 23.01 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.338 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 88.7 -8.93 78.03 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.661 -0.78 . . . . 10.0 112.845 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -89.08 116.09 27.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.942 0.401 . . . . 10.0 110.27 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 48.1 t -89.05 120.28 37.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.755 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 65.4 mt -124.09 130.48 73.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.953 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 53.4 mt -79.85 131.02 35.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.976 -0.379 . . . . 10.0 109.976 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 41.3 t -105.13 119.06 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.072 0.463 . . . . 10.0 110.241 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -86.5 123.92 32.24 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.312 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -90.27 -6.62 54.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.513 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -81.58 -48.54 11.64 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.032 0.382 . . . . 10.0 112.032 -178.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.99 2.58 8.69 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 69.02 54.41 14.18 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.567 -0.825 . . . . 10.0 111.859 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -114.0 150.91 33.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.64 0.257 . . . . 10.0 110.534 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.65 121.01 41.27 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.946 0.403 . . . . 10.0 111.12 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 49.2 mtt -107.45 99.24 8.77 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.861 -0.422 . . . . 10.0 109.861 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 345' ' ' GLN . . . . . 0.402 ' CD ' ' H ' ' A' ' 345' ' ' GLN . 0.0 OUTLIER -93.92 -8.3 40.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.678 -178.813 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -117.08 30.35 6.34 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.655 -0.784 . . . . 10.0 111.852 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -143.56 149.61 37.65 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.133 -0.321 . . . . 10.0 110.133 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -152.94 132.27 12.83 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.206 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -62.75 120.1 10.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.443 . . . . 10.0 111.334 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.6 m -71.63 -161.46 0.07 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.845 -0.616 . . . . 10.0 111.926 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 33.7 t70 64.12 23.36 13.17 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.755 0.788 . . . . 10.0 110.403 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 74.38 5.65 73.09 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.554 -0.748 . . . . 10.0 113.537 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 18.5 tp -64.24 -50.18 69.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 117.179 0.489 . . . . 10.0 110.602 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 354' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -61.95 -33.31 74.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.085 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 355' ' ' GLN . . . . . 0.577 ' HA ' ' NE2' ' A' ' 355' ' ' GLN . 0.8 OUTLIER -67.39 -34.9 78.23 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.155 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -66.56 -38.62 87.48 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.165 0.507 . . . . 10.0 110.004 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 85.4 t -68.32 -44.51 83.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.041 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -66.97 -19.31 65.7 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 115.683 -0.69 . . . . 10.0 110.876 179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -95.46 -15.45 22.94 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.224 -0.444 . . . . 10.0 111.252 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 360' ' ' LYS . . . . . 0.464 ' HA ' ' ND2' ' A' ' 240' ' ' ASN . 35.9 ttpt -78.46 -49.07 14.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.269 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -93.11 179.95 5.28 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.4 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -78.46 55.14 4.07 Favored Glycine 0 CA--C 1.517 0.198 0 C-N-CA 121.134 -0.555 . . . . 10.0 112.774 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 2.9 t -108.54 155.2 9.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 110.024 -0.362 . . . . 10.0 110.024 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.27 110.42 11.97 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 365' ' ' ILE . . . . . 0.846 HD12 ' HA ' ' A' ' 234' ' ' GLU . 27.8 mt -66.77 130.85 32.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.812 -179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -84.75 -169.78 2.8 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.608 -0.724 . . . . 10.0 110.17 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 367' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 230' ' ' GLU . 5.5 t-20 -106.11 20.33 19.12 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.123 0.487 . . . . 10.0 110.305 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 60.06 -163.68 0.23 Allowed 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.224 -0.898 . . . . 10.0 111.639 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -159.65 81.91 0.74 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.816 -0.809 . . . . 10.0 108.816 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -123.33 -165.3 1.31 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.601 -179.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 371' ' ' THR . . . . . 0.487 HG22 HG23 ' A' ' 224' ' ' ILE . 1.7 p -73.4 103.67 4.14 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.14 0.793 . . . . 10.0 113.14 -178.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 5.9 tp -86.33 -30.48 22.19 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.698 -0.853 . . . . 10.0 108.698 177.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -166.07 133.74 2.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.482 -1.235 . . . . 10.0 108.136 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 374' ' ' SER . . . . . 0.603 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 24.3 m -152.4 148.16 27.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.051 0.453 . . . . 10.0 111.769 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 16.7 tt -155.41 139.53 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.504 -0.771 . . . . 10.0 109.977 178.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.1 143.98 26.76 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -57.21 -41.37 79.29 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.672 0.272 . . . . 10.0 110.983 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 378' ' ' GLN . . . . . 0.429 ' HA ' ' CE1' ' A' ' 405' ' ' TYR . 1.5 tm0? -59.89 -39.92 86.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.174 0.511 . . . . 10.0 110.359 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -81.71 -0.85 44.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.311 -179.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -102.59 -48.04 4.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.173 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -71.04 -21.58 62.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.123 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -72.43 -12.17 60.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.882 0.372 . . . . 10.0 110.999 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 42.7 mt -84.91 -18.38 34.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.798 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.497 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 39.0 m-85 -77.03 142.41 39.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.169 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -73.96 -64.31 1.04 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.95 0.405 . . . . 10.0 110.347 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -95.5 98.24 10.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.091 -0.504 . . . . 10.0 109.669 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 52.0 tp -107.41 110.03 21.9 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.072 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -130.21 163.99 25.49 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.206 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.35 168.89 41.97 Favored Glycine 0 N--CA 1.441 -0.97 0 C-N-CA 120.422 -0.894 . . . . 10.0 112.398 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 35.9 mtm -105.75 140.01 39.44 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.211 -0.292 . . . . 10.0 110.211 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 3.4 t -124.27 156.5 36.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -91.22 174.76 38.93 Favored Glycine 0 N--CA 1.441 -0.988 0 C-N-CA 120.622 -0.799 . . . . 10.0 111.599 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 393' ' ' THR . . . . . 0.589 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 1.3 m -74.49 62.95 1.04 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.289 0.566 . . . . 10.0 110.499 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . 0.535 ' HB1' ' HG2' ' A' ' 566' ' ' ARG . . . -113.81 -43.18 3.31 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.474 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 395' ' ' ASP . . . . . 0.427 ' CG ' ' H ' ' A' ' 396' ' ' THR . 35.9 t70 59.66 -126.76 1.19 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 396' ' ' THR . . . . . 0.594 ' HB ' ' OE1' ' A' ' 397' ' ' GLU . 1.8 m 59.07 -93.78 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.77 0.428 . . . . 10.0 112.069 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 397' ' ' GLU . . . . . 0.594 ' OE1' ' HB ' ' A' ' 396' ' ' THR . 3.5 mp0 -75.77 2.28 12.59 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.943 0.401 . . . . 10.0 111.206 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -59.17 -26.09 64.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.65 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 399' ' ' PHE . . . . . 0.418 ' HD1' ' O ' ' A' ' 396' ' ' THR . 16.7 p90 -69.16 -23.06 63.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.969 0.414 . . . . 10.0 110.76 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -76.44 -13.38 60.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.5 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -59.37 -35.99 74.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.846 0.355 . . . . 10.0 110.558 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 402' ' ' SER . . . . . 0.481 ' O ' ' HA ' ' A' ' 406' ' ' LYS . 2.3 m -78.28 -18.23 55.58 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.656 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.2 m -100.36 -32.2 10.96 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.39 0.515 . . . . 10.0 112.39 -178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 55.4 mt -87.82 -49.58 14.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 111.736 0.273 . . . . 10.0 111.736 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 405' ' ' TYR . . . . . 0.429 ' CE1' ' HA ' ' A' ' 378' ' ' GLN . 96.6 m-85 -112.14 -5.73 14.21 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.994 -0.282 . . . . 10.0 111.654 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 406' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 402' ' ' SER . 3.9 mtpp 62.71 48.64 4.14 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.825 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 407' ' ' LEU . . . . . 0.418 HD13 HD11 ' A' ' 99' ' ' ILE . 16.6 mt -109.76 152.21 25.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.071 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . 0.494 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 22.3 t0 -93.52 135.22 34.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.506 -0.315 . . . . 10.0 110.318 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.83 118.65 27.5 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.31 -0.405 . . . . 10.0 111.373 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 21.6 t -124.26 137.43 57.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.294 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 5.1 m -102.32 140.18 21.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.592 0.235 . . . . 10.0 110.619 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 91.2 t -108.44 131.77 21.55 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.63 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.5 152.56 80.57 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.63 2.22 . . . . 10.0 112.278 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 1.5 p -78.71 157.03 28.66 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.491 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -64.92 -39.27 93.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.359 0.599 . . . . 10.0 109.835 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 -124.45 157.84 63.64 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.563 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.49 122.24 10.08 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.403 2.069 . . . . 10.0 111.793 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 27.6 mtm -72.47 112.02 8.16 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.851 0.358 . . . . 10.0 111.16 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 4.0 mt -103.84 54.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.562 0.696 . . . . 10.0 109.695 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 420' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 420' ' ' ARG . 33.5 ttp180 -98.38 104.2 16.21 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.358 -0.837 . . . . 10.0 109.905 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.86 98.89 2.54 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.933 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 422' ' ' ASP . . . . . 0.411 ' OD2' ' HD2' ' A' ' 572' ' ' ARG . 26.4 m-20 -84.02 114.66 21.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.765 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 39.5 mt -98.41 155.73 36.53 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.468 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -66.86 176.73 4.11 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.929 2.419 . . . . 10.0 112.878 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -93.03 130.02 38.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.559 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 64.2 mt -101.19 93.64 5.56 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.01 0.433 . . . . 10.0 109.956 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 427' ' ' VAL . . . . . 0.507 HG22 ' HB3' ' A' ' 588' ' ' LEU . 61.8 t -84.31 125.1 40.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.71 -0.677 . . . . 10.0 111.003 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 428' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 4.6 m-85 -114.45 176.73 4.92 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.85 -0.613 . . . . 10.0 109.942 179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 2.2 mmm -78.55 -75.44 0.23 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.13 -0.228 . . . . 10.0 111.195 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 58.3 p -90.63 162.12 15.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.845 0.355 . . . . 10.0 111.353 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -61.95 -32.93 73.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.527 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 436' ' ' GLN . . . -57.32 -42.64 82.25 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.728 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -65.37 -46.94 78.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.277 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 434' ' ' LYS . . . . . 0.505 ' O ' HG13 ' A' ' 438' ' ' ILE . 4.7 ttpt -58.95 -54.14 50.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.314 -0.857 . . . . 10.0 111.129 -179.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 435' ' ' ILE . . . . . 0.558 ' O ' HG12 ' A' ' 439' ' ' ILE . 40.3 mm -60.09 -45.64 95.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.388 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 432' ' ' ALA . 0.2 OUTLIER -60.96 -37.22 81.65 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.679 -0.237 . . . . 10.0 111.218 -179.438 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.98 -36.66 83.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.087 0.47 . . . . 10.0 109.847 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 438' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 434' ' ' LYS . 79.9 mt -65.25 -46.48 90.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.753 178.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 439' ' ' ILE . . . . . 0.558 HG12 ' O ' ' A' ' 435' ' ' ILE . 42.1 mm -57.51 -41.16 78.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.497 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -66.24 -45.07 81.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.174 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.77 -39.14 87.68 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.13 0.491 . . . . 10.0 110.117 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.557 HG12 HG11 ' A' ' 452' ' ' VAL . 71.2 mt -70.83 -49.68 48.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.565 -0.743 . . . . 10.0 111.068 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -54.08 -42.6 69.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.791 -0.641 . . . . 10.0 112.081 -178.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.99 -34.6 78.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.303 0.573 . . . . 10.0 110.684 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.469 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 66.5 mtt-85 -82.19 -17.48 46.06 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.825 -179.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 1.8 m -69.25 -28.35 66.25 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -84.71 -23.66 29.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.656 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -87.36 -14.06 41.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.938 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 79.14 36.78 26.73 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.762 -0.733 . . . . 10.0 112.619 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' GLN . . . . . 0.469 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 63.7 tt0 -105.44 126.42 30.91 Favored Pre-proline 0 C--N 1.324 -0.531 0 O-C-N 122.712 -0.287 . . . . 10.0 110.542 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -65.87 136.17 44.12 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.535 2.157 . . . . 10.0 111.421 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.557 HG11 HG12 ' A' ' 442' ' ' ILE . 91.8 t -119.16 124.76 73.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.356 -0.384 . . . . 10.0 111.392 -178.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 52.5 tp -112.21 108.25 17.42 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.965 -0.562 . . . . 10.0 109.544 178.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 12.2 t -90.92 115.27 29.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.169 -0.468 . . . . 10.0 110.418 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -96.46 79.59 0.74 Allowed Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.867 -0.682 . . . . 10.0 112.294 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 6.4 p -82.43 120.43 25.45 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.386 -0.227 . . . . 10.0 110.386 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 41.9 pt -89.93 -10.28 10.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.086 0.47 . . . . 10.0 110.638 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' SER . . . . . 0.499 ' OG ' ' HB2' ' A' ' 461' ' ' LYS . 25.8 p -116.57 127.01 54.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.506 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 24.2 mt -62.68 -32.95 57.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-O 120.897 0.38 . . . . 10.0 111.02 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -62.88 -33.03 74.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.977 0.418 . . . . 10.0 110.568 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.499 ' HB2' ' OG ' ' A' ' 458' ' ' SER . 0.0 OUTLIER -83.37 -30.66 27.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.769 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 17.5 m -59.32 -46.94 87.22 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.875 0.369 . . . . 10.0 110.697 179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.74 -33.61 66.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.858 0.361 . . . . 10.0 110.376 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 46.7 tp -63.39 -53.05 58.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.69 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 8.1 p -63.56 -33.69 63.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.695 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 75.6 m -64.43 -42.22 96.15 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 120.744 0.307 . . . . 10.0 110.442 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -67.54 -40.3 85.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.33 -0.396 . . . . 10.0 110.13 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . 0.499 ' HG3' HG21 ' A' ' 435' ' ' ILE . 8.4 mm-40 -65.57 -41.66 92.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.851 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 51.8 mt -61.75 -36.69 81.75 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.9 0.381 . . . . 10.0 110.477 179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.4 m -71.01 -33.45 70.38 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.294 0.569 . . . . 10.0 109.873 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -66.28 -40.36 90.03 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.483 -0.781 . . . . 10.0 110.576 179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.94 -21.27 37.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.584 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 89.79 52.82 2.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.709 -0.758 . . . . 10.0 112.489 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 50.0 mt -124.82 127.28 72.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.722 0.296 . . . . 10.0 110.566 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' A' ' 500' ' ' VAL . 50.6 mttm -62.16 138.76 58.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.136 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 45.4 p-80 -156.88 147.54 21.56 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.882 0.372 . . . . 10.0 111.231 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -130.54 119.59 22.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.304 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.7 t -89.59 133.87 30.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.006 0.431 . . . . 10.0 111.408 -178.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 86.4 mt -84.81 83.83 7.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.263 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -78.28 113.45 16.27 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.812 -0.44 . . . . 10.0 109.812 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -62.68 -10.11 11.42 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.897 0.703 . . . . 10.0 112.897 -178.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -81.36 -10.17 59.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.985 0.422 . . . . 10.0 109.992 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -135.47 85.23 2.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.93 -0.577 . . . . 10.0 109.537 179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' HIS . . . . . 0.406 ' HA ' ' OE1' ' A' ' 487' ' ' GLU . 30.8 m170 -61.57 -32.96 73.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.259 -178.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.51 -36.03 82.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.025 0.441 . . . . 10.0 110.086 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.93 -44.06 73.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.603 -0.726 . . . . 10.0 109.462 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.406 ' OE1' ' HA ' ' A' ' 484' ' ' HIS . 37.5 mt-10 -59.73 -47.83 84.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.433 179.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -60.26 -33.96 73.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.63 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -70.52 -38.56 74.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.808 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 50.8 mt -74.84 -45.68 43.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.799 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.0 t -55.36 -34.62 34.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.138 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -57.4 -31.49 65.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.542 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -124.62 26.59 7.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.734 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -69.02 -21.25 64.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.132 0.492 . . . . 10.0 110.902 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -100.08 14.12 60.04 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.771 -0.728 . . . . 10.0 111.671 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -75.52 140.44 71.94 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.208 -0.293 . . . . 10.0 110.208 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -52.59 125.98 19.54 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.689 2.26 . . . . 10.0 113.356 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 70.78 16.52 6.69 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.449 -0.796 . . . . 10.0 112.8 178.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.23 115.29 26.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.897 0.379 . . . . 10.0 110.105 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' A' ' 475' ' ' LYS . 53.8 t -96.1 108.03 20.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.247 0.546 . . . . 10.0 110.205 179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 7.4 m -106.11 130.18 54.05 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.601 -179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 49.0 mt -109.41 119.28 58.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.2 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -109.19 130.29 55.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.87 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 7.0 m -100.72 93.58 5.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.816 0.341 . . . . 10.0 110.75 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 55.51 78.41 0.19 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.456 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 8.6 ttt -83.87 142.88 30.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.421 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -70.8 173.01 7.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.007 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -61.69 156.82 35.18 Favored Glycine 0 N--CA 1.451 -0.336 0 CA-C-N 116.144 -0.48 . . . . 10.0 113.172 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.55 HH21 ' HB2' ' A' ' 210' ' ' GLU . 75.5 mtt180 70.77 -82.05 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 123.463 0.705 . . . . 10.0 111.302 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 79.73 170.65 40.72 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 111.53 -0.628 . . . . 10.0 111.53 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.28 148.47 49.72 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.585 0.231 . . . . 10.0 110.584 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.53 90.68 4.51 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.822 -0.436 . . . . 10.0 109.822 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 70.8 mt -70.7 114.74 9.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.692 -0.685 . . . . 10.0 111.235 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 3.9 t -89.71 133.84 30.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.663 -0.698 . . . . 10.0 110.182 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 53.7 mt -64.9 131.57 47.05 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.515 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 98.13 -17.17 59.06 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 121.079 -0.582 . . . . 10.0 111.743 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 115.66 -164.38 12.2 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.0 p -135.05 101.79 4.99 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 117.061 0.431 . . . . 10.0 110.624 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 53.3 p-90 -56.28 -28.15 57.75 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.315 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -61.0 -43.32 99.05 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.055 0.455 . . . . 10.0 110.662 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -73.09 -23.03 60.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.873 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -79.49 -47.06 16.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.042 -0.527 . . . . 10.0 110.574 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . 0.449 HG12 HD12 ' A' ' 537' ' ' ILE . 34.0 m -69.4 -23.45 26.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.927 0.394 . . . . 10.0 110.848 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -78.89 -10.85 59.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.009 0.433 . . . . 10.0 110.916 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -94.25 -3.1 51.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.665 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 58.5 mt -97.19 152.28 18.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.317 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -64.64 -61.22 2.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.554 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -131.1 97.28 20.34 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 529' ' ' PRO . . . . . 0.446 ' HA ' ' OE1' ' A' ' 533' ' ' GLN . 60.7 Cg_endo -81.17 93.18 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 122.613 2.209 . . . . 10.0 112.057 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 17.5 p -71.04 168.84 16.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.448 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.92 -41.42 70.98 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.936 0.398 . . . . 10.0 111.025 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -61.01 -43.58 98.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.053 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . 0.446 ' OE1' ' HA ' ' A' ' 529' ' ' PRO . 75.0 mt-30 -65.3 -46.64 79.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.731 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.421 HG22 ' HE2' ' A' ' 538' ' ' LYS . 75.1 mt -58.85 -49.24 83.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.314 -179.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -61.98 -41.88 98.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.458 -0.337 . . . . 10.0 111.036 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 20.1 tptp -61.08 -49.05 78.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.801 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . 0.449 HD12 HG12 ' A' ' 523' ' ' VAL . 74.6 mt -63.79 -39.29 84.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.706 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . 0.421 ' HE2' HG22 ' A' ' 534' ' ' ILE . 25.1 mtmt -62.11 -39.62 93.12 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.865 0.364 . . . . 10.0 110.277 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -62.92 -44.41 96.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.225 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -67.26 -41.95 84.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.115 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 70.9 t90 -60.46 -39.63 88.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.568 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -57.5 -46.03 84.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.469 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.61 -42.06 94.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.848 -0.615 . . . . 10.0 109.883 179.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 544' ' ' ARG . . . . . 0.465 ' O ' HG23 ' A' ' 548' ' ' VAL . 31.6 mtp180 -62.41 -38.54 90.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.824 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -66.77 -47.39 72.35 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.469 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -33.4 75.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.859 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.7 99.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.926 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 548' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 544' ' ' ARG . 67.7 t -65.82 -35.14 74.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.386 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 84.0 mt -62.26 -43.64 98.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.315 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.18 -18.15 61.29 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.913 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 551' ' ' ALA . . . . . 0.458 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -80.19 -30.49 38.76 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.398 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 125.82 19.14 2.29 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.571 -0.823 . . . . 10.0 112.973 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 72.21 -163.76 54.52 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.938 -0.649 . . . . 10.0 112.505 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 51.8 tp -77.91 119.68 21.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.918 0.389 . . . . 10.0 110.336 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.4 t60 -92.51 115.54 28.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.163 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 14.8 mm -98.83 132.8 43.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.929 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 557' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.8 mt -124.21 122.72 64.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.918 0.39 . . . . 10.0 110.517 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.89 116.71 5.24 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.897 -0.668 . . . . 10.0 111.437 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 19.0 p -74.37 -43.19 57.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.125 0.488 . . . . 10.0 110.656 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . 0.43 ' OE2' ' HG2' ' A' ' 461' ' ' LYS . 19.8 mp0 -136.72 145.21 44.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.631 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 561' ' ' ARG . . . . . 0.475 ' HB2' HD22 ' A' ' 594' ' ' LEU . 88.1 mtt-85 -95.36 166.85 11.68 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.854 -0.424 . . . . 10.0 109.854 179.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 562' ' ' HIS . . . . . 0.42 ' CE1' HD12 ' A' ' 567' ' ' ILE . 46.2 t-80 -107.39 149.85 27.41 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.541 -0.54 . . . . 10.0 109.541 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -57.02 -64.98 0.7 Allowed 'General case' 0 N--CA 1.462 0.148 0 N-CA-C 109.583 -0.525 . . . . 10.0 109.583 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.75 117.45 10.48 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 108.937 -0.764 . . . . 10.0 108.937 177.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 565' ' ' ARG . . . . . 0.409 ' HB3' ' OG1' ' A' ' 396' ' ' THR . 14.2 tpt180 -61.66 -14.36 30.53 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.891 -178.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 566' ' ' ARG . . . . . 0.535 ' HG2' ' HB1' ' A' ' 394' ' ' ALA . 5.4 ttm180 -55.06 -45.41 75.32 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 121.002 0.43 . . . . 10.0 110.939 179.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 567' ' ' ILE . . . . . 0.42 HD12 ' CE1' ' A' ' 562' ' ' HIS . 61.3 mt -81.1 -31.75 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.061 0.458 . . . . 10.0 110.401 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -61.41 -51.48 68.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.135 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 569' ' ' ASN . . . . . 0.533 ' HB3' ' O ' ' A' ' 393' ' ' THR . 31.3 m-20 -65.27 -28.95 69.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.634 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -62.13 -36.75 82.74 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.214 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 40.3 tp -76.65 -35.72 57.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.377 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 572' ' ' ARG . . . . . 0.411 ' HD2' ' OD2' ' A' ' 422' ' ' ASP . 14.4 ttp180 -69.32 -30.8 68.94 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.16 0.505 . . . . 10.0 110.497 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -85.37 13.82 53.4 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 121.035 -0.602 . . . . 10.0 113.76 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 574' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 574' ' ' ARG . 3.9 mmt180 -75.46 -32.38 60.6 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 117.231 0.515 . . . . 10.0 110.279 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 4.7 t -91.03 166.63 12.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.471 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 67.16 54.02 23.01 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.724 -0.75 . . . . 10.0 112.571 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 15.2 mmt180 -69.02 117.23 10.41 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.272 -0.27 . . . . 10.0 110.272 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 578' ' ' GLN . . . . . 0.649 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 3.5 tt0 61.45 26.79 16.49 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.968 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 86.4 55.97 2.36 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.867 -0.683 . . . . 10.0 112.679 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -108.36 -169.3 1.48 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.94 -0.393 . . . . 10.0 109.94 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -95.25 150.3 20.39 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.962 0.41 . . . . 10.0 111.596 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . -178.59 -179.18 48.37 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 121.027 -0.606 . . . . 10.0 112.135 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.6 p -155.31 128.57 8.3 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.144 -0.317 . . . . 10.0 110.144 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.11 125.45 52.16 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.785 0.326 . . . . 10.0 111.147 -179.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 585' ' ' ARG . . . . . 0.43 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 2.0 tpm_? -129.69 122.51 29.11 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -113.48 149.8 33.76 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.046 0.451 . . . . 10.0 110.777 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 587' ' ' TYR . . . . . 0.494 ' CD1' HG12 ' A' ' 438' ' ' ILE . 59.9 m-85 -129.0 162.06 28.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.988 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 588' ' ' LEU . . . . . 0.507 ' HB3' HG22 ' A' ' 427' ' ' VAL . 44.6 tp -162.51 149.41 13.32 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.35 -0.386 . . . . 10.0 110.104 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 92.5 p -123.3 169.94 10.8 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.808 -0.442 . . . . 10.0 109.808 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 71.4 mmm -83.61 0.22 47.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.144 0.497 . . . . 10.0 110.075 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -100.91 -17.37 16.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.005 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -70.71 147.48 49.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.13 0.49 . . . . 10.0 111.451 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -65.12 -15.88 62.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.558 -0.746 . . . . 10.0 112.735 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.546 ' O ' HG12 ' A' ' 597' ' ' ILE . 14.5 tp -64.81 -23.15 67.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.703 0.287 . . . . 10.0 111.406 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 7.0 mmt -75.49 -2.42 28.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.725 0.298 . . . . 10.0 111.442 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -95.17 -7.66 38.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.514 -0.312 . . . . 10.0 111.37 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.546 HG12 ' O ' ' A' ' 594' ' ' LEU . 20.2 pt -79.51 -13.09 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-O 120.945 0.402 . . . . 10.0 111.298 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -84.75 50.48 1.92 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.409 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 70.6 -55.83 0.62 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.812 0.845 . . . . 10.0 111.167 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 59.4 m -155.0 137.74 15.27 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -62.88 -17.2 61.28 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 602' ' ' ARG . . . . . 0.416 ' HD2' ' O ' ' A' ' 602' ' ' ARG . 1.8 tmm_? -64.32 -35.46 80.93 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 48.5 t -71.2 -46.37 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.91 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.69 -20.03 63.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.522 -0.763 . . . . 10.0 111.213 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -62.93 -15.08 55.15 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 116.018 -0.537 . . . . 10.0 113.088 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 46.2 tpp -67.37 -21.56 65.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.095 0.474 . . . . 10.0 110.431 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 66.6 mtt -78.32 -11.24 59.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.569 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 608' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 608' ' ' ARG . 59.8 mtt-85 -69.17 -17.64 63.83 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.089 0.471 . . . . 10.0 110.298 179.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -102.74 28.37 6.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.766 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 22.6 tp -88.17 -14.59 38.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.23 0.538 . . . . 10.0 110.099 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 111.26 -48.07 0.98 Allowed Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.803 -0.635 . . . . 10.0 112.193 179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 66.98 -77.54 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.368 0.667 . . . . 10.0 111.836 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 59.86 83.98 0.2 Allowed Pre-proline 0 N--CA 1.464 0.229 0 O-C-N 123.613 0.571 . . . . 10.0 110.992 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 614' ' ' PRO . . . . . 0.453 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 31.8 Cg_exo -58.13 105.03 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.833 2.355 . . . . 10.0 112.278 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 125.0 -14.68 7.46 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 121.023 -0.608 . . . . 10.0 111.71 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -110.57 129.56 55.77 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.061 -0.348 . . . . 10.0 110.061 179.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -83.3 100.65 10.77 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.542 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 4.7 tp -66.93 -28.53 43.3 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.758 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 40.01 82.64 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.611 0.967 . . . . 10.0 113.611 178.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 40.8 m170 -119.71 100.57 48.94 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 109.966 -0.383 . . . . 10.0 109.966 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -57.48 -30.17 87.3 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 123.368 2.712 . . . . 10.0 113.752 -178.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 65.9 p-90 -63.59 -22.08 66.7 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 121.12 -0.232 . . . . 10.0 111.583 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 70.1 t -66.84 -48.7 79.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 109.704 -0.48 . . . . 10.0 109.704 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 43.8 m -60.56 -40.39 91.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.38 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -67.13 -32.34 73.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.661 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -70.8 -43.81 67.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.959 0.409 . . . . 10.0 110.126 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 67.5 mt -65.67 -45.25 92.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.289 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.36 -34.9 74.52 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.808 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -65.21 -48.8 72.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.817 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . 0.47 ' O ' HG23 ' A' ' 634' ' ' VAL . . . -65.99 -36.87 84.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.832 179.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -58.11 -44.93 87.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.066 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 632' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 632' ' ' ARG . 9.5 mtp180 -74.05 -25.46 59.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.294 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -68.62 -37.13 79.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.32 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 634' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 630' ' ' ALA . 88.5 t -57.46 -48.06 83.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 109.786 -0.45 . . . . 10.0 109.786 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -70.18 -28.18 65.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.818 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.8 m -63.48 -35.25 79.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.181 -0.674 . . . . 10.0 109.181 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -70.25 -40.96 74.11 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.359 -0.837 . . . . 10.0 109.084 178.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -66.77 -35.6 80.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.257 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -58.13 -43.88 87.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.093 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.22 -40.63 90.84 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 641' ' ' ILE . . . . . 0.444 ' O ' ' HG ' ' A' ' 645' ' ' LEU . 61.3 mt -67.77 -46.22 82.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.3 179.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 64.8 mtm-85 -58.16 -42.79 86.73 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.038 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -61.65 -45.52 93.68 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.542 -0.754 . . . . 10.0 110.73 179.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -60.9 -39.74 90.43 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.862 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 641' ' ' ILE . 85.0 mt -71.03 -40.45 71.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.675 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 646' ' ' LEU . . . . . 0.433 ' HA ' ' HB2' ' A' ' 649' ' ' ASP . 82.4 mt -67.46 -24.43 65.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.578 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 647' ' ' GLU . . . . . 0.519 ' O ' HG23 ' A' ' 651' ' ' VAL . 2.6 mm-40 -58.33 -44.68 88.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.043 178.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -77.63 -31.17 52.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.333 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 649' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 646' ' ' LEU . 88.1 m-20 -65.9 -45.43 82.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.428 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 650' ' ' ASP . . . . . 0.459 ' HA ' ' HB3' ' A' ' 653' ' ' ASN . 15.9 t70 -63.46 -28.75 70.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.51 -0.313 . . . . 10.0 111.469 -179.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 651' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 647' ' ' GLU . 53.7 t -61.25 -50.46 80.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.444 -0.576 . . . . 10.0 109.444 178.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -70.48 -27.61 64.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.991 179.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 653' ' ' ASN . . . . . 0.459 ' HB3' ' HA ' ' A' ' 650' ' ' ASP . 20.5 t30 -63.13 -52.14 63.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.395 -0.821 . . . . 10.0 111.11 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -62.03 -44.56 96.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.808 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -60.73 -42.1 96.63 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.871 0.367 . . . . 10.0 110.083 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 6.6 ttp-105 -63.75 -45.99 87.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.02 178.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 657' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 657' ' ' ARG . 13.2 ttp180 -60.09 -43.16 95.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.694 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.71 -53.84 44.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.719 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.8 tp -65.31 -32.17 57.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-O 120.655 0.264 . . . . 10.0 111.419 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -69.78 -32.41 70.89 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 110.39 -0.226 . . . . 10.0 110.39 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 49.1 m -65.62 -46.29 79.82 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -63.77 -43.78 95.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.371 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 28.3 ttt-85 -63.26 -36.73 84.63 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.521 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -66.1 -40.71 90.98 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.776 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 665' ' ' GLU . . . . . 0.405 ' O ' HG22 ' A' ' 669' ' ' VAL . 1.6 tp10 -60.67 -49.74 76.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.054 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 61.7 mt -67.32 -17.19 64.66 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.066 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 44.2 tp -83.18 -44.13 15.38 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.385 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -71.63 -47.96 51.09 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 665' ' ' GLU . 20.0 m -68.59 149.36 11.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.073 0.463 . . . . 10.0 111.566 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -42.54 9.92 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.917 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -94.99 140.86 29.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.386 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 8.6 p -135.2 11.8 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.918 -179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 8.1 m -55.18 -38.61 68.57 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.587 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -59.17 -51.74 68.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 10.0 111.219 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 675' ' ' THR . . . . . 0.504 ' O ' HG12 ' A' ' 679' ' ' ILE . 0.2 OUTLIER -63.99 -46.12 86.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.051 -179.76 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 676' ' ' ILE . . . . . 0.408 ' O ' ' HB2' ' A' ' 680' ' ' ARG . 34.0 mm -58.47 -44.2 88.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.874 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -72.52 -40.5 66.76 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.949 -0.3 . . . . 10.0 111.613 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 60.6 m -61.92 -39.43 92.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.659 -0.246 . . . . 10.0 111.464 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 679' ' ' ILE . . . . . 0.504 HG12 ' O ' ' A' ' 675' ' ' THR . 45.9 pt -83.49 -21.07 8.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 120.835 -0.346 . . . . 10.0 111.011 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 680' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 676' ' ' ILE . 30.3 ttm-85 -59.66 -51.13 71.11 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.917 0.389 . . . . 10.0 110.702 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 681' ' ' GLU . . . . . 0.425 ' HG2' ' H ' ' A' ' 681' ' ' GLU . 2.8 pt-20 -63.76 -36.38 83.69 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.057 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -66.95 -46.5 74.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.836 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 683' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 679' ' ' ILE . 72.1 t -60.09 -45.1 96.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.361 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -62.98 -45.55 91.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.308 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 34.3 tttm -58.81 -49.2 78.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.694 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -60.4 -41.04 93.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.327 -0.397 . . . . 10.0 111.402 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 25.6 m -67.87 -40.08 83.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.39 179.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 92.1 mt -68.61 -43.4 83.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.213 -0.448 . . . . 10.0 110.377 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -60.92 -19.09 60.1 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.866 0.365 . . . . 10.0 111.721 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -79.59 -21.06 45.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.736 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -117.4 -29.28 5.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.995 0.426 . . . . 10.0 110.995 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 692' ' ' ILE . . . . . 0.56 HG23 ' CD1' ' A' ' 701' ' ' TRP . 55.6 mt -124.79 106.16 29.4 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.386 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -72.72 138.74 29.61 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.701 2.267 . . . . 10.0 111.389 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 694' ' ' PRO . . . . . 0.444 ' HA ' ' OE1' ' A' ' 732' ' ' GLU . 37.4 Cg_endo -67.21 131.37 24.9 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.344 2.029 . . . . 10.0 112.891 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 64.11 41.33 6.37 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.708 -0.678 . . . . 10.0 112.03 178.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 40.4 p -107.86 -150.98 0.46 Allowed 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 96.8 mt -113.55 158.71 20.42 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.174 -0.306 . . . . 10.0 110.174 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -58.99 -36.73 75.39 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.237 0.458 . . . . 10.0 112.237 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -78.29 1.39 21.89 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.032 0.444 . . . . 10.0 111.294 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 60.9 mtt -104.38 7.05 35.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.145 0.498 . . . . 10.0 110.071 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 701' ' ' TRP . . . . . 0.56 ' CD1' HG23 ' A' ' 692' ' ' ILE . 48.7 m0 -104.5 121.49 43.58 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.909 -0.587 . . . . 10.0 111.437 -178.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -86.05 82.74 7.98 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 703' ' ' ILE . . . . . 0.477 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 39.2 mm -61.74 -48.99 88.22 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.34 -0.846 . . . . 10.0 112.009 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 704' ' ' PRO . . . . . 0.477 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 42.9 Cg_exo -58.15 -43.69 45.47 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.008 1.805 . . . . 10.0 112.425 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -62.82 -42.93 99.59 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.954 -0.641 . . . . 10.0 112.299 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 35.2 tp -69.16 -42.49 75.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.659 0.266 . . . . 10.0 110.472 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -60.97 -44.91 96.64 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.706 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.83 -41.86 99.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.785 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -64.16 -41.98 96.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.888 0.375 . . . . 10.0 110.567 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 89.9 mt -62.64 -38.96 92.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.237 0.541 . . . . 10.0 110.011 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 21.1 mtpp -86.49 13.13 8.87 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.588 -0.733 . . . . 10.0 111.349 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -125.8 -51.95 1.57 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.767 0.318 . . . . 10.0 111.511 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -98.03 -23.64 15.68 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.353 0.871 . . . . 10.0 113.353 -177.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -108.63 -6.46 15.99 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.363 -0.535 . . . . 10.0 112.204 -178.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 39.1 t70 57.01 32.92 22.51 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.596 0.713 . . . . 10.0 110.7 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 12.5 tp -120.69 117.65 28.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.171 0.51 . . . . 10.0 111.06 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -90.96 99.24 12.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.725 -0.671 . . . . 10.0 110.459 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 77.7 mt -121.97 123.06 27.46 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.832 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -85.16 73.69 4.09 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.816 2.344 . . . . 10.0 111.653 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 46.7 mt -57.81 -37.67 61.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.115 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -62.34 -29.69 70.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.799 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -81.67 -37.61 27.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.003 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 42.5 m0 -60.92 -56.72 17.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.645 -0.707 . . . . 10.0 111.233 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 18.2 tp -65.07 -24.44 67.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.041 0.448 . . . . 10.0 111.244 -179.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -66.81 -39.93 87.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.042 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 726' ' ' LYS . . . . . 0.444 ' O ' ' HD3' ' A' ' 728' ' ' PRO . 8.8 mttp -99.84 -29.51 12.56 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.446 0.536 . . . . 10.0 112.446 -178.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -114.97 87.41 15.15 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 120.719 0.295 . . . . 10.0 111.049 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . 0.504 ' HD2' ' OE1' ' A' ' 729' ' ' GLU . 10.6 Cg_exo -72.27 -22.23 22.31 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.683 2.255 . . . . 10.0 112.346 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . 0.504 ' OE1' ' HD2' ' A' ' 728' ' ' PRO . 4.0 mp0 -74.59 1.95 10.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.75 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 730' ' ' LEU . . . . . 0.421 HD21 ' NH1' ' A' ' 738' ' ' ARG . 16.4 mt -66.12 -27.34 67.97 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 56.42 -101.41 0.13 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.801 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 732' ' ' GLU . . . . . 0.444 ' OE1' ' HA ' ' A' ' 694' ' ' PRO . 8.4 tt0 -148.99 -54.31 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.924 -0.31 . . . . 10.0 111.428 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.78 -50.51 73.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.454 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.59 -35.61 74.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.559 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 4.5 tt -65.0 -43.47 92.44 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.164 -0.471 . . . . 10.0 109.898 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 736' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 736' ' ' ARG . 52.8 mtt180 -62.67 -46.75 86.72 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.115 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -63.13 -38.1 89.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.198 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 738' ' ' ARG . . . . . 0.421 ' NH1' HD21 ' A' ' 730' ' ' LEU . 21.9 mmm-85 -57.47 -49.83 75.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.853 0.359 . . . . 10.0 110.089 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 79.8 mt -57.31 -46.34 85.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.218 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 740' ' ' LEU . . . . . 0.434 ' O ' HG13 ' A' ' 744' ' ' ILE . 53.6 tp -62.0 -47.2 85.86 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.11 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -59.44 -46.71 87.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.382 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.9 -35.73 77.42 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.199 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 20.4 m -66.66 -44.84 80.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.435 179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 744' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 740' ' ' LEU . 73.1 mt -64.49 -37.65 80.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.458 . . . . 10.0 110.614 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.47 -55.66 25.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.363 -0.381 . . . . 10.0 110.611 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 85.0 t -62.23 -35.47 69.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.758 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -58.67 -49.48 77.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.463 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 748' ' ' GLN . . . . . 0.588 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 44.0 mt-30 -64.52 -35.99 82.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.493 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 64.8 mtp180 -64.68 -36.77 85.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.147 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -71.08 -37.72 72.45 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.45 -45.43 91.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.877 -1.056 . . . . 10.0 112.269 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 752' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 56.2 mt-10 -58.61 -28.7 65.86 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -178.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 17.8 t -78.74 -32.6 15.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.992 0.425 . . . . 10.0 111.147 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.9 t -86.59 -46.04 16.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.082 0.468 . . . . 10.0 110.946 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 130.78 137.78 4.17 Favored Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 111.137 -0.785 . . . . 10.0 111.137 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 756' ' ' ALA . . . . . 0.441 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -57.64 -59.26 5.47 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 757' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 757' ' ' GLU . 27.1 mp0 -63.09 -36.03 82.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.762 0.315 . . . . 10.0 111.032 -179.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 17.5 tpt -65.85 -43.86 87.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.82 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 40.3 mmm -63.03 -42.51 99.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.516 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.441 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.7 mmp_? -60.12 -39.25 85.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.249 0.547 . . . . 10.0 109.834 179.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -69.45 -38.11 77.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.685 -0.689 . . . . 10.0 109.711 178.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -64.07 -49.96 70.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.158 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -59.08 -46.12 89.1 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.213 -0.448 . . . . 10.0 110.31 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 46.1 tttp -57.44 -46.2 83.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.24 178.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -66.68 -46.04 79.19 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.832 -0.622 . . . . 10.0 112.351 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 61.6 t -59.66 -42.01 87.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.408 0.147 . . . . 10.0 110.822 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 22.7 mtp -59.94 -48.82 80.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.726 0.298 . . . . 10.0 110.427 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.99 -43.3 96.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.644 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -62.5 -48.3 80.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.312 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 8.4 m -63.0 -40.17 96.96 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.85 0.357 . . . . 10.0 110.292 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.6 tt -61.61 -46.92 87.78 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.433 -0.581 . . . . 10.0 109.433 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 772' ' ' ASP . . . . . 0.593 ' O ' ' HG2' ' A' ' 776' ' ' LYS . 0.3 OUTLIER -63.99 -43.6 95.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.796 179.613 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 42.1 m -55.86 -45.98 78.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.896 0.379 . . . . 10.0 110.844 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.24 -24.96 59.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.723 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -67.62 -38.84 84.48 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.996 -0.372 . . . . 10.0 109.996 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.593 ' HG2' ' O ' ' A' ' 772' ' ' ASP . 3.8 mmtt -62.38 -40.84 97.79 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 108.816 -0.809 . . . . 10.0 108.816 178.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 777' ' ' GLU . . . . . 0.448 ' HG2' ' HG3' ' A' ' 305' ' ' MET . 15.5 tm-20 -63.4 -53.29 54.65 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.912 -1.04 . . . . 10.0 109.374 178.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 778' ' ' HIS . . . . . 0.537 ' O ' ' HG2' ' A' ' 782' ' ' MET . 16.0 t60 -54.77 -37.27 65.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.31 -0.859 . . . . 10.0 111.86 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.16 -44.31 97.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.999 0.428 . . . . 10.0 110.361 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -75.43 -38.14 59.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.433 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.97 -42.06 93.33 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.9 -0.591 . . . . 10.0 111.281 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 782' ' ' MET . . . . . 0.537 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 97.5 mmm -60.0 -37.67 80.38 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.171 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 783' ' ' ASP . . . . . 0.424 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 9.1 t70 -71.79 -45.82 60.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.421 179.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -54.48 -42.52 70.82 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.531 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 21.9 tp -78.93 -30.97 44.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.858 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -58.5 -45.15 89.36 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.956 0.407 . . . . 10.0 110.984 -179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 787' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 6.9 pt20 -88.58 -31.8 18.44 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.749 -0.38 . . . . 10.0 110.627 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -70.61 -25.68 75.31 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.018 -0.611 . . . . 10.0 113.226 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 789' ' ' ILE . . . . . 0.403 ' HA ' ' HG3' ' A' ' 792' ' ' ARG . 6.3 tp -61.97 -17.7 18.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.805 0.336 . . . . 10.0 111.667 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -64.33 -27.14 68.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.829 0.347 . . . . 10.0 110.483 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 87.0 mt -98.38 2.22 47.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.402 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 792' ' ' ARG . . . . . 0.403 ' HG3' ' HA ' ' A' ' 789' ' ' ILE . 7.6 mtp180 -109.68 -21.06 12.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.605 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -77.6 87.44 1.03 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 121.03 -0.605 . . . . 10.0 112.199 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 8.2 p90 -79.79 -177.23 5.82 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.917 0.389 . . . . 10.0 110.874 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -75.23 156.33 35.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.583 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 67.56 34.95 4.35 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.432 0.457 . . . . 10.0 111.291 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -167.73 137.28 2.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.417 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -79.77 129.17 71.92 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.545 -0.298 . . . . 10.0 110.461 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.3 -24.09 58.39 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 123.099 2.533 . . . . 10.0 113.807 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 25.7 mtmm -82.45 -45.48 14.71 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.001 0.429 . . . . 10.0 109.95 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -62.95 -44.19 96.74 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.695 -0.684 . . . . 10.0 111.418 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -65.66 -36.55 83.99 Favored 'General case' 0 C--N 1.333 -0.129 0 N-CA-C 109.76 -0.459 . . . . 10.0 109.76 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -61.36 -47.52 85.48 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.003 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -58.3 -40.46 82.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.114 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -60.39 -53.5 56.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.33 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -60.77 -37.49 82.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.692 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 28.4 m -65.97 -36.77 84.23 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.904 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -67.37 -41.46 85.03 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 6.6 m -65.47 -38.25 89.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.204 0.526 . . . . 10.0 109.827 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 32.7 ttm -63.52 -41.85 98.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.327 179.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -65.83 -42.49 90.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.57 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.42 -46.53 89.73 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.008 0.432 . . . . 10.0 110.32 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.75 85.03 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.463 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 22.4 ttp -63.61 -40.72 97.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.098 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 96.0 mt -64.5 -40.59 95.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.523 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -65.05 -40.88 95.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.149 0.5 . . . . 10.0 110.173 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 14.4 m -68.93 -30.84 69.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.256 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 61.5 tp -63.55 -57.43 10.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.585 -0.734 . . . . 10.0 110.608 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt -61.13 -34.52 75.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.691 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -60.45 -61.44 2.6 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.582 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -66.79 -31.57 72.29 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.554 0.576 . . . . 10.0 112.554 -178.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 822' ' ' VAL . . . . . 0.442 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 14.6 t -60.22 -54.58 32.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.851 -0.34 . . . . 10.0 110.282 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 34.3 mm -66.6 -40.63 86.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.934 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 50.7 m -60.65 -50.9 71.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.005 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 93.3 m -59.6 -38.72 82.0 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.749 0.309 . . . . 10.0 111.593 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 826' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 94.6 mt -66.65 -18.27 65.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.823 0.344 . . . . 10.0 111.347 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 5.4 m -102.51 -34.1 9.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.913 0.387 . . . . 10.0 110.309 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -63.35 -23.89 67.61 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.624 -0.717 . . . . 10.0 111.722 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.82 122.33 4.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 121.586 0.708 . . . . 10.0 111.323 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -86.38 93.13 9.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.549 -0.751 . . . . 10.0 110.161 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 62.1 t -90.75 137.44 21.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.606 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 38.0 mtt180 -72.34 93.08 1.47 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.981 0.419 . . . . 10.0 110.216 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 91.4 mtp -97.26 121.81 57.7 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.966 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.76 170.06 19.71 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.678 2.252 . . . . 10.0 111.501 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -66.19 108.03 2.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.012 0.434 . . . . 10.0 111.066 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.485 -0.769 . . . . 10.0 109.84 179.474 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 110.308 -0.256 . . . . 10.0 110.308 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.68 108.58 14.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.062 0.458 . . . . 10.0 110.27 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 2.5 pt -96.83 91.66 2.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.904 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.1 95.63 4.27 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.103 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 79.9 mt -91.03 133.24 35.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.066 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.45 146.99 29.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.551 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -85.89 65.39 9.1 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.056 0.455 . . . . 10.0 110.328 179.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.74 -19.82 61.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.296 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -83.42 67.43 9.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.307 0.575 . . . . 10.0 109.853 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . 0.552 ' O ' ' HD3' ' B' ' 12' ' ' PRO . 28.4 mttt -73.33 147.68 44.19 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.223 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.29 101.1 11.82 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 120.951 0.405 . . . . 10.0 111.701 -178.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . 0.552 ' HD3' ' O ' ' B' ' 10' ' ' LYS . 8.1 Cg_endo -87.89 18.93 1.43 Allowed 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 123.052 2.502 . . . . 10.0 111.59 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -60.88 -31.79 71.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.795 -0.638 . . . . 10.0 111.555 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -33.95 76.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.969 0.414 . . . . 10.0 110.994 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 39.5 t -81.49 -33.83 12.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.519 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.11 -16.99 56.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.972 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 82.0 t -66.82 -35.25 74.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.928 0.394 . . . . 10.0 110.904 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.18 -40.32 78.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.123 0.487 . . . . 10.0 111.064 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.31 -6.89 59.21 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.685 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . 0.467 ' HA2' ' OG ' ' B' ' 23' ' ' SER . . . -62.07 -32.17 81.36 Favored Glycine 0 N--CA 1.453 -0.226 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.974 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 12.6 t -59.85 -34.7 56.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.912 0.387 . . . . 10.0 111.214 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 22.6 ttt -132.91 56.08 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.231 0.538 . . . . 10.0 110.378 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . 0.467 ' OG ' ' HA2' ' B' ' 20' ' ' GLY . 73.8 m -83.51 90.83 7.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.502 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -87.95 157.3 18.97 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.006 -0.739 . . . . 10.0 109.006 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -140.69 145.88 37.1 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.152 0.501 . . . . 10.0 111.244 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -105.34 -122.27 0.22 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.689 -0.687 . . . . 10.0 109.392 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 60.3 ttp -85.72 -31.24 22.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.881 0.372 . . . . 10.0 110.421 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.038 -0.982 . . . . 10.0 110.112 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.79 0.329 . . . . 10.0 110.245 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -81.79 124.94 30.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.84 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 136.62 150.0 5.76 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.908 -0.663 . . . . 10.0 112.444 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' HB3' ' A' ' 16' ' ' ARG . 6.0 m -63.31 148.16 49.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.906 0.384 . . . . 10.0 110.421 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.665 ' HD2' ' OD1' ' A' ' 408' ' ' ASP . 2.3 mmp_? -66.94 143.9 56.55 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.53 0.567 . . . . 10.0 112.53 -178.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.9 t30 68.33 -82.96 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 114.76 -1.109 . . . . 10.0 112.801 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -51.63 -59.64 4.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.509 0.929 . . . . 10.0 113.509 -177.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 16' ' ' ARG . 8.1 tpt180 -72.13 -41.73 66.84 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.76 0.652 . . . . 10.0 112.76 -177.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.6 p -59.44 -50.55 73.51 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 93.9 mt -64.06 -37.88 89.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.762 0.315 . . . . 10.0 111.041 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 23.6 ttp-105 -65.62 -45.12 84.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.469 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -63.58 -41.74 98.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.124 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.419 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 52.1 mtt -65.81 -34.81 79.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.618 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -61.96 -33.4 74.23 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.012 0.434 . . . . 10.0 110.135 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 19' ' ' ARG . 25.0 mtpp -66.88 -35.61 80.42 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.33 -0.618 . . . . 10.0 109.33 179.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 56.9 t -71.87 -38.83 66.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.504 -0.771 . . . . 10.0 109.476 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.574 HG13 HD12 ' A' ' 88' ' ' LEU . 59.5 t -58.49 -36.18 57.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.683 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -60.66 -38.66 85.62 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.069 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.7 mt -65.72 -43.97 93.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 65.9 mt -62.65 -36.44 75.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.503 -0.772 . . . . 10.0 110.233 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.3 m-20 -63.35 -36.27 83.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.478 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.2 -25.28 36.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.71 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 46.8 mtt -80.35 -19.05 47.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.064 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.487 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 5.8 tt0 -59.65 -55.87 41.46 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-O 119.356 -0.355 . . . . 10.0 110.973 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.487 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 27.5 Cg_exo -63.7 -19.34 67.1 Favored 'Trans proline' 0 C--N 1.359 1.09 0 C-N-CA 121.97 1.78 . . . . 10.0 111.712 179.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -74.3 -45.09 49.72 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.4 mmt -68.96 -24.02 64.21 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.357 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 96.5 mt-10 -65.06 -22.77 67.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.76 179.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.9 mttt -86.35 -6.61 58.9 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.386 0.613 . . . . 10.0 109.915 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.2 mp -98.38 141.21 31.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.383 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.8 p -74.48 170.15 16.29 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.241 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -60.23 -38.05 82.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.959 0.409 . . . . 10.0 110.846 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -68.12 -32.89 73.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.721 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -69.71 -34.34 73.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.764 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.88 -43.65 98.42 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -67.04 -32.48 73.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.093 -0.958 . . . . 10.0 109.761 178.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.5 -34.91 90.86 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.351 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -66.74 -36.88 83.49 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.3 m -60.78 -44.83 96.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.136 178.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.15 -33.85 76.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.284 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -65.16 -40.51 94.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.65 179.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.413 ' CD1' HD22 ' A' ' 63' ' ' LEU . 23.2 m-30 -61.01 -42.66 98.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.777 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.4 tpp180 -59.02 -43.12 91.53 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.016 0.436 . . . . 10.0 110.372 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.37 -41.37 76.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.891 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -61.44 -38.11 86.0 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.153 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 55.3 mt -63.22 -40.16 96.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.801 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -70.14 -31.96 69.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.539 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -69.65 -61.79 1.64 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.785 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 168.95 27.27 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.204 -0.998 . . . . 10.0 113.27 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -94.02 140.92 29.13 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 179.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.1 t -87.09 139.43 17.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.572 HD11 ' O ' ' A' ' 118' ' ' LEU . 20.6 tp -56.26 -40.75 74.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.967 0.413 . . . . 10.0 111.107 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -63.43 -21.55 66.36 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.626 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -82.31 -20.73 36.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.076 0.465 . . . . 10.0 110.358 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.413 HD22 ' CD1' ' A' ' 50' ' ' PHE . 90.6 mt -82.15 -9.32 59.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.625 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.538 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 76.8 mt -49.43 -53.4 40.72 Favored Pre-proline 0 CA--C 1.542 0.645 0 N-CA-C 113.013 0.746 . . . . 10.0 113.013 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.538 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 33.5 Cg_exo -58.95 -49.83 10.4 Favored 'Trans proline' 0 C--N 1.355 0.919 0 C-N-CA 121.963 1.776 . . . . 10.0 113.204 -179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.442 ' O ' HG23 ' A' ' 70' ' ' VAL . 48.6 mt-10 -69.61 -43.8 72.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.335 -0.393 . . . . 10.0 111.955 -178.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.42 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -64.9 -47.56 77.36 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.002 0.371 . . . . 10.0 112.002 -178.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -61.5 -34.03 74.8 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.7 -0.227 . . . . 10.0 110.663 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.58 -43.98 88.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.372 179.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 66' ' ' GLU . 95.5 t -61.59 -47.44 93.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.024 -0.534 . . . . 10.0 110.265 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 67' ' ' ALA . 48.2 t -61.58 -42.52 94.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.442 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -59.82 -46.22 89.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.488 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.3 tp10 -64.17 -44.25 92.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.383 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.46 -33.39 72.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.374 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.5 m -63.76 -37.11 86.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.38 179.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.6 mtmm -72.33 -12.51 61.17 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.83 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -110.89 -39.32 4.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -178.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 62.0 t -82.07 -45.09 20.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.957 0.408 . . . . 10.0 111.702 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -101.21 -27.88 12.96 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.854 0.359 . . . . 10.0 111.212 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.11 4.63 81.35 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.017 -0.611 . . . . 10.0 111.784 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 18.0 mtt -117.27 139.94 50.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.587 -0.523 . . . . 10.0 109.587 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.434 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 8.5 ttp180 -85.66 138.05 32.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.815 0.34 . . . . 10.0 110.711 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.41 114.31 5.33 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 178.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -55.56 152.52 8.98 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 123.596 0.56 . . . . 10.0 112.022 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.75 -40.17 96.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.975 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.9 m -68.29 -27.33 36.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 10.0 111.084 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.463 HE22 HD23 ' A' ' 110' ' ' LEU . 96.7 mt-30 -70.96 -30.29 66.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.221 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.574 HD12 HG13 ' A' ' 25' ' ' VAL . 86.9 mt -65.22 -36.21 83.45 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.466 ' O ' HG23 ' A' ' 93' ' ' VAL . 82.2 mt -65.19 -50.57 65.41 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.835 -0.621 . . . . 10.0 109.719 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -60.88 -42.09 99.5 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.666 -0.697 . . . . 10.0 112.089 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -66.44 -32.2 81.1 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.886 -0.673 . . . . 10.0 112.079 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.419 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 13.9 ttm -71.27 -36.09 71.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.846 0.355 . . . . 10.0 110.424 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 89' ' ' LEU . 76.5 t -65.82 -33.78 65.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.223 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.1 mt -73.76 -2.27 22.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.702 -0.681 . . . . 10.0 112.13 -179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -80.5 -28.03 37.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.207 0.527 . . . . 10.0 109.988 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -103.73 175.43 5.48 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.668 -0.697 . . . . 10.0 110.167 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 43.1 ttt85 -78.49 77.83 4.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.888 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 408' ' ' ASP . 0.4 OUTLIER -152.0 159.85 43.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.099 0.476 . . . . 10.0 111.582 -179.676 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.577 HD12 HG11 ' A' ' 211' ' ' VAL . 49.9 mm -100.12 134.64 39.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.713 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.84 111.95 23.69 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.851 0.358 . . . . 10.0 111.287 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -86.99 117.11 25.49 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 44.7 mtt -111.59 177.67 4.58 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.281 0.562 . . . . 10.0 111.495 -178.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.466 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 9.2 mmm180 -108.73 142.71 38.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.312 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.63 110.0 2.6 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.771 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.445 ' O ' ' HG2' ' A' ' 578' ' ' GLN . . . 127.17 -23.36 5.51 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.856 -0.687 . . . . 10.0 112.535 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -75.85 -41.06 53.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.939 0.4 . . . . 10.0 110.834 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 155.27 150.38 5.56 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.971 -0.633 . . . . 10.0 111.63 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.416 ' HE2' ' HA ' ' A' ' 108' ' ' LYS . 0.3 OUTLIER -121.55 -80.43 0.62 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.777 0.289 . . . . 10.0 110.687 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.74 -24.64 38.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.061 0.457 . . . . 10.0 110.675 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.463 HD23 HE22 ' A' ' 87' ' ' GLN . 45.9 tp -63.14 -25.29 68.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.323 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.96 -20.99 26.5 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.23 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -83.06 -8.84 59.49 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.435 0.531 . . . . 10.0 112.435 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 11.5 p -67.1 -33.36 75.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.768 0.318 . . . . 10.0 111.793 -179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.403 ' HB2' ' CD ' ' A' ' 115' ' ' PRO . 26.3 mt -65.71 -57.6 13.74 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.929 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.403 ' CD ' ' HB2' ' A' ' 114' ' ' LEU . 33.2 Cg_endo -63.13 -32.28 74.83 Favored 'Trans proline' 0 C--N 1.357 0.977 0 C-N-CA 121.935 1.757 . . . . 10.0 111.959 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.98 -52.88 45.57 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.689 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.413 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 63.6 t80 -59.92 -44.55 94.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.865 0.364 . . . . 10.0 110.633 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.572 ' O ' HD11 ' A' ' 60' ' ' LEU . 36.6 tp -59.44 -54.74 43.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.462 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -69.94 -23.29 63.18 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.876 0.324 . . . . 10.0 111.876 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.48 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -67.28 -26.19 66.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.019 0.438 . . . . 10.0 110.882 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 63.5 mt -60.81 -25.55 66.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.382 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.7 p -70.17 -19.32 63.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.864 0.364 . . . . 10.0 111.089 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 72.45 12.09 76.84 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 121.048 -0.596 . . . . 10.0 112.711 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 2.1 mmpp? -85.28 -21.99 28.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.688 0.28 . . . . 10.0 111.034 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.39 115.23 3.78 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.554 -0.831 . . . . 10.0 112.962 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.408 HG13 ' CD2' ' A' ' 205' ' ' TYR . 96.4 t -83.78 112.18 20.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.598 -0.519 . . . . 10.0 109.598 178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 19.0 m170 -86.87 96.43 10.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.799 0.333 . . . . 10.0 110.387 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.5 t -86.1 120.34 35.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.127 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 26.0 t -98.88 113.58 34.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.326 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.36 151.8 21.84 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.99 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.412 ' H ' HG22 ' A' ' 131' ' ' VAL . 0.6 OUTLIER -69.06 -49.15 65.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.353 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -126.96 157.6 39.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.421 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.08 -17.77 63.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.703 -178.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -68.51 -55.44 11.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.837 0.351 . . . . 10.0 110.559 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.6 mt -65.68 -31.94 73.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.69 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.05 -44.62 74.9 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.866 -0.607 . . . . 10.0 111.118 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -80.7 -40.45 25.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.792 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -52.55 -61.37 2.32 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.922 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -70.11 -27.3 64.48 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.259 -0.428 . . . . 10.0 112.073 -178.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.61 -50.49 64.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.949 0.404 . . . . 10.0 110.494 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -71.17 -33.21 69.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.052 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -70.88 -36.69 72.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.569 -0.287 . . . . 10.0 111.658 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -92.69 -3.12 55.4 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.027 -0.269 . . . . 10.0 111.559 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.486 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 63.2 ttm-85 -59.77 -49.16 93.05 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-O 119.293 -0.384 . . . . 10.0 111.877 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' PRO . . . . . 0.559 ' O ' ' HB2' ' A' ' 149' ' ' PHE . 29.2 Cg_exo -63.15 -9.12 16.03 Favored 'Trans proline' 0 C--N 1.361 1.204 0 C-N-CA 122.228 1.952 . . . . 10.0 112.692 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.5 tp -93.09 -52.39 4.59 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.018 0.437 . . . . 10.0 110.245 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -72.24 -45.5 59.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.888 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -67.0 -23.29 65.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.764 0.316 . . . . 10.0 110.971 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.559 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 29.7 t80 -68.29 -26.11 65.48 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.751 -0.463 . . . . 10.0 109.751 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 54.2 mt -94.5 -1.0 54.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.637 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 97.62 1.8 58.83 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.819 -0.705 . . . . 10.0 113.447 178.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 28.8 mt -80.9 140.79 35.12 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.057 0.429 . . . . 10.0 110.794 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.86 123.95 34.26 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.754 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 56.7 t -104.95 119.78 54.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.574 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -115.51 146.87 18.89 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.652 -0.785 . . . . 10.0 112.201 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.5 tp -119.99 127.4 75.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.038 0.447 . . . . 10.0 110.45 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -108.46 105.83 15.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.137 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 161' ' ' MET . 86.1 mt -96.65 146.68 31.73 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.897 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' PRO . . . . . 0.494 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 27.5 Cg_endo -62.37 116.96 3.84 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.856 2.371 . . . . 10.0 112.355 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 96.21 6.19 59.01 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.749 -0.739 . . . . 10.0 112.825 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . 0.449 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.5 OUTLIER -67.97 150.09 97.92 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.539 0.17 . . . . 10.0 110.612 179.679 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -63.52 152.53 79.75 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.628 2.219 . . . . 10.0 112.14 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . 0.527 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.46 -50.92 80.29 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 113.12 0.785 . . . . 10.0 113.12 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.527 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 52.7 Cg_exo -57.03 -44.59 42.92 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 122.029 1.819 . . . . 10.0 112.416 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.12 -41.89 97.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.848 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.44 ' HZ2' ' CG ' ' A' ' 185' ' ' ASP . 54.4 mttm -63.91 -41.38 97.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.955 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' ARG . . . . . 0.43 ' HG2' ' HA ' ' A' ' 199' ' ' VAL . 64.3 mtt180 -58.35 -36.8 74.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.285 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -70.5 -38.79 74.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.962 0.41 . . . . 10.0 110.26 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.02 -44.19 85.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.524 -0.762 . . . . 10.0 111.11 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 41.7 m-85 -73.76 -28.2 61.55 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.307 -0.406 . . . . 10.0 111.036 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -76.27 -10.3 59.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.753 0.311 . . . . 10.0 111.274 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -75.12 174.67 9.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.615 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . 0.48 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 9.4 m-20 -75.44 -38.55 59.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.12 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 66.4 mt -130.84 125.95 59.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.006 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.9 m -115.5 117.21 29.74 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.917 0.389 . . . . 10.0 111.626 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -96.06 131.21 42.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.998 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -166.43 173.66 41.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.284 -0.96 . . . . 10.0 112.768 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.17 153.54 20.87 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 122.214 0.205 . . . . 10.0 111.074 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -61.48 -36.59 80.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.684 -179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -63.23 -56.44 16.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.44 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.494 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.5 tp10 -62.81 -37.85 88.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.238 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.67 -34.69 71.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.767 0.318 . . . . 10.0 110.993 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -81.21 -40.3 11.58 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.92 -0.657 . . . . 10.0 111.835 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -64.38 -36.09 83.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.826 0.346 . . . . 10.0 110.75 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . 0.44 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 29.8 m-20 -61.42 -40.74 95.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.333 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -61.53 -38.12 86.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.418 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 54.8 mt -67.24 -41.68 85.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.554 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 72.9 mtm-85 -67.61 -41.71 83.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.951 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.39 -23.79 67.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.19 0.519 . . . . 10.0 111.264 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -90.95 1.66 56.86 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.966 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 66.6 mtp -108.88 -7.11 15.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.736 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -62.42 160.52 13.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.061 -0.518 . . . . 10.0 111.621 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -110.8 -14.9 13.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.281 0.563 . . . . 10.0 109.932 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -129.24 138.15 32.54 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.464 -0.789 . . . . 10.0 109.481 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -58.3 -29.97 89.57 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 122.639 2.226 . . . . 10.0 112.743 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -70.77 -16.09 62.73 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.662 0.245 . . . . 10.0 111.662 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -76.36 -15.96 59.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.668 -0.242 . . . . 10.0 111.549 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 75.1 mtt180 -57.88 134.82 56.65 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.959 0.409 . . . . 10.0 111.521 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 199' ' ' VAL . . . . . 0.43 ' HA ' ' HG2' ' A' ' 167' ' ' ARG . 20.5 m -108.07 -20.49 6.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.496 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -89.47 -178.61 5.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.209 0.528 . . . . 10.0 111.729 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -137.73 -179.02 5.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.588 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -52.91 133.56 37.8 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.432 0.635 . . . . 10.0 112.351 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 17.3 mt -87.55 61.99 6.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.473 -0.785 . . . . 10.0 110.034 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -80.06 -50.08 10.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.337 0.495 . . . . 10.0 112.337 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' TYR . . . . . 0.408 ' CD2' HG13 ' A' ' 126' ' ' VAL . 33.3 t80 -131.22 138.02 49.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.993 0.425 . . . . 10.0 111.701 -178.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.608 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -134.53 125.28 27.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.697 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 30.5 tp -122.68 108.57 13.23 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.877 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.4 p -96.04 129.87 45.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.207 0.527 . . . . 10.0 110.836 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -58.81 -55.9 29.16 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.377 -0.829 . . . . 10.0 111.981 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' GLU . . . . . 0.468 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 23.0 tt0 -126.27 114.72 18.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.867 0.365 . . . . 10.0 110.924 -179.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.577 HG11 HD12 ' A' ' 99' ' ' ILE . 25.5 m -85.22 -9.56 11.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.792 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . 0.424 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 10.0 t70 -52.97 -68.07 0.2 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.363 -0.835 . . . . 10.0 110.99 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 7.8 p -82.4 -50.8 8.49 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.996 -0.547 . . . . 10.0 112.119 -179.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 69.2 mt -55.52 -41.71 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 114.37 1.248 . . . . 10.0 114.37 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 10.8 mt -97.76 -51.95 3.91 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.614 0.968 . . . . 10.0 113.614 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 216' ' ' ILE . . . . . 0.424 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 47.0 mm -70.76 -56.24 11.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 113.387 0.884 . . . . 10.0 113.387 -177.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -74.49 -41.24 61.07 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.87 0.693 . . . . 10.0 112.87 -177.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -91.11 28.21 1.67 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 111.88 0.326 . . . . 10.0 111.88 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -66.78 -52.61 42.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.015 0.436 . . . . 10.0 111.907 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 220' ' ' ARG . . . . . 0.431 ' O ' ' HD3' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -94.74 16.73 15.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.325 -178.419 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 90.1 m -79.82 116.92 64.51 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 120.819 0.342 . . . . 10.0 110.298 179.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -92.33 141.49 2.29 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 123.022 2.481 . . . . 10.0 113.065 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 223' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.71 112.95 25.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.528 178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 53.3 mt -115.16 124.43 71.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.405 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 6.5 pt -82.75 173.06 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.229 -0.442 . . . . 10.0 110.974 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 1.4 p -82.63 156.7 23.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.14 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -152.52 157.19 27.14 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 121.291 -0.48 . . . . 10.0 112.042 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -80.14 -23.73 6.21 Favored 'Trans proline' 0 CA--C 1.531 0.365 0 C-N-CA 122.616 2.211 . . . . 10.0 113.885 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -161.77 -168.19 1.89 Allowed 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.872 0.368 . . . . 10.0 111.568 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . 0.405 ' CD ' ' HB3' ' A' ' 369' ' ' ASN . 30.7 tt0 -147.23 145.54 29.49 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.149 -0.686 . . . . 10.0 109.149 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 8.5 t70 58.75 -110.87 0.52 Allowed 'General case' 0 N--CA 1.465 0.308 0 O-C-N 123.625 0.578 . . . . 10.0 110.274 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 5.2 p -173.04 115.58 0.27 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 120.91 0.386 . . . . 10.0 110.708 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.0 -32.47 66.16 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.119 -0.492 . . . . 10.0 111.347 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -63.18 -33.79 76.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.305 0.574 . . . . 10.0 110.461 179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.39 -41.23 80.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.487 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . 0.438 ' HA ' HG12 ' A' ' 239' ' ' VAL . 60.4 m-85 -67.79 -48.48 66.18 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.406 0.521 . . . . 10.0 112.406 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 237' ' ' LYS . . . . . 0.478 ' O ' ' HD3' ' A' ' 241' ' ' LYS . 8.3 ptmm? -63.63 -27.24 69.1 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.914 -0.315 . . . . 10.0 111.573 -178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 35.7 ttp85 -88.11 -40.33 13.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.643 0.258 . . . . 10.0 111.205 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 239' ' ' VAL . . . . . 0.528 HG11 ' HB3' ' A' ' 309' ' ' HIS . 2.6 p -67.27 -27.82 40.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 111.722 0.267 . . . . 10.0 111.722 -178.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -77.95 -14.6 59.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.43 0.633 . . . . 10.0 110.126 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 241' ' ' LYS . . . . . 0.478 ' HD3' ' O ' ' A' ' 237' ' ' LYS . 11.7 mptt -97.67 19.17 14.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.43 -179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 242' ' ' ILE . . . . . 0.483 ' C ' ' HD3' ' A' ' 244' ' ' PRO . 11.3 tt -88.51 -5.69 10.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.596 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 243' ' ' ILE . . . . . 0.437 HG23 HD12 ' A' ' 246' ' ' LEU . 54.3 mt -117.67 74.25 8.98 Favored Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.177 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 244' ' ' PRO . . . . . 0.483 ' HD3' ' C ' ' A' ' 242' ' ' ILE . 93.4 Cg_endo -104.46 7.15 0.3 Allowed 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 123.132 2.554 . . . . 10.0 114.212 -179.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.24 15.12 0.9 Allowed 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.872 0.693 . . . . 10.0 112.872 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 246' ' ' LEU . . . . . 0.437 HD12 HG23 ' A' ' 243' ' ' ILE . 62.5 mt -99.21 153.7 18.72 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.501 -0.48 . . . . 10.0 110.691 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 10.7 pt -121.42 165.93 16.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.36 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 3.5 ptt180 -78.66 8.94 4.55 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -88.94 -29.39 19.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.891 0.377 . . . . 10.0 110.446 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 250' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 251' ' ' LYS . 13.8 tt0 -167.4 159.55 12.55 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 250' ' ' GLU . 0.4 OUTLIER 79.2 179.08 0.11 Allowed 'General case' 0 C--O 1.234 0.278 0 O-C-N 124.276 0.985 . . . . 10.0 110.075 -179.119 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 252' ' ' GLU . . . . . 0.417 ' HG2' ' HG ' ' A' ' 285' ' ' LEU . 16.4 mp0 -64.75 97.88 0.24 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.124 0.787 . . . . 10.0 113.124 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -163.4 -45.33 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.62 -1.173 . . . . 10.0 108.28 178.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.08 -179.61 4.45 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.131 -0.94 . . . . 10.0 110.82 179.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . 0.514 ' HG2' HG22 ' A' ' 256' ' ' THR . 0.0 OUTLIER -86.06 -35.03 20.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.068 0.461 . . . . 10.0 110.613 -179.464 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 256' ' ' THR . . . . . 0.514 HG22 ' HG2' ' A' ' 255' ' ' GLU . 14.6 t -162.56 -42.41 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 10.0 109.844 179.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 1.5 t80 59.98 -73.14 0.03 OUTLIER 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.795 0.838 . . . . 10.0 112.225 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 62.31 -170.29 0.17 Allowed 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.051 0.54 . . . . 10.0 110.441 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -85.64 -21.44 53.7 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.56 -0.828 . . . . 10.0 111.421 179.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.85 -53.31 13.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.525 -0.337 . . . . 10.0 110.939 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 77.56 -168.6 54.46 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.755 -0.736 . . . . 10.0 111.483 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -130.61 -92.47 0.42 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.889 0.345 . . . . 10.0 110.112 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -153.79 168.46 26.23 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.643 -0.503 . . . . 10.0 109.643 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 3.0 m -83.65 -9.68 58.71 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.021 0.438 . . . . 10.0 110.082 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.59 -62.64 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.183 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.923 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -140.01 88.27 2.22 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.787 -0.82 . . . . 10.0 108.787 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.94 -47.57 77.2 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.802 -0.635 . . . . 10.0 110.752 -178.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 268' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.62 104.67 0.45 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.578 -0.737 . . . . 10.0 110.637 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 4.8 m -93.78 127.22 39.39 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.856 -179.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 27.0 ttp180 -96.31 78.61 3.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.294 0.569 . . . . 10.0 110.933 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -121.87 133.8 54.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.745 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 41.4 t -79.25 89.48 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.036 0.446 . . . . 10.0 110.512 -179.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -168.34 -35.42 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.35 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 1.1 tp 69.87 -156.76 0.15 Allowed 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.477 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 6.5 t -132.7 -176.7 4.19 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.628 0.252 . . . . 10.0 110.723 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -164.7 -35.91 0.03 OUTLIER 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.883 -0.598 . . . . 10.0 110.446 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 1.9 mmt180 -79.74 66.34 5.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.085 -0.507 . . . . 10.0 112.006 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . -95.79 -38.28 4.71 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.804 -0.712 . . . . 10.0 111.855 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 279' ' ' LEU . 2.7 mm? 55.91 -95.05 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.355 0.662 . . . . 10.0 112.36 179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 11.5 p -70.73 -24.09 24.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 111.778 0.288 . . . . 10.0 111.778 -178.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 83.9 mt -64.95 -63.0 1.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.913 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 24.2 pt -59.39 -19.98 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.048 -0.524 . . . . 10.0 111.99 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -70.71 -25.03 62.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.922 0.391 . . . . 10.0 110.305 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -89.68 -26.48 20.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.417 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 285' ' ' LEU . . . . . 0.417 ' HG ' ' HG2' ' A' ' 252' ' ' GLU . 1.6 tm? -70.33 -34.82 73.12 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 178.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 286' ' ' LEU . . . . . 0.426 ' HG ' ' N ' ' A' ' 287' ' ' VAL . 34.3 tp -64.31 165.49 9.49 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.521 179.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 287' ' ' VAL . . . . . 0.426 ' N ' ' HG ' ' A' ' 286' ' ' LEU . 33.0 t 71.37 161.02 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 109.974 -0.38 . . . . 10.0 109.974 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 288' ' ' LYS . . . . . 0.416 ' N ' HG12 ' A' ' 287' ' ' VAL . 0.0 OUTLIER 81.25 158.94 0.15 Allowed 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.798 0.839 . . . . 10.0 110.901 179.806 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 73.92 166.2 0.29 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.339 -0.846 . . . . 10.0 111.607 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 290' ' ' GLY . . . . . 0.471 ' O ' ' HB ' ' A' ' 291' ' ' ILE . . . -82.49 159.36 38.57 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.999 -0.619 . . . . 10.0 112.886 -178.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 291' ' ' ILE . . . . . 0.471 ' HB ' ' O ' ' A' ' 290' ' ' GLY . 78.8 mt 79.35 -47.26 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 123.611 0.764 . . . . 10.0 110.425 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 41.4 ttp -93.95 17.82 11.6 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.199 -1.037 . . . . 10.0 108.199 177.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -77.87 -8.7 58.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.542 -1.208 . . . . 10.0 111.517 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -89.21 176.5 6.93 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.867 0.365 . . . . 10.0 110.739 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -84.62 69.49 3.32 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 121.203 -0.523 . . . . 10.0 112.815 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -125.13 173.42 8.75 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.153 -0.314 . . . . 10.0 110.153 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 21.0 m -112.39 159.23 18.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.47 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 15.9 tp -85.36 -21.52 28.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.351 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -92.5 5.85 49.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.726 0.298 . . . . 10.0 111.614 -179.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 10.0 m -69.18 141.38 91.53 Favored Pre-proline 0 C--N 1.326 -0.446 0 N-CA-C 110.042 -0.355 . . . . 10.0 110.042 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.44 -27.93 85.78 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.649 2.233 . . . . 10.0 111.885 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 302' ' ' ALA . . . . . 0.4 ' HA ' ' HG3' ' A' ' 810' ' ' MET . . . -84.75 -4.19 58.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.982 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -122.32 17.86 10.63 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.404 0.621 . . . . 10.0 110.194 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 9.6 tp -63.71 -25.22 37.73 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.313 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.0 tmm? -63.77 -47.27 81.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.895 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 306' ' ' LEU . . . . . 0.434 ' O ' ' HB2' ' A' ' 309' ' ' HIS . 14.7 tp -70.59 -38.03 73.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.218 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 13.4 tpt -61.42 -42.46 98.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.185 0.517 . . . . 10.0 109.889 178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -67.47 -24.09 65.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.294 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 309' ' ' HIS . . . . . 0.528 ' HB3' HG11 ' A' ' 239' ' ' VAL . 35.5 m170 -71.05 -49.56 43.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.368 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 33.6 m -69.15 -25.78 30.48 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.103 0 CA-C-O 120.798 0.333 . . . . 10.0 110.735 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 88.9 m -62.88 -40.27 97.01 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 312' ' ' ALA . . . . . . . . . . . . . . . -70.72 -39.58 73.3 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.343 179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 313' ' ' ALA . . . . . 0.405 ' O ' ' HB2' ' A' ' 317' ' ' HIS . . . -63.0 -38.25 90.45 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.744 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 19.4 tp -73.4 -34.68 65.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.369 0.604 . . . . 10.0 109.652 178.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 315' ' ' ARG . . . . . 0.702 ' O ' ' HB2' ' A' ' 319' ' ' LEU . 21.1 ttp180 -64.66 -42.34 95.47 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.173 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -88.3 20.57 3.21 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.103 0.478 . . . . 10.0 110.431 179.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 317' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 313' ' ' ALA . 1.7 t60 -108.06 -59.21 1.88 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.322 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -110.8 -21.32 12.12 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.287 0.477 . . . . 10.0 112.287 -179.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 319' ' ' LEU . . . . . 0.702 ' HB2' ' O ' ' A' ' 315' ' ' ARG . 3.9 mm? -78.75 -55.66 5.0 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.944 0.402 . . . . 10.0 110.285 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -99.56 113.55 26.02 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.277 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.73 142.31 30.45 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.537 0.684 . . . . 10.0 111.726 -179.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 322' ' ' ARG . . . . . 0.479 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 4.0 tpt180 -65.49 139.05 58.46 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.35 -0.841 . . . . 10.0 111.616 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 323' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 97.2 m-20 83.77 -29.21 0.09 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.311 1.044 . . . . 10.0 113.189 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 2.3 p -103.3 -44.71 9.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 120.705 -0.398 . . . . 10.0 111.574 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -87.57 -40.65 14.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.444 0.64 . . . . 10.0 110.367 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 54.7 p90 -143.36 147.69 35.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.699 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 5.8 tp -123.08 113.96 40.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.336 0.588 . . . . 10.0 110.253 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 328' ' ' VAL . . . . . 0.413 HG21 ' HG3' ' A' ' 361' ' ' GLU . 21.2 t -90.73 99.27 9.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.795 -0.638 . . . . 10.0 109.489 179.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 329' ' ' LYS . . . . . 0.445 ' O ' ' HD3' ' A' ' 329' ' ' LYS . 0.0 OUTLIER -117.15 131.14 56.95 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.818 -178.884 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 2.6 p30 42.61 42.24 2.74 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.092 0.957 . . . . 10.0 113.352 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 88.98 -10.64 72.04 Favored Glycine 0 C--N 1.33 0.211 0 C-N-CA 120.836 -0.697 . . . . 10.0 114.531 177.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -103.82 130.6 51.4 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 117.618 0.709 . . . . 10.0 111.072 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 47.2 t -96.03 102.65 13.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.076 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 43.9 mt -98.56 130.8 46.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.419 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 27.6 mt -83.52 135.31 25.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.4 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 16.3 t -108.57 129.12 63.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.857 0.36 . . . . 10.0 110.304 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -77.33 125.94 30.13 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.387 -0.369 . . . . 10.0 110.537 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -69.2 -30.49 68.69 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.947 0.403 . . . . 10.0 111.12 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -73.7 -65.5 0.82 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -177.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.25 -27.48 26.0 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.716 0.636 . . . . 10.0 112.716 -177.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 77.45 44.82 12.13 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.319 -0.943 . . . . 10.0 112.157 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.9 mmt85 -118.91 144.55 46.35 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.099 -0.334 . . . . 10.0 110.099 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.92 115.8 20.58 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.873 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 72.6 mtm -113.46 95.84 5.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.982 0.42 . . . . 10.0 110.911 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -81.47 -27.87 34.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.0 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -84.65 49.15 4.19 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.984 -0.627 . . . . 10.0 112.358 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -139.64 126.39 20.66 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 348' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 348' ' ' ARG . 0.6 OUTLIER -126.73 111.72 14.58 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.768 0.318 . . . . 10.0 110.914 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 75.3 m95 -88.42 139.06 30.87 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.764 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.99 -162.41 0.6 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.408 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 4.2 t70 61.65 16.59 7.88 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.276 0.631 . . . . 10.0 111.439 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 67.8 26.27 73.9 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 116.013 -0.539 . . . . 10.0 113.119 179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 50.8 tp -59.35 -52.48 65.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.846 0.323 . . . . 10.0 111.271 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 354' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -78.87 -12.85 60.04 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.827 -0.349 . . . . 10.0 111.267 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 355' ' ' GLN . . . . . 0.447 ' CD ' ' HA ' ' A' ' 368' ' ' GLU . 1.2 mp0 -66.27 -42.92 87.79 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.035 0.445 . . . . 10.0 110.22 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -69.5 -33.53 72.97 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.131 179.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 94.6 t -62.19 -47.96 90.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.075 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -65.63 -31.93 73.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.924 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -80.51 -20.74 42.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.603 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -89.57 -47.18 8.14 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.914 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 361' ' ' GLU . . . . . 0.413 ' HG3' HG21 ' A' ' 328' ' ' VAL . 49.6 mm-40 -77.21 168.93 19.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.322 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -81.33 70.4 3.1 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.26 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -149.0 -176.41 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 122.398 0.279 . . . . 10.0 110.363 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -103.16 148.02 26.29 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.754 -0.461 . . . . 10.0 109.754 179.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 365' ' ' ILE . . . . . . . . . . . . . 72.1 mt -74.11 142.37 14.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.244 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -75.13 -163.26 0.22 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.384 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -74.61 8.05 2.6 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.201 -0.454 . . . . 10.0 112.049 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 368' ' ' GLU . . . . . 0.447 ' HA ' ' CD ' ' A' ' 355' ' ' GLN . 37.9 mt-10 59.94 -96.48 0.06 Allowed 'General case' 0 C--O 1.236 0.384 0 C-N-CA 123.141 0.576 . . . . 10.0 112.494 179.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.405 ' HB3' ' CD ' ' A' ' 230' ' ' GLU . 55.9 t30 -146.44 -123.44 0.07 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 121.15 -0.22 . . . . 10.0 111.118 -179.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -173.06 104.95 0.14 Allowed 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 117.788 0.267 . . . . 10.0 111.469 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 46.5 m -159.6 119.52 2.99 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.833 0.349 . . . . 10.0 111.199 179.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -138.82 -67.35 0.46 Allowed 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.836 178.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -138.1 147.99 44.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.074 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 374' ' ' SER . . . . . . . . . . . . . 18.9 m -153.82 153.21 31.71 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.42 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.5 tt -146.45 146.22 19.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 120.754 0.311 . . . . 10.0 110.534 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.71 142.03 28.17 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -56.39 -52.3 65.13 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 111.818 0.303 . . . . 10.0 111.818 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -56.05 -41.84 75.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.069 0.462 . . . . 10.0 110.62 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -69.68 -21.19 63.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.693 -0.685 . . . . 10.0 111.577 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 43.3 t80 -82.04 -42.71 18.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.857 0.36 . . . . 10.0 110.268 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -70.24 -17.77 63.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.312 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -78.26 -7.48 57.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.378 -0.374 . . . . 10.0 110.835 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 25.5 mt -89.25 -2.86 58.64 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.548 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.608 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 43.9 m-85 -96.48 137.79 35.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.793 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -70.64 -74.04 0.15 Allowed 'General case' 0 C--O 1.238 0.452 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.169 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -88.86 98.51 11.77 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.432 HD23 HD21 ' A' ' 407' ' ' LEU . 56.2 tp -109.08 111.48 23.14 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.019 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -124.57 154.78 40.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.987 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -156.02 158.49 28.64 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.21 -0.995 . . . . 10.0 112.573 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 24.5 mtm -115.71 160.88 19.5 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.684 0.278 . . . . 10.0 110.419 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 391' ' ' THR . . . . . 0.576 ' HB ' HG22 ' A' ' 211' ' ' VAL . 6.6 t -164.31 169.79 17.01 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.111 178.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -93.71 166.21 27.58 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.832 -0.907 . . . . 10.0 110.832 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 393' ' ' THR . . . . . 0.466 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 0.2 OUTLIER -60.77 102.55 0.2 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.558 0.218 . . . . 10.0 110.594 179.719 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -141.79 -29.26 0.62 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.546 0.572 . . . . 10.0 112.546 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 38.8 t70 55.76 -119.63 1.41 Allowed 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 110.12 -0.326 . . . . 10.0 110.12 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 396' ' ' THR . . . . . 0.48 ' HB ' ' OE1' ' A' ' 397' ' ' GLU . 2.3 m 51.99 -100.9 0.1 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.97 0.73 . . . . 10.0 112.97 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 397' ' ' GLU . . . . . 0.48 ' OE1' ' HB ' ' A' ' 396' ' ' THR . 3.7 mp0 -76.91 9.8 2.68 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.283 0.475 . . . . 10.0 112.283 -178.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -58.8 -30.5 67.65 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.247 0.462 . . . . 10.0 112.247 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -72.2 -17.0 61.96 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.103 0.409 . . . . 10.0 112.103 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -81.59 -13.43 58.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.657 0.265 . . . . 10.0 111.277 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -61.16 -44.98 96.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.619 -0.264 . . . . 10.0 111.487 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 11.9 m -74.64 -4.44 37.22 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 48.9 m -111.15 -54.89 2.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.037 0.384 . . . . 10.0 112.037 -179.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 49.3 mt -71.31 -47.95 56.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -106.3 -5.77 18.86 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -178.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm 60.5 47.5 8.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.37 0.605 . . . . 10.0 110.288 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 407' ' ' LEU . . . . . 0.525 HD13 HD11 ' A' ' 99' ' ' ILE . 42.0 mt -117.04 135.81 53.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.626 -0.715 . . . . 10.0 109.866 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . 0.665 ' OD1' ' HD2' ' A' ' 13' ' ' ARG . 1.1 t0 -75.69 175.87 8.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 10.2 m -138.78 125.61 21.0 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 121.947 -0.47 . . . . 10.0 111.881 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 47.2 t -130.97 137.39 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.851 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.9 t -92.74 134.67 29.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 110.195 -0.298 . . . . 10.0 110.195 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 412' ' ' VAL . . . . . 0.414 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 38.8 t -95.16 127.71 41.53 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.125 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 412' ' ' VAL . 24.6 Cg_exo -64.19 154.26 71.81 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.843 2.362 . . . . 10.0 112.055 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.3 p -84.11 154.42 23.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.196 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -66.85 -36.66 82.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.284 0.564 . . . . 10.0 109.588 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 41.2 mtm180 -129.45 154.19 80.72 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.001 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.48 115.3 2.94 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.429 2.086 . . . . 10.0 111.973 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 51.1 ttp -75.71 105.37 6.71 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.959 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -97.58 62.06 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.212 0.53 . . . . 10.0 110.936 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 36.2 ttp180 -98.42 115.57 28.78 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.265 -0.643 . . . . 10.0 109.265 178.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 47.0 mtpt -82.95 100.84 10.67 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.495 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 422' ' ' ASP . . . . . 0.47 ' HA ' ' OG ' ' A' ' 584' ' ' SER . 8.2 m-20 -89.0 102.35 14.99 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 68.1 mt -82.82 153.31 67.27 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.295 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.49 168.26 6.87 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.12 2.547 . . . . 10.0 113.444 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -88.17 124.31 33.69 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.312 -0.858 . . . . 10.0 110.706 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 58.3 mt -98.49 86.89 3.7 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.5 -0.556 . . . . 10.0 109.5 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 22.6 t -81.18 129.45 37.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.394 -179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 428' ' ' TYR . . . . . 0.505 ' CE2' ' HA ' ' A' ' 614' ' ' PRO . 6.9 m-85 -112.42 -178.17 3.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.358 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 62.9 mtm -80.99 -74.22 0.33 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.909 -0.317 . . . . 10.0 111.166 -178.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 67.8 p -89.5 162.56 15.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.912 0.387 . . . . 10.0 111.415 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 431' ' ' GLU . . . . . 0.41 ' O ' HG12 ' A' ' 435' ' ' ILE . 3.9 tt0 -63.09 -29.8 71.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.175 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -59.43 -46.01 89.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.768 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -61.2 -44.46 97.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.23 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 434' ' ' LYS . . . . . 0.423 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 37.4 ttpt -58.69 -50.3 74.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.544 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 435' ' ' ILE . . . . . 0.46 ' O ' HG12 ' A' ' 439' ' ' ILE . 45.7 mm -61.25 -46.0 97.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.904 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 55.9 tp60 -58.13 -43.5 87.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.876 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.52 86.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.811 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 438' ' ' ILE . . . . . 0.431 HD13 HG22 ' A' ' 559' ' ' THR . 92.0 mt -62.42 -49.64 83.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.051 178.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 439' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 435' ' ' ILE . 45.6 mm -60.24 -38.76 78.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.253 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -61.83 -44.52 96.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.675 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . 0.604 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 14.8 t70 -63.98 -45.15 90.36 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 86.6 mt -58.65 -39.62 76.71 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.692 -0.686 . . . . 10.0 110.964 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -58.29 -40.62 82.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.676 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.419 ' O ' ' HE2' ' A' ' 448' ' ' LYS . 63.2 mm-40 -69.18 -40.14 78.28 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.765 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.604 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 17.7 mmt180 -65.66 -45.52 82.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.548 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 7.6 m -63.04 -38.48 91.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.593 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.7 -31.61 72.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.252 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' LYS . . . . . 0.419 ' HE2' ' O ' ' A' ' 444' ' ' GLU . 0.2 OUTLIER -86.86 -23.15 25.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.233 -179.491 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 95.93 29.25 8.71 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.838 -0.696 . . . . 10.0 111.825 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' GLN . . . . . 0.561 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 64.2 tt0 -101.43 130.99 23.61 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 120.451 0.167 . . . . 10.0 111.046 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.96 140.58 50.63 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.676 2.251 . . . . 10.0 111.282 178.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 23.9 t -121.61 133.69 67.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.692 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 60.4 tp -120.68 106.27 11.57 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 22.5 t -95.09 127.77 46.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.752 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -115.5 115.17 3.34 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.958 -0.639 . . . . 10.0 111.911 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 21.8 p -103.72 148.58 25.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.633 0.254 . . . . 10.0 110.839 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' ILE . . . . . 0.426 HG12 ' OE1' ' A' ' 560' ' ' GLU . 21.1 pt -92.36 -4.54 10.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.853 0.358 . . . . 10.0 111.107 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 7.5 m -148.82 146.98 28.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.082 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 47.6 mt -63.09 -36.68 76.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.396 -0.366 . . . . 10.0 111.127 -179.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -56.86 -37.23 71.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.036 0.446 . . . . 10.0 110.326 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -67.48 -40.03 85.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.04 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.87 -43.75 91.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.481 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -61.99 -43.05 99.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.637 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 40.6 tp -65.13 -50.17 67.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.901 -0.591 . . . . 10.0 111.546 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 9.3 p -64.88 -33.93 66.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 121.048 -0.261 . . . . 10.0 111.393 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 71.1 m -65.44 -38.91 91.27 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 120.84 0.352 . . . . 10.0 110.363 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -63.32 -48.27 78.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.261 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.94 -39.7 95.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.76 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 18.8 mt -63.49 -37.24 86.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.891 0.377 . . . . 10.0 110.432 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 20.7 m -68.92 -39.93 79.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.43 0.633 . . . . 10.0 109.807 178.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt -64.7 -32.11 73.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.215 -0.902 . . . . 10.0 110.493 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -87.41 -4.61 59.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.013 -0.54 . . . . 10.0 111.293 179.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 68.31 31.55 74.53 Favored Glycine 0 C--N 1.329 0.169 0 CA-C-N 116.116 -0.493 . . . . 10.0 112.963 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 57.5 mt -101.06 136.68 31.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.731 0.301 . . . . 10.0 110.62 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.483 ' O ' ' HB ' ' A' ' 500' ' ' VAL . 52.8 mttm -61.0 134.63 57.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.135 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' HIS . . . . . 0.405 ' HA ' ' O ' ' A' ' 500' ' ' VAL . 45.5 p-80 -152.84 125.4 8.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.066 0.46 . . . . 10.0 111.289 -179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -110.13 124.25 51.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.868 -0.606 . . . . 10.0 109.467 178.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 19.1 t -94.16 122.24 45.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.805 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.469 HD12 ' HB2' ' A' ' 503' ' ' ALA . 21.0 mt -79.5 72.83 6.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.429 0.633 . . . . 10.0 110.412 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -68.8 126.03 28.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.473 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -66.95 -18.57 65.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.618 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -72.51 -29.88 63.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.003 0.43 . . . . 10.0 110.567 179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -107.71 74.33 0.95 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.955 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -65.71 -32.55 74.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.921 0.391 . . . . 10.0 110.68 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.36 -38.74 90.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.572 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -80.44 -29.88 37.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.098 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.43 ' HG3' HD22 ' A' ' 479' ' ' LEU . 26.4 tt0 -54.49 -47.41 73.07 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.516 -0.766 . . . . 10.0 110.864 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -56.82 -41.45 77.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.288 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -68.64 -41.33 79.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.956 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.2 mt -64.35 -47.82 87.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.264 -0.426 . . . . 10.0 110.911 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 97.4 t -63.58 -36.96 78.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.918 0.389 . . . . 10.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -62.9 -33.95 76.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.672 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -113.0 23.16 13.67 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.972 0.415 . . . . 10.0 111.106 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -73.18 -18.81 61.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.107 0.48 . . . . 10.0 110.928 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -94.38 15.0 64.21 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.867 -0.682 . . . . 10.0 111.744 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' TYR . . . . . 0.402 ' HA ' ' HD3' ' A' ' 497' ' ' PRO . 5.5 t80 -71.27 140.63 85.3 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 110.365 -0.235 . . . . 10.0 110.365 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 496' ' ' TYR . 52.4 Cg_exo -56.54 128.11 28.69 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.398 2.065 . . . . 10.0 112.371 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 64.6 32.94 11.14 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.031 179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -111.52 121.6 45.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.566 -0.288 . . . . 10.0 110.274 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' VAL . . . . . 0.483 ' HB ' ' O ' ' A' ' 475' ' ' LYS . 44.5 t -101.92 117.75 47.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.035 0.445 . . . . 10.0 110.927 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.6 m -109.47 135.88 49.77 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.282 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 25.9 mt -115.99 123.47 71.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.706 0.289 . . . . 10.0 110.548 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . 0.469 ' HB2' HD12 ' A' ' 479' ' ' LEU . . . -122.51 136.89 54.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.777 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 10.3 m -107.48 122.23 46.22 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.702 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 16.7 m120 53.37 68.04 0.9 Allowed 'General case' 0 N--CA 1.465 0.294 0 O-C-N 123.682 0.614 . . . . 10.0 110.743 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.03 135.04 57.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.176 -179.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.9 172.59 12.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.712 -0.677 . . . . 10.0 110.848 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -68.9 167.1 46.17 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 121.009 -0.615 . . . . 10.0 112.422 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.468 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 74.8 mtt180 64.96 -86.71 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.023 0.529 . . . . 10.0 111.179 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.2 133.23 5.68 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.835 -0.697 . . . . 10.0 112.376 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -65.35 153.88 39.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.714 0.292 . . . . 10.0 111.046 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -76.96 112.98 14.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.806 0.336 . . . . 10.0 110.462 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 82.5 mt -84.56 125.0 40.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.186 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 2.0 t -85.84 125.47 40.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.788 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.4 HD21 ' HB2' ' A' ' 554' ' ' LEU . 72.4 mt -74.99 132.07 41.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.585 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 91.94 -4.31 78.24 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.505 -0.638 . . . . 10.0 111.505 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 113.0 -175.32 16.55 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.608 -0.997 . . . . 10.0 110.608 -179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 1.6 p -123.26 93.83 4.07 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 117.304 0.552 . . . . 10.0 111.018 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 34.8 p-90 -59.22 -32.99 70.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.009 0.433 . . . . 10.0 110.405 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -66.54 -23.58 66.25 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.32 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -92.96 -33.22 14.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.095 0.474 . . . . 10.0 109.864 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -68.2 -39.83 82.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.748 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . 0.544 HG12 HD12 ' A' ' 537' ' ' ILE . 26.8 m -73.53 -23.1 19.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.973 0.416 . . . . 10.0 110.318 178.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -81.94 -27.67 33.18 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.716 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -66.26 -27.77 68.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.442 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 25.2 mt -75.98 136.5 40.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.837 -0.62 . . . . 10.0 109.979 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -69.33 -32.21 71.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.987 0.422 . . . . 10.0 110.027 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -134.36 88.11 31.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.312 179.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -84.34 103.01 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.462 2.108 . . . . 10.0 112.06 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 20.8 p -75.83 162.7 27.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.52 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -60.37 -34.42 73.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.937 0.398 . . . . 10.0 110.364 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.38 -47.39 76.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.107 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -64.26 -43.08 95.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.826 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 72.4 mt -59.46 -42.78 88.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.609 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.64 -36.84 68.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.541 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 9.5 tptt -64.18 -50.27 68.78 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.327 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . 0.544 HD12 HG12 ' A' ' 523' ' ' VAL . 81.4 mt -63.6 -36.05 74.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 110.114 -0.328 . . . . 10.0 110.114 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -62.3 -45.79 91.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.064 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -68.32 -40.5 81.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.449 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.56 -45.16 94.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.574 -0.739 . . . . 10.0 109.454 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 50.0 t90 -61.68 -37.63 84.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.842 -1.072 . . . . 10.0 110.877 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 40.2 tp60 -57.39 -44.9 84.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.778 0.323 . . . . 10.0 110.879 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 42.2 t -64.03 -42.74 96.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.083 0.468 . . . . 10.0 110.314 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -68.83 -38.14 79.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.588 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -62.27 -45.21 94.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.963 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.08 -34.22 77.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.271 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -60.22 -39.39 86.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.732 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 99.6 t -69.69 -39.05 77.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.857 -0.61 . . . . 10.0 110.526 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.88 -45.94 90.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.598 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -69.51 -15.52 63.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.503 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 551' ' ' ALA . . . . . 0.561 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -86.02 -25.86 25.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.974 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 123.89 22.75 2.14 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.567 -0.825 . . . . 10.0 112.896 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 71.12 -162.51 54.14 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.007 -0.616 . . . . 10.0 112.636 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.4 ' HB2' HD21 ' A' ' 515' ' ' LEU . 50.7 tp -74.36 126.71 31.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.089 -0.337 . . . . 10.0 110.089 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 555' ' ' HIS . . . . . 0.421 ' HA ' ' O ' ' A' ' 583' ' ' SER . 65.9 t60 -97.86 110.97 23.44 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.328 -179.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 16.7 mm -92.8 132.88 35.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.427 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 26.4 mt -127.5 124.51 63.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.909 0.385 . . . . 10.0 110.239 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -110.13 129.92 9.62 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 111.32 -0.712 . . . . 10.0 111.32 179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 559' ' ' THR . . . . . 0.431 HG22 HD13 ' A' ' 438' ' ' ILE . 16.1 p -79.58 -34.31 40.96 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.155 0.502 . . . . 10.0 110.62 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . 0.426 ' OE1' HG12 ' A' ' 457' ' ' ILE . 25.8 mp0 -142.04 160.19 40.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.503 -0.771 . . . . 10.0 110.074 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 561' ' ' ARG . . . . . 0.508 ' HB2' HD22 ' A' ' 594' ' ' LEU . 24.7 mmt180 -98.11 150.35 21.53 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.257 -0.645 . . . . 10.0 109.257 178.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 562' ' ' HIS . . . . . 0.428 ' CE1' HD12 ' A' ' 567' ' ' ILE . 6.3 t-80 -93.91 145.35 24.69 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.946 -0.39 . . . . 10.0 109.946 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -62.33 -57.54 10.96 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.2 107.96 6.7 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 178.064 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 41.8 ttt85 -60.53 -16.96 42.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.952 -0.567 . . . . 10.0 112.275 -178.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -55.85 -41.96 75.1 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 121.236 0.541 . . . . 10.0 110.299 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 567' ' ' ILE . . . . . 0.428 HD12 ' CE1' ' A' ' 562' ' ' HIS . 58.9 mt -84.59 -28.99 6.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.367 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -61.52 -48.08 82.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.415 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -64.13 -36.27 83.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.667 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -70.89 -28.79 64.8 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.196 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.429 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 25.5 tp -66.44 -39.84 89.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.994 0.426 . . . . 10.0 110.467 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 32.5 mtm105 -82.4 -16.03 50.51 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.19 0.519 . . . . 10.0 110.009 178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.26 4.2 34.7 Favored Glycine 0 CA--C 1.52 0.355 0 CA-C-N 115.731 -0.668 . . . . 10.0 113.225 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 574' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 2.4 mmt180 -77.08 -24.29 51.85 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.724 -0.473 . . . . 10.0 109.724 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 3.8 t -106.97 162.39 13.88 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.915 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 66.67 40.91 94.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.224 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -87.43 143.81 27.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.178 -0.305 . . . . 10.0 110.178 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 578' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 105' ' ' GLY . 60.4 mt-30 64.75 23.56 12.74 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.637 0.586 . . . . 10.0 110.371 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 69.85 45.14 59.22 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.524 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -107.52 -167.27 1.24 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.296 -0.261 . . . . 10.0 110.296 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -88.82 167.82 12.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.22 0.533 . . . . 10.0 111.877 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 168.86 166.06 27.29 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.512 -0.635 . . . . 10.0 111.512 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.421 ' O ' ' HA ' ' A' ' 555' ' ' HIS . 4.8 p -152.51 142.38 22.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.919 0.359 . . . . 10.0 110.52 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 584' ' ' SER . . . . . 0.47 ' OG ' ' HA ' ' A' ' 422' ' ' ASP . 84.6 p -126.61 139.67 53.01 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.07 0.462 . . . . 10.0 110.554 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 4.3 tpm_? -135.83 109.42 7.98 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.909 -0.775 . . . . 10.0 108.909 179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -102.34 145.31 29.68 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.269 0.557 . . . . 10.0 111.671 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 587' ' ' TYR . . . . . 0.423 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 68.6 m-85 -127.5 164.45 21.91 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.193 -0.912 . . . . 10.0 109.39 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 588' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 587' ' ' TYR . 5.5 mt -163.57 166.89 22.01 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 110.194 -0.299 . . . . 10.0 110.194 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 589' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 428' ' ' TYR . 0.3 OUTLIER -139.01 150.43 45.81 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 178.262 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 590' ' ' MET . . . . . 0.437 ' HA ' ' HG3' ' A' ' 595' ' ' MET . 75.3 mmm -68.47 -8.51 41.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.563 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -93.66 2.12 56.41 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.875 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -80.58 154.46 27.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.849 0.357 . . . . 10.0 110.864 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -68.15 -17.86 64.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.746 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.546 ' O ' HG12 ' A' ' 597' ' ' ILE . 9.1 tp -65.61 -24.01 66.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.992 0.425 . . . . 10.0 110.998 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.437 ' HG3' ' HA ' ' A' ' 590' ' ' MET . 13.6 mmt -73.89 1.63 10.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.652 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -96.84 -3.11 42.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.24 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.546 HG12 ' O ' ' A' ' 594' ' ' LEU . 24.0 pt -84.9 -3.22 7.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.07 0.462 . . . . 10.0 110.971 -179.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -89.78 1.55 55.99 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.696 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.84 -66.03 0.23 Allowed 'General case' 0 N--CA 1.466 0.35 0 O-C-N 124.001 0.813 . . . . 10.0 111.827 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.7 m -86.74 120.53 28.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.011 0.434 . . . . 10.0 110.918 -179.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.16 -19.39 64.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.656 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -61.26 -34.57 75.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.69 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 49.4 t -65.13 -49.36 79.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.067 0.46 . . . . 10.0 109.885 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.0 -35.63 81.08 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.378 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -64.94 -38.02 94.99 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 116.076 -0.511 . . . . 10.0 112.237 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 37.8 tpp -68.16 -28.36 67.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.905 0.383 . . . . 10.0 110.543 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 58.0 mtt -68.28 -24.61 64.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.809 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 80.1 mtt-85 -69.59 -17.99 63.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.866 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -82.39 9.21 9.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.072 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 4.2 tp -78.79 -11.01 59.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.056 0.455 . . . . 10.0 110.461 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 611' ' ' GLY . . . . . 0.443 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 87.79 -45.64 3.36 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.575 -0.821 . . . . 10.0 111.776 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 612' ' ' MET . . . . . 0.443 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.6 OUTLIER 73.36 -56.8 0.65 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.625 0.77 . . . . 10.0 111.912 179.154 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 18.2 mtpp 61.21 80.79 0.25 Allowed Pre-proline 0 N--CA 1.463 0.204 0 O-C-N 123.523 0.515 . . . . 10.0 111.153 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 614' ' ' PRO . . . . . 0.505 ' HA ' ' CE2' ' A' ' 428' ' ' TYR . 32.5 Cg_exo -58.93 106.86 0.31 Allowed 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.018 2.479 . . . . 10.0 112.451 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 120.0 -22.29 8.61 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.921 -0.657 . . . . 10.0 112.009 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -106.1 116.65 32.29 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.814 0.34 . . . . 10.0 110.1 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -69.14 102.01 1.57 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.873 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 10.5 tp -71.99 -33.09 46.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.174 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 48.14 86.29 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.428 0.691 . . . . 10.0 112.853 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -120.51 96.75 48.95 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.245 179.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.59 -29.49 85.35 Favored 'Trans proline' 0 N--CA 1.476 0.446 0 C-N-CA 123.49 2.793 . . . . 10.0 114.456 -178.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 56.0 p-90 -63.21 -24.44 67.88 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.638 -0.425 . . . . 10.0 111.374 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 95.9 t -65.71 -48.24 83.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 91.3 m -61.1 -38.86 87.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.463 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.19 -35.22 79.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.306 -0.407 . . . . 10.0 110.27 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -68.7 -45.04 72.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.196 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 77.9 mt -66.28 -41.48 89.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.706 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.03 -41.49 92.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.976 0.417 . . . . 10.0 110.75 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -70.07 -38.77 75.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.125 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . 0.403 ' O ' HG23 ' A' ' 634' ' ' VAL . . . -61.36 -42.09 98.14 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.943 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -58.93 -42.21 89.22 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.299 0.571 . . . . 10.0 110.022 178.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -70.48 -34.81 72.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.563 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -59.47 -38.05 79.77 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.786 0.327 . . . . 10.0 110.327 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 634' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 630' ' ' ALA . 95.1 t -57.09 -52.64 53.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.423 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -73.07 -25.7 61.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.353 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 56.9 m -64.19 -38.27 90.44 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -77.44 -34.93 54.45 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.21 -0.663 . . . . 10.0 109.21 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 28.6 t30 -64.67 -40.51 95.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.088 -0.96 . . . . 10.0 110.606 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.09 -37.7 83.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.75 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 640' ' ' ASP . . . . . 0.502 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 3.4 t70 -62.09 -27.6 69.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.084 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 58.0 mt -81.6 -37.24 15.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 109.408 -0.589 . . . . 10.0 109.408 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 642' ' ' ARG . . . . . . . . . . . . . 53.9 mtm-85 -62.02 -38.49 88.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.33 179.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 14.6 pttm -65.56 -27.16 68.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.958 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -65.44 -41.7 93.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.159 0.504 . . . . 10.0 109.734 179.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.98 -41.61 77.67 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.043 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 646' ' ' LEU . . . . . 0.409 ' O ' ' HB2' ' A' ' 650' ' ' ASP . 96.1 mt -61.07 -40.7 94.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.696 -0.683 . . . . 10.0 110.939 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -56.46 -36.37 68.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.101 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -83.8 -41.47 17.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.673 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -70.95 -32.09 68.88 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 650' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 653' ' ' ASN . 0.3 OUTLIER -63.59 -32.58 74.09 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.892 0.377 . . . . 10.0 110.731 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 651' ' ' VAL . . . . . 0.474 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 44.8 t -63.53 -44.08 98.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 121.382 0.61 . . . . 10.0 109.435 178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -73.6 -24.42 60.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.412 -0.813 . . . . 10.0 110.34 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 653' ' ' ASN . . . . . 0.411 ' HB3' ' O ' ' A' ' 650' ' ' ASP . 18.1 t30 -61.83 -51.57 67.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.584 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.84 -43.93 97.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.798 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 655' ' ' GLN . . . . . 0.474 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 29.7 mt-30 -61.89 -44.57 96.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.368 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 16.6 ttp-105 -61.79 -42.89 99.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.124 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 45.3 ttp180 -66.39 -43.19 86.55 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.656 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.7 -47.11 79.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.125 -0.489 . . . . 10.0 112.014 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.8 tp -67.79 -39.84 82.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 120.935 -0.306 . . . . 10.0 111.389 -179.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -70.55 -31.19 68.14 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.672 -0.411 . . . . 10.0 110.088 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 27.6 t -61.34 -51.0 70.65 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -59.29 -46.52 88.34 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.34 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 -60.11 -43.28 95.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.085 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -74.6 -35.19 62.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.756 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -64.57 -43.01 95.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.874 0.369 . . . . 10.0 110.038 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 79.7 mt -76.42 -17.08 59.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.343 0.592 . . . . 10.0 109.98 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 24.4 tp -76.54 -37.44 56.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.247 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -54.38 28.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.584 -0.735 . . . . 10.0 111.288 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 26.8 m -76.39 149.05 6.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.079 -0.509 . . . . 10.0 111.603 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.61 -24.0 16.78 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.334 179.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -83.37 108.63 16.68 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.273 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 672' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 676' ' ' ILE . 7.9 p -113.59 -3.94 11.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.221 0.534 . . . . 10.0 109.863 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -42.16 72.63 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.338 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.85 -46.74 88.13 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.916 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 675' ' ' THR . . . . . 0.414 ' O ' HG12 ' A' ' 679' ' ' ILE . 3.8 m -64.26 -48.03 77.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.297 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 676' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 672' ' ' VAL . 48.2 mm -57.29 -43.86 82.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.45 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.81 -40.34 75.99 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.045 -0.262 . . . . 10.0 111.372 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 69.6 m -61.43 -44.07 97.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.573 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 679' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 675' ' ' THR . 45.0 pt -77.26 -23.62 14.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 C-N-CA 120.839 -0.344 . . . . 10.0 111.285 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 36.2 ttm-85 -60.4 -46.07 91.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.951 0.405 . . . . 10.0 110.61 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -63.84 -37.84 88.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.744 -0.662 . . . . 10.0 111.014 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -70.29 -47.56 60.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.205 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 683' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 679' ' ' ILE . 75.8 t -59.79 -46.81 93.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.969 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -63.44 -42.72 98.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.482 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.4 tttm -60.54 -50.87 71.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.457 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.2 -41.81 89.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.908 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 95.5 m -62.84 -46.27 88.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.727 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 95.8 mt -66.29 -41.29 88.79 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-N 116.58 -0.282 . . . . 10.0 110.381 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -56.61 -29.73 62.46 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.677 0.391 . . . . 10.0 111.921 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -72.97 -23.25 60.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 10.0 112.033 -179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -111.71 -30.41 7.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.894 0.378 . . . . 10.0 111.184 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 692' ' ' ILE . . . . . 0.617 HG23 ' CD1' ' A' ' 701' ' ' TRP . 86.1 mt -127.84 108.03 20.34 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.454 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.14 132.1 20.52 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.352 2.035 . . . . 10.0 111.001 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -52.04 116.21 2.64 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.633 2.222 . . . . 10.0 112.69 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 63.57 74.06 0.43 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.801 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 17.1 p -135.25 -162.2 1.23 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.557 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 88.9 mt -98.41 159.29 15.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.598 -0.273 . . . . 10.0 110.585 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.41 -38.63 71.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.883 -179.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -67.24 -16.19 64.14 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.96 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 43.0 mtt -92.49 -6.1 50.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.983 0.42 . . . . 10.0 110.482 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 701' ' ' TRP . . . . . 0.617 ' CD1' HG23 ' A' ' 692' ' ' ILE . 46.5 m0 -90.75 103.67 16.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.431 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -80.81 77.96 7.63 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.364 0.602 . . . . 10.0 110.006 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 703' ' ' ILE . . . . . 0.492 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.5 mm -61.65 -48.09 90.86 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.304 -0.862 . . . . 10.0 111.197 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 704' ' ' PRO . . . . . 0.492 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.2 Cg_exo -55.85 -47.27 25.94 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 121.889 1.726 . . . . 10.0 112.134 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -65.03 -43.01 96.41 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.033 -0.603 . . . . 10.0 112.293 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 61.9 tp -61.63 -46.58 89.2 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.767 0.318 . . . . 10.0 110.466 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -63.64 -40.46 96.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.788 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -56.52 -41.62 77.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.994 0.426 . . . . 10.0 110.862 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 709' ' ' ARG . 1.2 tpt180 -75.77 -47.62 25.1 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.176 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 66.6 mt -60.67 -45.68 93.23 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.464 0.542 . . . . 10.0 112.464 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 44.8 mttt -75.38 -5.88 47.16 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -178.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -116.6 -57.37 2.19 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.09 0.774 . . . . 10.0 113.09 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -89.29 -16.76 30.39 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.929 0.715 . . . . 10.0 112.929 -177.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -108.48 -7.22 15.83 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.14 -0.624 . . . . 10.0 111.603 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.16 27.28 17.07 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.068 0.461 . . . . 10.0 110.786 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 1.9 mp -108.53 100.76 9.99 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.486 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -86.26 77.25 9.57 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.013 -0.539 . . . . 10.0 109.712 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.64 131.52 21.72 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.346 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 719' ' ' PRO . . . . . 0.501 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 85.4 Cg_endo -83.75 65.81 7.33 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.152 2.568 . . . . 10.0 112.23 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 720' ' ' ILE . . . . . 0.401 ' HA ' ' CE3' ' A' ' 723' ' ' TRP . 52.6 mt -59.53 -43.77 91.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.689 -179.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -66.45 -27.27 67.68 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.022 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 722' ' ' GLU . . . . . 0.501 ' HB2' ' HB2' ' A' ' 719' ' ' PRO . 1.0 OUTLIER -98.58 27.58 4.74 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.776 -179.581 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 723' ' ' TRP . . . . . 0.401 ' CE3' ' HA ' ' A' ' 720' ' ' ILE . 4.7 m0 -115.41 -47.44 2.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.636 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 94.8 mt -63.84 -21.1 66.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.089 -0.505 . . . . 10.0 112.081 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -78.4 -17.32 56.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.039 0.447 . . . . 10.0 110.613 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 41.3 mttp -107.39 -29.9 9.0 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.784 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 727' ' ' GLU . . . . . 0.545 ' O ' ' HB2' ' A' ' 730' ' ' LEU . 33.7 mt-10 -123.65 87.35 52.44 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.53 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -63.75 -30.73 69.23 Favored 'Trans proline' 0 CA--C 1.528 0.195 0 C-N-CA 122.577 2.185 . . . . 10.0 112.218 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -91.11 20.11 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.411 -0.358 . . . . 10.0 111.258 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 730' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 727' ' ' GLU . 0.5 OUTLIER -66.75 -30.09 70.22 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.829 -0.434 . . . . 10.0 109.829 178.938 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 32.4 m170 62.44 -167.71 0.2 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.54 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -96.84 -45.0 6.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.164 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -61.22 -55.12 35.72 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.636 -0.257 . . . . 10.0 111.154 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 730' ' ' LEU . 1.3 m -58.27 -32.89 68.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.839 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 37.5 tp -63.56 -42.94 98.31 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 51.7 mtt180 -62.84 -44.85 95.04 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.949 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -62.09 -36.18 80.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.91 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 20.8 mmm-85 -61.08 -50.64 72.45 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.943 -0.391 . . . . 10.0 109.943 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 59.7 mt -60.08 -43.36 92.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.381 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 34.1 tp -63.29 -48.12 79.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.767 -0.651 . . . . 10.0 111.029 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.18 -40.21 95.62 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.869 0.366 . . . . 10.0 111.014 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.58 -39.36 93.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.919 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 743' ' ' SER . . . . . 0.41 ' O ' ' HB2' ' A' ' 747' ' ' TYR . 48.3 p -61.27 -38.3 86.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.76 0.314 . . . . 10.0 110.444 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 58.2 mt -70.2 -41.89 78.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.192 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -60.87 -46.59 90.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.553 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 87.6 t -69.49 -37.27 74.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.433 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 747' ' ' TYR . . . . . 0.41 ' HB2' ' O ' ' A' ' 743' ' ' SER . 20.8 t80 -61.04 -51.95 67.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.341 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 748' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 21.9 mt-30 -63.84 -28.05 69.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.438 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -46.03 79.6 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.847 178.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -67.13 -33.6 75.79 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.154 -0.476 . . . . 10.0 109.824 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -62.44 -25.24 67.87 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.367 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 752' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 85.5 mt-10 -62.15 -24.8 67.39 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.895 0.332 . . . . 10.0 111.895 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 1.7 t -102.59 4.93 10.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.266 0.555 . . . . 10.0 110.611 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 47.8 t -113.64 -49.68 5.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.928 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.17 145.82 6.96 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.047 -0.821 . . . . 10.0 111.047 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 756' ' ' ALA . . . . . 0.471 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -59.98 -66.25 0.55 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.056 0.428 . . . . 10.0 111.785 -178.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.48 -27.48 66.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.068 0.461 . . . . 10.0 110.742 -179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.5 tpt -66.56 -46.91 74.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.876 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 759' ' ' MET . . . . . 0.404 ' O ' ' HG3' ' A' ' 763' ' ' GLU . 12.4 tpt -62.39 -38.66 90.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.556 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.9 mmp_? -59.13 -35.11 72.9 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.267 0.556 . . . . 10.0 110.41 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -69.96 -38.41 76.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.581 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -65.51 -44.93 85.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.085 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.446 ' HA ' HD21 ' A' ' 826' ' ' LEU . 84.9 mt-10 -58.95 -49.29 78.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.857 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -59.74 -42.97 94.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.306 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.89 -46.82 92.79 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.946 -0.645 . . . . 10.0 112.011 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.15 -42.09 91.95 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-O 120.686 0.279 . . . . 10.0 110.637 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 23.7 mtp -59.09 -48.47 81.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.606 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.7 -44.94 92.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.53 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 -59.35 -46.26 89.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.26 -0.427 . . . . 10.0 111.115 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 9.2 m -65.74 -39.94 91.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.974 0.416 . . . . 10.0 110.416 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.2 tt -61.46 -49.88 75.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.942 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -64.29 -30.98 72.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.934 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 7.8 t -64.69 -52.67 55.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.214 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 71.4 mt -72.79 -26.96 61.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.245 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 9.3 t-105 -60.5 -47.01 88.02 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.621 -0.263 . . . . 10.0 110.835 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -69.96 -31.34 69.02 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.768 -0.373 . . . . 10.0 110.337 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.24 -47.16 74.66 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 108.468 -0.938 . . . . 10.0 108.468 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 38.1 t60 -60.06 -40.46 89.54 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.69 -1.141 . . . . 10.0 110.64 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 19.7 mt -63.46 -46.77 84.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.537 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -65.69 -43.29 89.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.382 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.57 -46.43 89.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.03 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 50.8 mmm -63.1 -41.58 99.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.762 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.21 -46.95 86.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.828 0.347 . . . . 10.0 110.52 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -65.24 -38.81 91.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.03 0.443 . . . . 10.0 110.458 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . 0.502 ' O ' ' HB ' ' A' ' 789' ' ' ILE . 15.8 tp -67.4 -38.89 85.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.468 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -57.06 -42.51 80.73 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.63 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -84.31 -31.86 24.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.388 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -78.74 -26.01 59.46 Favored Glycine 0 CA--C 1.52 0.362 0 C-N-CA 120.695 -0.764 . . . . 10.0 113.054 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 789' ' ' ILE . . . . . 0.502 ' HB ' ' O ' ' A' ' 785' ' ' LEU . 0.4 OUTLIER -57.99 -22.66 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 122.871 0.468 . . . . 10.0 111.506 -179.566 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 33.8 m170 -60.49 -34.23 73.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.631 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 53.9 mt -77.18 -33.43 56.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.535 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -75.49 -13.36 60.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.091 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -79.35 77.18 1.87 Allowed Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 111.153 -0.779 . . . . 10.0 111.153 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -80.0 -176.37 5.46 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.876 0.369 . . . . 10.0 111.254 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -63.79 142.74 58.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.537 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 67.12 10.92 8.08 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.954 -179.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -122.61 126.95 48.73 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.317 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -84.52 120.28 74.02 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.251 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.0 -16.43 49.5 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 122.9 2.4 . . . . 10.0 113.314 -178.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 22.1 mtmm -90.88 -49.6 6.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.947 0.403 . . . . 10.0 110.022 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -65.07 -39.46 93.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.104 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -65.9 -41.97 90.8 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 179.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -59.83 -37.03 78.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.479 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -67.01 -25.7 66.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.466 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 44.9 ttp85 -80.16 -47.95 13.92 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -58.1 -43.46 87.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.644 -0.707 . . . . 10.0 111.048 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 3.9 p -66.86 -37.73 85.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.265 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -66.11 -48.44 70.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.555 -0.293 . . . . 10.0 110.416 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 15.0 m -63.11 -34.78 78.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.092 0.472 . . . . 10.0 110.169 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 810' ' ' MET . . . . . 0.4 ' HG3' ' HA ' ' A' ' 302' ' ' ALA . 35.0 ttm -66.78 -36.48 82.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.86 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -70.55 -44.08 68.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.334 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -59.67 -47.07 87.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.385 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.64 81.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.799 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 23.6 ttp -62.78 -36.25 82.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.447 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 95.7 mt -71.88 -30.02 64.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.479 . . . . 10.0 109.876 179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 816' ' ' GLU . . . . . 0.475 ' HA ' ' CE ' ' A' ' 819' ' ' LYS . 74.4 mm-40 -69.8 -45.14 68.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.474 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 1.3 p -70.11 -28.73 65.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.615 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 818' ' ' LEU . . . . . 0.41 ' O ' HG23 ' A' ' 822' ' ' VAL . 58.8 tp -56.7 -63.15 1.29 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.705 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 819' ' ' LYS . . . . . 0.475 ' CE ' ' HA ' ' A' ' 816' ' ' GLU . 31.0 pttt -62.31 -32.8 73.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.797 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -60.91 -59.22 5.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.271 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -66.42 -32.58 74.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.309 -0.405 . . . . 10.0 111.584 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 822' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 818' ' ' LEU . 20.3 t -60.87 -53.25 51.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-O 120.792 0.33 . . . . 10.0 110.211 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 33.7 mm -65.36 -37.46 80.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.42 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 45.5 t -58.44 -57.88 10.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.229 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 22.1 m -59.19 -42.61 91.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.377 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 826' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 763' ' ' GLU . 68.2 mt -65.39 -43.26 91.26 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -178.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 4.9 m -75.03 -26.06 59.2 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.974 0.416 . . . . 10.0 111.059 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -87.06 11.95 12.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.451 0.538 . . . . 10.0 112.451 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.8 p -64.17 128.98 27.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -101.69 115.26 30.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.035 0.445 . . . . 10.0 111.15 -179.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 4.4 m -135.19 155.26 37.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.607 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 25.3 ptt-85 -74.1 93.25 2.25 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.168 0.508 . . . . 10.0 110.455 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 72.3 mtp -80.08 139.34 52.99 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.543 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -68.15 147.36 72.81 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.667 2.245 . . . . 10.0 111.701 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.53 105.06 11.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.962 0.411 . . . . 10.0 110.208 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 . . . . . 0 C--O 1.245 0.839 0 CA-C-O 118.562 -0.732 . . . . 10.0 110.332 -179.922 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.767 0.317 . . . . 10.0 110.721 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.0 168.76 20.11 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 41.0 mt -64.12 97.82 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.586 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.6 m -84.31 -31.64 24.76 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.158 0.504 . . . . 10.0 110.528 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 43.5 tp -88.18 110.73 20.92 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.264 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.1 171.99 17.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.133 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -54.52 115.92 2.39 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 123.757 0.661 . . . . 10.0 110.032 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -100.78 14.53 31.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.034 0.445 . . . . 10.0 111.42 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -83.41 87.97 6.98 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.141 0.496 . . . . 10.0 110.541 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -79.42 138.96 37.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.468 -0.787 . . . . 10.0 110.338 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 72.0 mt -111.1 99.89 44.87 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.164 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -68.12 -15.32 42.81 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.068 2.512 . . . . 10.0 112.621 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.429 ' O ' HG23 ' B' ' 17' ' ' VAL . 70.8 mt -58.2 -34.99 70.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.528 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.48 -48.92 78.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.235 -0.439 . . . . 10.0 112.009 -179.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 32.4 m -79.25 -13.83 13.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.919 0.39 . . . . 10.0 111.569 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.24 -30.77 62.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.062 0.458 . . . . 10.0 110.361 179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.526 ' O ' HG23 ' B' ' 21' ' ' VAL . 72.8 t -64.26 -41.19 91.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.516 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.23 -25.84 67.33 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.3 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.66 -48.66 30.62 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.87 -26.44 60.58 Favored Glycine 0 N--CA 1.452 -0.292 0 CA-C-N 115.546 -0.752 . . . . 10.0 112.908 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 17' ' ' VAL . 85.6 t -63.25 -20.99 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 120.952 0.406 . . . . 10.0 111.196 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 2.4 tpt -85.09 -4.49 59.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.865 0.364 . . . . 10.0 111.268 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.4 m -134.67 -174.52 3.61 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.499 -0.319 . . . . 10.0 110.141 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -88.11 62.89 7.01 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -80.09 115.53 19.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.496 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -105.19 -5.44 20.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.892 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 30.3 ttm -83.49 66.97 9.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.798 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.956 0 CA-C-O 118.886 -0.578 . . . . 10.0 110.365 179.916 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 47.4 t . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -126.57 120.58 29.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.703 0.287 . . . . 10.0 110.773 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 109.76 -168.43 13.18 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.117 -0.563 . . . . 10.0 111.94 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.428 ' H ' ' HD2' ' A' ' 16' ' ' ARG . 0.3 OUTLIER -57.0 140.38 49.16 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.942 0.401 . . . . 10.0 110.452 179.472 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.456 ' HD2' ' OD1' ' A' ' 408' ' ' ASP . 16.9 mmt85 -88.98 164.15 15.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.696 -178.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.9 t30 64.84 -88.4 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.167 -0.924 . . . . 10.0 112.652 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -55.52 -60.07 3.94 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.825 0.676 . . . . 10.0 112.825 -177.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.428 ' HD2' ' H ' ' A' ' 12' ' ' SER . 11.7 ttt85 -63.56 -38.13 89.97 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.668 -0.242 . . . . 10.0 111.437 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -57.85 -51.54 69.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.739 0.304 . . . . 10.0 110.982 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.4 mt -64.72 -35.38 80.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.203 -179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.7 ttp-105 -66.87 -44.42 80.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.498 -0.319 . . . . 10.0 110.807 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -39.47 90.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.149 0.499 . . . . 10.0 110.133 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.465 ' O ' HG23 ' A' ' 25' ' ' VAL . 55.4 mtt -71.84 -28.28 63.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.644 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -29.96 69.09 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.366 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -71.07 -39.92 71.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.714 -0.675 . . . . 10.0 109.584 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.1 t -65.84 -38.44 82.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.62 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.647 HG13 HD12 ' A' ' 88' ' ' LEU . 98.7 t -58.79 -37.42 66.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.233 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -63.4 -41.34 98.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.431 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.1 mt -62.32 -44.65 99.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.079 0.466 . . . . 10.0 109.885 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' A' ' 65' ' ' PRO . 48.8 mt -62.66 -44.57 99.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.341 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -63.35 -38.77 92.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.787 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.483 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -75.01 -26.06 59.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.477 -0.328 . . . . 10.0 111.531 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 15.9 ttt -84.25 -12.55 54.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.066 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.504 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 7.1 tt0 -57.2 -51.96 77.74 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 116.371 -0.377 . . . . 10.0 111.34 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.504 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 61.1 Cg_exo -54.11 -30.64 61.34 Favored 'Trans proline' 0 C--N 1.363 1.296 0 C-N-CA 122.207 1.938 . . . . 10.0 112.429 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -70.13 -44.24 69.33 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.648 -0.501 . . . . 10.0 109.648 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 23.3 mmt -66.92 -31.07 71.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.749 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -63.06 -20.36 65.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.902 0.382 . . . . 10.0 111.0 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.6 mtmt -96.42 1.55 51.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.566 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 mp -100.14 148.85 24.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.095 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.4 p -81.66 166.81 19.82 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -58.58 -38.74 78.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.965 0.412 . . . . 10.0 110.999 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -68.89 -33.14 73.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.977 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -68.55 -35.65 77.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.836 0.35 . . . . 10.0 110.144 179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.3 mt -66.58 -46.97 74.24 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -60.64 -33.75 73.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.338 -0.846 . . . . 10.0 110.305 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.64 -33.25 86.72 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 115.538 -0.755 . . . . 10.0 111.873 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -69.09 -36.87 78.06 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.913 -0.403 . . . . 10.0 109.913 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.5 m -60.07 -46.25 90.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.946 0.403 . . . . 10.0 110.221 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.37 -34.93 79.08 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.932 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -62.26 -45.04 95.09 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.995 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -60.36 -42.57 96.03 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.102 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -58.35 -38.23 76.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.872 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.89 -40.38 32.52 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.967 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 64.1 mtp180 -60.51 -40.49 91.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.571 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 32.2 mt -63.94 -20.9 66.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.707 0.289 . . . . 10.0 111.62 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -106.34 9.85 31.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.07 0.462 . . . . 10.0 110.857 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -117.52 -50.29 2.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.365 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 168.57 64.51 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.602 -0.809 . . . . 10.0 112.309 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -144.35 149.42 36.12 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.42 ' HB ' ' HB2' ' A' ' 62' ' ' ASN . 4.7 t -97.3 142.53 14.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.52 -179.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 39.1 tp -61.3 -47.14 87.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.945 0.403 . . . . 10.0 111.238 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -73.82 1.35 10.74 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.265 -0.425 . . . . 10.0 111.45 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.42 ' HB2' ' HB ' ' A' ' 59' ' ' VAL . 65.6 t30 -105.54 -11.05 16.54 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.311 0.577 . . . . 10.0 109.839 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.6 mt -93.56 -4.64 50.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.798 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.454 ' N ' ' HD2' ' A' ' 65' ' ' PRO . 73.9 mt -49.58 -56.64 15.53 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 115.806 -0.634 . . . . 10.0 112.62 -179.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 64' ' ' ILE . 11.3 Cg_endo -54.32 -47.28 27.78 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.34 2.027 . . . . 10.0 113.474 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -71.44 -42.96 67.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.84 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.422 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -65.64 -48.25 72.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.898 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -63.72 -31.55 72.76 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.512 -0.313 . . . . 10.0 111.11 -179.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.45 -44.73 93.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.832 0.348 . . . . 10.0 110.288 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 81.9 t -62.82 -43.93 99.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.442 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 67' ' ' ALA . 40.4 t -64.06 -44.34 97.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.835 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.497 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 1.1 ttm180 -59.01 -39.73 82.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.843 0.354 . . . . 10.0 110.212 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.8 tp10 -68.45 -49.81 57.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.664 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.28 -30.75 69.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.654 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.6 m -57.79 -40.6 80.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.505 -0.316 . . . . 10.0 111.392 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.0 mtmt -77.65 -17.86 57.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.699 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -95.65 -29.92 14.05 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.938 0.348 . . . . 10.0 111.938 -178.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 64.9 t -94.31 -55.51 6.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.618 0.246 . . . . 10.0 111.458 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -90.95 -40.84 11.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.88 0.371 . . . . 10.0 111.039 -179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.45 9.94 34.71 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.681 -0.771 . . . . 10.0 111.94 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.1 mtt -122.83 151.72 41.41 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.459 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 11.7 ttp180 -98.79 138.48 35.88 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.979 0.418 . . . . 10.0 111.192 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.02 110.89 4.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.584 178.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -56.9 156.88 6.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.299 0.571 . . . . 10.0 112.003 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.38 -38.17 79.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.229 -0.896 . . . . 10.0 111.182 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.77 -31.64 51.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.839 0.352 . . . . 10.0 111.082 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -67.08 -34.04 76.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.647 HD12 HG13 ' A' ' 25' ' ' VAL . 80.9 mt -65.82 -36.16 82.69 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.415 ' O ' HG23 ' A' ' 93' ' ' VAL . 62.6 mt -66.46 -49.62 66.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.705 178.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.449 ' O ' ' HG ' ' A' ' 94' ' ' LEU . . . -60.12 -43.85 97.91 Favored Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.842 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.26 -32.75 85.22 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.03 -0.605 . . . . 10.0 112.096 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 8.7 ttm -69.2 -42.11 76.21 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.901 -0.407 . . . . 10.0 109.901 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 89' ' ' LEU . 85.2 t -65.9 -36.42 77.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.656 -0.702 . . . . 10.0 110.071 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 90' ' ' GLY . 79.9 mt -68.14 -8.83 41.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.734 -0.666 . . . . 10.0 111.993 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -81.36 -20.68 40.09 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.499 0.666 . . . . 10.0 109.236 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -102.18 174.56 5.87 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.315 -0.857 . . . . 10.0 110.236 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -83.63 67.88 9.62 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.308 0.575 . . . . 10.0 109.564 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 16.4 m -141.01 161.77 37.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.4 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.651 HD11 HD13 ' A' ' 407' ' ' LEU . 44.0 mm -103.17 131.0 52.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.734 179.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -110.06 122.97 48.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.891 0.377 . . . . 10.0 111.793 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.62 ' CD ' ' HA ' ' A' ' 393' ' ' THR . 42.5 tt0 -94.72 130.08 41.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.134 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 41.6 mtm -145.34 176.94 9.19 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.707 0.289 . . . . 10.0 110.78 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.496 ' HB2' ' HG2' ' A' ' 106' ' ' GLU . 16.9 mmm180 -105.76 175.77 5.39 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 109.808 -0.442 . . . . 10.0 109.808 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 18.9 p -77.2 -36.65 54.69 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.757 0.313 . . . . 10.0 111.821 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -72.55 -9.4 73.81 Favored Glycine 0 N--CA 1.453 -0.23 0 CA-C-N 116.08 -0.509 . . . . 10.0 113.888 -178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.496 ' HG2' ' HB2' ' A' ' 103' ' ' ARG . 3.2 mm-40 -90.86 -1.29 57.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.226 0.513 . . . . 10.0 110.6 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.94 62.16 4.44 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.381 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -52.94 -45.54 67.74 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 111.884 0.327 . . . . 10.0 111.884 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -33.97 76.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.707 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 25.5 tp -70.46 -28.98 65.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.936 0.398 . . . . 10.0 110.494 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 64.8 m -70.81 -30.24 66.64 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.327 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.17 -15.94 63.56 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.3 0.852 . . . . 10.0 113.3 -178.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 41.1 p -72.41 -25.4 61.47 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.403 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 31.1 mt -68.18 -57.26 9.37 Favored Pre-proline 0 CA--C 1.537 0.478 0 N-CA-C 112.411 0.523 . . . . 10.0 112.411 -178.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.403 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 30.1 Cg_endo -62.38 -31.42 81.27 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 121.994 1.796 . . . . 10.0 111.85 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.67 -49.48 68.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.692 -0.685 . . . . 10.0 110.431 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.471 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 59.1 t80 -62.5 -45.74 91.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.961 0.41 . . . . 10.0 110.66 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 62.8 tp -59.77 -49.36 78.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.668 -0.697 . . . . 10.0 111.616 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 14.0 m-80 -72.41 -26.43 61.86 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.433 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -66.13 -26.08 67.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.7 0.286 . . . . 10.0 111.137 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 60.7 mt -60.71 -21.25 62.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.75 -179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.7 p -79.92 -17.31 53.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.704 0.288 . . . . 10.0 111.027 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.53 6.83 59.59 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 121.099 -0.572 . . . . 10.0 112.802 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.92 -24.08 44.31 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.857 -0.202 . . . . 10.0 111.326 -179.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 109.21 123.85 4.81 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.342 -0.932 . . . . 10.0 113.546 179.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 68.9 t -102.15 119.05 49.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -99.73 107.13 19.13 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.894 0.378 . . . . 10.0 110.806 -179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 64.0 t -96.27 122.03 47.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.242 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 26.5 t -102.02 110.0 27.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.527 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.52 162.31 13.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.528 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.429 ' HA ' HD11 ' A' ' 214' ' ' ILE . 4.4 m -67.23 -40.42 84.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 111.876 0.324 . . . . 10.0 111.876 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -145.41 161.07 40.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.359 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -64.68 -24.61 67.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.892 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -59.18 -55.85 29.67 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.474 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 89.8 mt -73.68 -31.49 63.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.512 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.85 -52.0 67.28 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.696 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -33.8 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.417 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -59.17 -57.15 14.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.488 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.32 -29.65 67.53 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.518 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.533 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -60.24 -41.64 93.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.811 0.339 . . . . 10.0 110.69 179.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -89.16 -25.33 21.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.337 -0.392 . . . . 10.0 111.329 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -75.56 -43.28 49.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.79 0.329 . . . . 10.0 111.466 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 43.7 m-20 -90.35 -1.92 57.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.936 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.533 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 59.2 ttm-85 -60.44 -48.83 92.68 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 116.102 -0.499 . . . . 10.0 112.084 179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' PRO . . . . . 0.59 ' O ' ' HB2' ' A' ' 149' ' ' PHE . 34.1 Cg_exo -61.86 -12.69 26.82 Favored 'Trans proline' 0 C--N 1.359 1.092 0 C-N-CA 122.083 1.855 . . . . 10.0 112.946 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.3 tp -88.52 -53.96 4.41 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.982 0.42 . . . . 10.0 110.322 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -70.89 -42.79 69.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.868 -178.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.43 -10.13 59.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.803 0.335 . . . . 10.0 111.54 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.59 ' HB2' ' O ' ' A' ' 145' ' ' PRO . 19.1 t80 -83.97 -26.01 29.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.365 0.603 . . . . 10.0 109.714 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 37.4 mt -95.47 -8.19 36.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.434 -0.803 . . . . 10.0 110.805 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 106.28 15.31 18.02 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.619 -0.8 . . . . 10.0 113.634 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 90.0 mt -101.84 136.76 41.12 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.15 0.475 . . . . 10.0 109.903 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.8 p -90.6 130.18 36.66 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.062 0.458 . . . . 10.0 111.298 -179.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.447 HG21 ' HA ' ' A' ' 144' ' ' ARG . 61.4 t -102.46 120.06 51.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.379 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -111.54 139.63 15.68 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.746 -0.74 . . . . 10.0 111.701 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.2 tp -117.28 130.21 72.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.833 0.349 . . . . 10.0 110.125 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -115.26 129.75 56.72 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.11 -0.495 . . . . 10.0 109.913 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 66.0 mt -121.61 147.8 48.83 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.362 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' PRO . . . . . 0.526 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 17.9 Cg_endo -59.92 102.11 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.212 2.608 . . . . 10.0 112.658 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 110.72 4.03 28.33 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.695 -0.764 . . . . 10.0 112.611 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . 0.481 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 48.1 ttm -64.33 138.97 97.6 Favored Pre-proline 0 C--N 1.327 -0.394 0 C-N-CA 122.254 0.222 . . . . 10.0 110.696 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -52.06 144.32 37.75 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.801 2.334 . . . . 10.0 112.601 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . 0.454 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.77 -48.34 93.79 Favored Pre-proline 0 CA--C 1.54 0.586 0 N-CA-C 113.054 0.761 . . . . 10.0 113.054 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.8 Cg_exo -55.51 -41.57 76.58 Favored 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 121.935 1.757 . . . . 10.0 112.39 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -69.16 -39.89 78.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.642 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.481 ' HE2' ' O ' ' A' ' 161' ' ' MET . 58.7 mttm -58.78 -45.12 90.56 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.33 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -59.94 -29.26 68.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.557 -0.747 . . . . 10.0 111.625 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -78.8 -43.63 24.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.919 0.39 . . . . 10.0 110.288 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.7 -38.47 91.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.377 -179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -78.11 -26.63 48.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.307 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.22 -11.29 59.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.178 0.513 . . . . 10.0 110.424 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -70.84 177.94 3.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.591 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . 0.433 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 19.1 m-20 -76.18 -46.31 29.08 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.597 -179.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 49.2 mt -127.49 125.95 66.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.207 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.9 m -111.46 126.87 55.41 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.408 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -103.33 137.17 41.82 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.389 -0.597 . . . . 10.0 109.389 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -179.19 177.19 48.31 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.368 -0.92 . . . . 10.0 112.727 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -93.7 158.86 15.47 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.713 0.292 . . . . 10.0 110.835 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -68.37 -32.65 72.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.457 -0.338 . . . . 10.0 110.816 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -59.68 -53.93 52.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.123 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.526 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.9 tp10 -68.13 -35.6 78.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.768 0.318 . . . . 10.0 110.661 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -54.85 -42.93 72.59 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.286 -0.416 . . . . 10.0 111.005 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -72.84 -41.0 50.95 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.844 -0.694 . . . . 10.0 112.147 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -64.94 -37.39 87.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 10.0 110.464 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . 0.457 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 15.1 m-20 -62.3 -41.76 98.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.021 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -62.13 -41.84 98.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.666 -0.697 . . . . 10.0 110.051 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' LEU . . . . . 0.469 ' O ' ' HB2' ' A' ' 191' ' ' MET . 67.8 mt -62.35 -45.19 94.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.828 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 58.3 mtm-85 -67.91 -38.94 83.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.888 0.375 . . . . 10.0 110.885 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -62.82 -50.95 68.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.76 -0.655 . . . . 10.0 111.618 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.22 1.66 20.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.569 0.581 . . . . 10.0 112.569 -178.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' MET . . . . . 0.469 ' HB2' ' O ' ' A' ' 187' ' ' LEU . 23.1 ttp -106.52 2.84 26.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.048 0.451 . . . . 10.0 110.568 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 197' ' ' GLU . . . -73.3 167.67 20.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.199 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -105.56 -29.77 9.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.126 0.488 . . . . 10.0 110.004 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -118.12 144.88 35.7 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.813 179.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.77 -24.87 74.66 Favored 'Trans proline' 0 CA--C 1.527 0.163 0 C-N-CA 122.364 2.042 . . . . 10.0 112.629 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 45.1 mp0 -75.29 -10.44 59.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.361 -0.381 . . . . 10.0 111.384 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.465 ' HB2' ' HB1' ' A' ' 192' ' ' ALA . 46.1 mt-10 -89.03 -3.27 58.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.778 0.323 . . . . 10.0 110.544 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 198' ' ' ARG . 30.5 mtt85 -61.42 158.67 14.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.569 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 4.8 m -136.32 -18.41 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.756 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -88.81 177.87 6.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.15 0.5 . . . . 10.0 111.085 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 1.3 mmm180 -137.44 176.6 8.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.462 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.7 tmtm? -60.01 126.95 29.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.277 0.56 . . . . 10.0 111.143 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . 0.411 HD22 ' CZ ' ' A' ' 384' ' ' TYR . 14.2 mt -80.47 91.08 5.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.528 -0.76 . . . . 10.0 109.691 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 29.9 t-80 -99.91 -63.28 1.14 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.295 -0.412 . . . . 10.0 111.082 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -128.54 138.06 52.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.139 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.497 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -133.37 129.55 37.58 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.476 -0.783 . . . . 10.0 109.659 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 45.7 tp -119.53 110.53 17.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.167 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 2.4 p -92.43 126.22 44.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.521 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -58.26 -65.58 0.62 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.617 -0.72 . . . . 10.0 111.269 -179.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' GLU . . . . . 0.474 ' CD ' HH21 ' A' ' 509' ' ' ARG . 0.5 OUTLIER -112.64 113.91 26.28 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.923 0.392 . . . . 10.0 110.745 -179.83 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.649 HG11 HD12 ' A' ' 99' ' ' ILE . 27.6 m -76.56 -14.13 14.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.041 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . 0.535 ' OD2' ' HD3' ' A' ' 566' ' ' ARG . 1.1 m-20 -45.91 -78.17 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 124.061 0.851 . . . . 10.0 112.247 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.34 -47.09 9.68 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.455 -0.793 . . . . 10.0 112.17 -178.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' ILE . . . . . 0.433 ' HA ' ' HG3' ' A' ' 218' ' ' GLU . 53.2 mt -53.25 -31.89 18.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 N-CA-C 113.876 1.065 . . . . 10.0 113.876 -177.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 215' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 215' ' ' LEU . 10.6 mt -106.26 -58.46 1.92 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 39.1 mm -68.22 -54.46 21.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 113.207 0.817 . . . . 10.0 113.207 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -73.27 -45.04 58.11 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.798 0.666 . . . . 10.0 112.798 -177.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 218' ' ' GLU . . . . . 0.433 ' HG3' ' HA ' ' A' ' 214' ' ' ILE . 5.2 mm-40 -73.45 1.7 9.25 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.36 0.504 . . . . 10.0 112.36 -178.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.47 -25.37 68.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.689 0.281 . . . . 10.0 111.73 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 220' ' ' ARG . . . . . 0.478 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -114.31 19.38 16.33 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.069 -0.253 . . . . 10.0 111.306 -179.241 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 5.6 m -97.45 106.28 31.48 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 120.951 -0.3 . . . . 10.0 110.605 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 222' ' ' PRO . . . . . 0.478 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 81.7 Cg_endo -92.84 131.46 0.93 Allowed 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.925 2.417 . . . . 10.0 113.202 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 223' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 374' ' ' SER . 47.6 mt -85.56 124.02 31.64 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.536 HG23 HG23 ' A' ' 371' ' ' THR . 83.3 mt -117.68 130.67 72.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 120.787 0.327 . . . . 10.0 111.663 -178.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 20.8 pt -105.11 138.01 31.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 178.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 3.9 m -80.04 157.95 26.62 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.323 0.49 . . . . 10.0 112.323 -178.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -170.98 110.03 0.34 Allowed Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 110.888 -0.885 . . . . 10.0 110.888 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 228' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' A' ' 229' ' ' ALA . 65.6 Cg_endo -94.22 106.29 0.14 Allowed 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.066 2.511 . . . . 10.0 114.803 -178.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 229' ' ' ALA . . . . . 0.577 ' HB3' ' HG2' ' B' ' 22' ' ' MET . . . 162.06 69.08 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.886 1.274 . . . . 10.0 108.459 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -89.76 174.53 7.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.266 -0.879 . . . . 10.0 112.989 -176.268 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 231' ' ' ASP . . . . . 0.48 ' HA ' ' HB1' ' B' ' 18' ' ' ALA . 0.6 OUTLIER -76.6 -26.77 55.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.913 -1.039 . . . . 10.0 111.175 -179.274 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.456 ' HB2' ' HG2' ' A' ' 355' ' ' GLN . 0.6 OUTLIER -55.15 -37.22 66.69 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.745 -178.789 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 49.7 m -57.55 -25.71 60.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.783 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -108.38 -49.17 3.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.055 0.455 . . . . 10.0 111.344 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 48.7 tpp -57.22 -44.6 83.87 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.114 0.783 . . . . 10.0 113.114 -177.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . 0.481 ' HB3' ' CB ' ' A' ' 359' ' ' ALA . 26.7 m-85 -69.37 -17.3 63.67 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -67.81 -26.95 66.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.836 0.35 . . . . 10.0 110.617 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -106.39 -35.91 6.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.664 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 55.6 t -64.86 -45.51 94.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 111.902 0.334 . . . . 10.0 111.902 -178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -71.84 -5.56 35.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.85 0.357 . . . . 10.0 111.826 -178.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -97.83 -5.67 34.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.741 0.305 . . . . 10.0 110.894 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 49.5 mm -98.42 -31.89 3.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.287 0.565 . . . . 10.0 110.368 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 243' ' ' ILE . . . . . 0.49 ' N ' ' HD2' ' A' ' 244' ' ' PRO . 55.6 mt -54.28 -47.95 95.96 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-N 115.486 -0.779 . . . . 10.0 112.872 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 244' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 243' ' ' ILE . 39.0 Cg_endo -67.22 13.07 0.16 Allowed 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.159 1.906 . . . . 10.0 113.571 179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 245' ' ' HIS . . . . . 0.404 ' H ' ' C ' ' A' ' 243' ' ' ILE . 10.6 t-80 -114.44 8.42 16.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.226 0.536 . . . . 10.0 110.11 179.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 40.6 mt -89.57 170.47 10.46 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.766 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 72.7 mt -91.93 126.66 44.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.448 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -73.24 71.21 1.19 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.574 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 179.17 -40.41 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.79 -0.641 . . . . 10.0 109.86 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -154.95 159.98 40.8 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.143 -178.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt 76.24 87.89 0.08 Allowed 'General case' 0 N--CA 1.465 0.28 0 O-C-N 124.106 0.879 . . . . 10.0 112.068 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 252' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 55.39 12.23 0.7 Allowed 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 115.018 1.488 . . . . 10.0 115.018 177.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -80.58 -43.48 20.53 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.735 -0.603 . . . . 10.0 109.613 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -99.78 163.36 12.5 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.267 -0.879 . . . . 10.0 109.629 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 255' ' ' GLU . 0.0 OUTLIER -85.66 -24.75 26.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.004 0.431 . . . . 10.0 110.67 -179.66 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 17.9 m -149.86 -74.26 0.17 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.418 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 12.7 t80 66.23 -71.04 0.09 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.313 0.645 . . . . 10.0 111.687 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 258' ' ' GLN . . . . . 0.439 ' OE1' ' HG3' ' A' ' 277' ' ' ARG . 12.2 tp60 62.61 -178.62 0.14 Allowed 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.136 0.574 . . . . 10.0 110.886 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -84.65 49.29 4.21 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.682 -0.771 . . . . 10.0 111.727 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -141.29 -64.49 0.44 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.745 0.307 . . . . 10.0 110.791 -179.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 79.3 -156.79 41.86 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.671 -0.776 . . . . 10.0 111.951 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.65 -162.18 0.85 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -52.14 143.36 14.45 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.389 0.431 . . . . 10.0 111.57 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.07 50.18 0.87 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.185 -0.461 . . . . 10.0 112.076 -178.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 17.1 t -123.45 -41.12 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.312 0.577 . . . . 10.0 109.769 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 266' ' ' ASP . . . . . 0.561 ' OD1' ' HG2' ' A' ' 268' ' ' LYS . 27.3 t0 -134.34 144.24 48.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.25 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -111.67 0.13 16.23 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.594 0.22 . . . . 10.0 111.594 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 268' ' ' LYS . . . . . 0.638 ' HD3' ' O ' ' A' ' 318' ' ' ALA . 5.1 ptpp? -108.07 144.8 34.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.357 0.599 . . . . 10.0 111.459 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 6.2 m -91.63 77.17 5.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.542 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 270' ' ' ARG . . . . . 0.519 ' HA ' HD13 ' A' ' 319' ' ' LEU . 11.6 ttt85 -71.31 9.33 0.8 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.707 -178.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -92.62 -5.58 51.22 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 122.061 -0.4 . . . . 10.0 110.427 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 59.9 t 74.36 129.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-N 115.698 -0.683 . . . . 10.0 112.133 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -166.15 -73.1 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.203 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 9.1 mp 61.68 81.23 0.2 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.688 0.617 . . . . 10.0 111.844 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 29.0 m -138.52 119.48 14.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.618 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -74.47 135.45 42.28 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.719 -0.475 . . . . 10.0 109.719 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 277' ' ' ARG . . . . . 0.439 ' HG3' ' OE1' ' A' ' 258' ' ' GLN . 3.7 ptp180 -160.91 27.64 0.14 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.172 0.511 . . . . 10.0 110.508 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.404 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . -114.05 -44.39 0.74 Allowed Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 115.708 -0.678 . . . . 10.0 111.978 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 278' ' ' GLY . 4.2 mm? 71.54 -52.71 0.69 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.577 0.751 . . . . 10.0 111.589 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 15.0 p -62.23 -22.23 28.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.943 0.402 . . . . 10.0 111.157 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 22.2 mt -72.91 -65.2 0.83 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.868 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 34.4 pt -58.1 -19.59 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.59 -179.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -68.72 -21.11 64.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.798 0.332 . . . . 10.0 110.791 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.79 -3.12 19.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.169 0.509 . . . . 10.0 110.341 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.7 -34.25 62.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.441 -0.948 . . . . 10.0 108.441 178.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 6.8 mt -92.16 -156.2 0.45 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.933 -1.031 . . . . 10.0 109.967 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 287' ' ' VAL . . . . . . . . . . . . . 3.4 t 57.99 42.63 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.581 0.705 . . . . 10.0 110.922 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.95 178.16 4.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.495 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 69.18 -162.05 0.18 Allowed 'General case' 0 C--O 1.235 0.308 0 O-C-N 123.579 0.55 . . . . 10.0 110.632 -179.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -129.21 34.32 2.84 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.56 -0.829 . . . . 10.0 112.588 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 291' ' ' ILE . . . . . 0.486 HD12 ' HB3' ' B' ' 14' ' ' ALA . 4.1 tt -166.56 127.72 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.785 -0.45 . . . . 10.0 109.785 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 8.9 tpt 64.37 29.76 13.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.598 0.713 . . . . 10.0 109.92 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -94.35 1.3 55.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.305 -0.861 . . . . 10.0 111.603 -179.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -75.41 -176.8 3.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.31 -0.405 . . . . 10.0 111.055 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -75.85 70.78 1.98 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 121.022 -0.609 . . . . 10.0 112.462 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -124.21 177.65 5.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.825 0.345 . . . . 10.0 110.699 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 6.4 m -129.02 171.46 12.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.983 -0.553 . . . . 10.0 109.976 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 6.8 tp -87.6 5.59 38.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.197 0.523 . . . . 10.0 110.064 179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -104.78 -5.63 21.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.278 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 13.4 m -62.35 124.05 81.01 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.043 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -76.86 4.26 5.85 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.927 2.418 . . . . 10.0 112.432 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -65.13 -36.59 84.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.866 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -153.36 108.51 3.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.674 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 5.1 mp -93.15 -11.2 9.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.4 0.619 . . . . 10.0 110.156 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . 0.499 ' HG3' ' HG2' ' A' ' 777' ' ' GLU . 71.5 mmm -60.22 -52.86 63.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.192 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 6.1 mp -60.11 -38.96 84.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.524 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 22.3 ttt -60.83 -47.83 84.58 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.618 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -74.84 -25.22 58.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.845 0.355 . . . . 10.0 110.766 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -71.5 -44.42 64.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.481 -0.327 . . . . 10.0 111.516 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 27.5 m -69.74 -37.8 74.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 121.035 -0.266 . . . . 10.0 111.571 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -67.84 -36.94 81.24 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.126 0.489 . . . . 10.0 110.437 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 312' ' ' ALA . . . . . . . . . . . . . . . -66.71 -30.86 71.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.195 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -76.93 -32.78 57.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.208 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.12 -42.53 72.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.542 . . . . 10.0 110.733 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 315' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -67.51 -17.12 64.55 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 120.984 0.421 . . . . 10.0 110.631 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -88.61 10.53 20.2 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.287 0.565 . . . . 10.0 110.235 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 23.9 m80 -118.62 -42.13 2.77 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.832 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.638 ' O ' ' HD3' ' A' ' 268' ' ' LYS . . . -107.74 -50.72 3.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.198 -0.456 . . . . 10.0 112.055 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 319' ' ' LEU . . . . . 0.519 HD13 ' HA ' ' A' ' 270' ' ' ARG . 2.0 mm? -60.17 -55.93 27.78 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.698 0.259 . . . . 10.0 111.698 -179.003 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -102.97 132.49 49.18 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.086 0.469 . . . . 10.0 110.243 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -114.89 136.28 53.28 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.827 -178.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 322' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 322' ' ' ARG . 8.5 ptm180 -66.96 159.51 28.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.989 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 323' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 77.55 -25.24 0.2 Allowed 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.846 0.858 . . . . 10.0 112.387 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 14.2 p -113.96 -40.14 3.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.618 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -93.9 -22.3 18.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.154 0.502 . . . . 10.0 110.927 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -163.1 159.13 22.78 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.109 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 10.5 tp -140.09 139.1 37.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.011 0.434 . . . . 10.0 109.94 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 43.0 t -102.5 104.29 16.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.312 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -96.96 87.58 4.29 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.57 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 2.8 t70 53.15 56.48 7.43 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.476 -0.783 . . . . 10.0 111.615 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 93.56 -29.91 7.92 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.817 -0.706 . . . . 10.0 112.709 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -79.59 101.37 8.27 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.83 0.348 . . . . 10.0 111.37 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 23.2 t -79.29 111.73 16.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.201 -0.454 . . . . 10.0 109.848 178.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 84.0 mt -113.42 136.53 49.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.891 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 335' ' ' ILE . . . . . 0.464 ' HB ' ' HB2' ' A' ' 344' ' ' MET . 74.1 mt -82.07 135.05 25.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.254 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 58.6 t -106.93 113.56 43.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.033 0.444 . . . . 10.0 110.115 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.48 128.56 36.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.633 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -84.73 -4.89 59.25 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.039 -0.528 . . . . 10.0 112.179 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -84.94 -55.79 3.89 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.099 -0.376 . . . . 10.0 111.528 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -120.35 -25.15 5.7 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.081 0.401 . . . . 10.0 112.081 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 106.98 29.04 4.75 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.035 -0.826 . . . . 10.0 111.035 -179.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 5.2 tpp180 -74.83 125.86 29.7 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.865 0.364 . . . . 10.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.56 102.07 13.8 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.942 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 344' ' ' MET . . . . . 0.464 ' HB2' ' HB ' ' A' ' 335' ' ' ILE . 64.1 mtt -86.73 93.46 9.25 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -86.73 -25.06 24.91 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.684 -178.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -95.96 17.81 58.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.458 -0.877 . . . . 10.0 113.137 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 19.8 mmt85 -141.77 145.56 34.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.85 0.325 . . . . 10.0 110.533 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -144.13 144.37 31.55 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.259 -0.428 . . . . 10.0 109.998 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 349' ' ' TRP . . . . . 0.444 ' HB3' HD23 ' A' ' 353' ' ' LEU . 61.9 m95 -50.61 126.22 14.95 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.724 1.009 . . . . 10.0 113.724 -177.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.88 -163.18 0.99 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.287 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 14.5 t70 63.81 17.51 10.55 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.377 0.608 . . . . 10.0 111.442 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 352' ' ' GLY . . . . . 0.402 ' HA2' ' OE1' ' A' ' 355' ' ' GLN . . . 82.43 23.11 57.37 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.772 -0.728 . . . . 10.0 112.67 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.444 HD23 ' HB3' ' A' ' 349' ' ' TRP . 34.0 tp -91.0 -40.95 11.37 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.067 0.395 . . . . 10.0 112.067 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 354' ' ' HIS . . . . . 0.426 ' HB3' ' O ' ' A' ' 349' ' ' TRP . 14.5 p80 -62.82 -28.9 70.33 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 122.0 -0.437 . . . . 10.0 110.682 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 355' ' ' GLN . . . . . 0.456 ' HG2' ' HB2' ' A' ' 232' ' ' SER . 18.7 mp0 -68.46 -30.91 69.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.238 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -72.3 -27.98 62.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.203 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 77.0 t -80.77 -46.95 20.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.709 -0.678 . . . . 10.0 110.084 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -67.52 -11.4 57.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.347 -0.842 . . . . 10.0 111.941 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 359' ' ' ALA . . . . . 0.481 ' CB ' ' HB3' ' A' ' 236' ' ' TYR . . . -109.53 -4.01 16.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.775 0.322 . . . . 10.0 111.272 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 29.0 ttpp -95.38 -54.58 3.35 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.954 0.407 . . . . 10.0 110.169 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -73.33 177.58 5.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.622 -0.717 . . . . 10.0 109.911 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -78.4 57.1 4.11 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 120.724 -0.75 . . . . 10.0 112.941 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 11.0 m -138.54 -172.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 110.181 -0.303 . . . . 10.0 110.181 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 364' ' ' GLN . . . . . 0.463 ' HG2' ' N ' ' A' ' 365' ' ' ILE . 4.7 tt0 -125.05 150.08 47.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.473 -0.33 . . . . 10.0 110.469 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 365' ' ' ILE . . . . . 0.5 ' H ' HD12 ' A' ' 365' ' ' ILE . 4.2 mp -63.89 144.21 14.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.674 -0.693 . . . . 10.0 110.28 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 37.0 mm-40 -71.24 -171.0 0.54 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.621 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 367' ' ' ASN . . . . . 0.419 ' ND2' ' HB2' ' A' ' 228' ' ' PRO . 0.2 OUTLIER -72.41 -24.6 61.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 10.0 112.036 -179.021 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 65.31 -161.44 0.27 Allowed 'General case' 0 C--O 1.239 0.521 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 43.2 t30 174.78 119.9 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.607 0.763 . . . . 10.0 109.866 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -129.0 178.74 6.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.239 0.543 . . . . 10.0 111.424 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 371' ' ' THR . . . . . 0.536 HG23 HG23 ' A' ' 224' ' ' ILE . 56.1 m -85.97 102.23 13.59 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.405 -0.816 . . . . 10.0 110.402 179.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 53.2 mt -65.79 -46.22 79.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.243 0.544 . . . . 10.0 110.365 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -153.4 154.24 34.09 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.419 -0.81 . . . . 10.0 109.732 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 374' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 4.2 t -153.33 152.92 31.66 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.763 0.316 . . . . 10.0 110.519 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 14.4 tt -156.9 140.51 7.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.47 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.91 147.77 22.56 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.424 178.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -59.44 -37.97 79.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.478 0.18 . . . . 10.0 111.301 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 378' ' ' GLN . . . . . 0.486 HE21 HG23 ' A' ' 404' ' ' ILE . 1.5 tm0? -59.84 -39.04 83.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.305 0.574 . . . . 10.0 110.12 179.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -82.96 -2.49 55.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.344 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -101.12 -46.13 5.16 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.278 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -70.31 -20.66 62.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.169 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 42.8 mtp180 -76.54 -9.05 58.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.805 0.336 . . . . 10.0 111.031 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 80.3 mt -83.25 -19.56 36.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.016 0.436 . . . . 10.0 110.001 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.497 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 49.1 m-85 -77.39 141.45 39.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.304 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -71.17 -67.61 0.5 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.154 0.502 . . . . 10.0 110.235 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -100.75 102.32 13.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.169 0.509 . . . . 10.0 110.039 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 50.1 tp -111.05 115.72 29.93 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.879 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -121.3 158.21 28.68 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.104 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -154.52 158.28 28.13 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.198 -1.001 . . . . 10.0 112.61 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 39.6 mtm -115.47 154.79 28.66 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 391' ' ' THR . . . . . 0.465 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 14.7 t -149.94 159.52 44.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.533 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -88.49 157.83 28.13 Favored Glycine 0 N--CA 1.441 -1.016 0 N-CA-C 109.99 -1.244 . . . . 10.0 109.99 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 393' ' ' THR . . . . . 0.62 ' HA ' ' CD ' ' A' ' 101' ' ' GLU . 9.5 m -56.69 99.99 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.11 0.455 . . . . 10.0 111.218 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . 0.519 ' HA ' HD22 ' A' ' 569' ' ' ASN . . . -160.11 -27.96 0.06 Allowed 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.816 -0.629 . . . . 10.0 112.037 -179.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 6.7 t70 59.26 -95.27 0.05 Allowed 'General case' 0 N--CA 1.474 0.729 0 O-C-N 123.326 0.391 . . . . 10.0 110.499 -179.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 5.7 m 55.97 -105.6 0.28 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.045 0.757 . . . . 10.0 113.045 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -84.24 25.42 0.85 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.118 0.414 . . . . 10.0 112.118 -177.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 398' ' ' ALA . . . . . 0.523 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -67.69 -31.02 70.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.9 0.381 . . . . 10.0 110.858 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -65.99 -18.61 65.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.587 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -83.41 -19.67 35.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.682 -0.235 . . . . 10.0 111.235 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 401' ' ' PHE . . . . . 0.523 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 17.5 m-85 -60.56 -42.02 95.74 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.909 0.337 . . . . 10.0 111.909 -179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 6.8 m -70.39 -19.87 62.98 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.423 0.527 . . . . 10.0 112.423 -178.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 26.7 m -98.82 -43.68 6.67 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.998 0.37 . . . . 10.0 111.998 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . 0.486 HG23 HE21 ' A' ' 378' ' ' GLN . 60.4 mt -77.87 -62.01 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 112.843 0.683 . . . . 10.0 112.843 -178.083 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 405' ' ' TYR . . . . . 0.434 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 81.9 m-85 -97.36 -2.7 41.83 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -177.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt 62.73 48.1 4.37 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.161 0.505 . . . . 10.0 110.427 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 407' ' ' LEU . . . . . 0.651 HD13 HD11 ' A' ' 99' ' ' ILE . 16.2 mt -113.2 142.08 46.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.028 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . 0.456 ' OD1' ' HD2' ' A' ' 13' ' ' ARG . 9.5 t0 -80.79 166.09 21.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.599 0.238 . . . . 10.0 110.602 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 2.0 m -118.42 109.18 15.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.717 0.294 . . . . 10.0 110.953 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 42.1 t -121.6 115.91 47.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.966 0.412 . . . . 10.0 110.918 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 53.3 t -83.99 108.67 16.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.017 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 58.6 t -79.15 130.47 69.28 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.927 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.21 146.46 81.43 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.49 2.127 . . . . 10.0 111.507 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 74.3 p -89.14 149.34 23.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.809 0.337 . . . . 10.0 111.136 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -83.65 -28.16 28.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.081 -1.081 . . . . 10.0 108.081 178.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -97.87 128.26 34.57 Favored Pre-proline 0 N--CA 1.448 -0.573 0 CA-C-N 114.765 -1.107 . . . . 10.0 109.13 178.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.36 124.91 12.19 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.62 2.213 . . . . 10.0 113.451 -178.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 48.9 mtm -90.26 82.1 6.03 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.527 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 419' ' ' ILE . . . . . 0.444 HG13 ' HA ' ' A' ' 581' ' ' ALA . 5.9 pt -92.31 42.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.118 -179.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 420' ' ' ARG . . . . . 0.558 ' HA ' ' O ' ' A' ' 581' ' ' ALA . 38.5 ttp180 -73.83 137.46 43.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.413 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 583' ' ' SER . 83.0 mttt -93.38 95.65 9.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.248 0.547 . . . . 10.0 110.398 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -80.26 125.33 29.74 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.51 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 89.9 mt -109.43 152.08 42.5 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 116.259 -0.428 . . . . 10.0 109.951 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.77 160.14 42.1 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.586 2.19 . . . . 10.0 112.895 -179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -81.72 119.6 24.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.568 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 426' ' ' LEU . 12.6 mt -99.87 102.75 14.25 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.241 0.543 . . . . 10.0 110.661 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 427' ' ' VAL . . . . . 0.534 HG23 HG11 ' A' ' 623' ' ' VAL . 6.0 t -94.65 125.49 47.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.625 -0.716 . . . . 10.0 110.817 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 428' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' A' ' 590' ' ' MET . 2.7 m-85 -104.29 179.86 4.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.636 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 28.4 mmm -73.54 -76.78 0.12 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.682 0.277 . . . . 10.0 111.383 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 64.4 p -88.26 159.75 17.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.971 0.415 . . . . 10.0 111.389 -179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.79 -31.5 70.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.624 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -61.63 -38.05 86.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.93 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 433' ' ' GLU . . . . . 0.443 ' HG2' ' HG3' ' A' ' 614' ' ' PRO . 31.8 mt-10 -65.58 -39.42 91.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.039 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -59.53 -48.5 81.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.948 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 435' ' ' ILE . . . . . 0.529 ' O ' HG12 ' A' ' 439' ' ' ILE . 41.1 mm -61.81 -43.38 97.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.458 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -56.67 -44.7 81.66 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.709 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.36 -38.91 91.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.732 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 438' ' ' ILE . . . . . 0.441 ' O ' HG13 ' A' ' 442' ' ' ILE . 92.4 mt -62.47 -49.91 81.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.658 179.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 439' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 435' ' ' ILE . 47.9 mm -58.45 -43.25 86.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.268 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -63.13 -44.81 94.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.717 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . 0.612 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 14.1 t70 -63.56 -44.88 92.84 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.775 0.321 . . . . 10.0 110.326 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.487 HG12 HG11 ' A' ' 452' ' ' VAL . 54.8 mt -59.9 -42.17 88.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.378 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -57.3 -42.8 82.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.5 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.18 -41.71 98.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.408 179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.612 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 15.7 mmt180 -68.25 -39.63 82.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.485 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 13.3 m -62.94 -37.15 85.88 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.773 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -68.78 -32.12 71.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.035 -0.529 . . . . 10.0 111.363 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 47.7 mttp -85.48 -19.4 31.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.215 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 89.41 33.55 9.29 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.67 -0.776 . . . . 10.0 111.321 -178.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' GLN . . . . . 0.54 ' OE1' ' HD2' ' A' ' 445' ' ' ARG . 60.2 tt0 -105.37 129.58 24.51 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 120.432 0.158 . . . . 10.0 110.836 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -66.28 141.71 63.66 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.683 2.255 . . . . 10.0 111.462 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.487 HG11 HG12 ' A' ' 442' ' ' ILE . 51.7 t -121.94 128.11 75.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.396 -178.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 57.1 tp -115.07 109.1 17.55 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 18.9 t -95.93 127.93 47.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.358 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -110.26 109.86 2.74 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.887 -0.673 . . . . 10.0 112.391 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' THR . . . . . 0.402 ' HG1' ' HA ' ' A' ' 504' ' ' THR . 15.9 p -105.06 146.84 28.56 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.397 -0.223 . . . . 10.0 110.397 179.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 24.3 pt -94.13 -17.66 7.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.829 0.347 . . . . 10.0 111.294 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 23.2 m -130.75 137.85 49.68 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.339 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 39.4 mt -60.4 -32.24 50.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.091 0.472 . . . . 10.0 110.886 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.67 -33.74 71.95 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.712 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 -33.8 47.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.512 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.3 m -61.33 -43.74 98.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.545 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -68.62 -36.79 79.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.16 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.48 -53.71 50.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.81 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 10.2 p -65.04 -32.7 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 120.775 0.321 . . . . 10.0 110.322 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 47.0 t -65.0 -43.49 92.37 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.464 -0.569 . . . . 10.0 109.464 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -60.4 -49.38 77.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.661 -0.699 . . . . 10.0 110.294 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . 0.51 ' HG3' HG21 ' A' ' 435' ' ' ILE . 10.7 mm-40 -62.16 -38.89 90.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.706 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 24.0 mt -63.16 -38.15 90.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.078 0.466 . . . . 10.0 110.279 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 4.1 m -72.09 -34.38 68.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.762 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -63.57 -36.91 85.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.437 -0.801 . . . . 10.0 110.004 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -79.45 -30.78 42.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.743 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 97.91 34.31 5.49 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.955 -0.641 . . . . 10.0 112.281 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 70.6 mt -102.71 127.98 55.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.641 0.258 . . . . 10.0 110.849 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -63.63 129.31 39.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.141 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -155.38 153.74 30.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.832 0.349 . . . . 10.0 111.195 -179.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -130.48 132.87 45.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.033 179.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . 0.456 HG22 HD12 ' A' ' 502' ' ' ILE . 19.2 t -100.03 130.0 49.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.356 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 36.6 mt -75.76 94.17 3.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.856 0.36 . . . . 10.0 110.574 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -78.66 108.13 11.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.636 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -65.2 -7.69 13.98 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.888 0.699 . . . . 10.0 112.888 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -88.05 -11.44 47.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.988 0.423 . . . . 10.0 110.254 179.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -126.66 90.95 3.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.036 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -60.72 -30.67 70.11 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.3 -179.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.97 -37.25 87.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.069 0.461 . . . . 10.0 109.939 178.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -73.66 -38.71 64.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.431 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -52.32 -60.91 2.65 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.692 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -59.63 -36.67 76.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.243 -0.89 . . . . 10.0 111.953 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -65.66 -44.41 86.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.876 0.37 . . . . 10.0 111.529 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 83.1 mt -70.91 -45.99 70.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.241 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 71.6 t -58.88 -35.26 55.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-O 120.836 0.351 . . . . 10.0 111.305 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -59.29 -33.21 70.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.998 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -121.11 24.37 10.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.642 0.258 . . . . 10.0 111.165 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.77 -19.38 62.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.042 0.449 . . . . 10.0 111.198 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -97.88 14.44 62.81 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.858 -0.687 . . . . 10.0 112.023 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -73.4 143.04 82.23 Favored Pre-proline 0 C--N 1.327 -0.407 0 N-CA-C 110.07 -0.345 . . . . 10.0 110.07 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.98 123.8 14.01 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.591 2.194 . . . . 10.0 113.167 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.8 17.65 7.59 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -91.8 113.71 26.05 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.017 0.437 . . . . 10.0 110.315 179.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 33.0 t -92.3 112.05 25.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.598 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 12.0 m -108.35 131.62 54.56 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.526 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' ILE . . . . . 0.456 HD12 HG22 ' A' ' 478' ' ' VAL . 55.5 mt -109.84 117.6 55.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 120.827 0.346 . . . . 10.0 110.311 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -111.95 122.84 48.89 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.811 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' THR . . . . . 0.402 ' HA ' ' HG1' ' A' ' 456' ' ' THR . 8.8 m -103.28 124.15 48.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.19 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 52.88 68.71 0.79 Allowed 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.864 0.728 . . . . 10.0 110.763 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.0 132.87 36.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.838 -179.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.57 177.02 7.06 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.066 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -67.09 163.19 45.45 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.125 -0.56 . . . . 10.0 112.486 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.474 HH21 ' CD ' ' A' ' 210' ' ' GLU . 98.5 mtt180 64.83 -92.98 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 122.849 0.46 . . . . 10.0 111.016 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 86.43 141.16 6.22 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.941 -0.647 . . . . 10.0 112.252 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.84 137.06 58.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.762 0.315 . . . . 10.0 110.835 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.17 116.48 8.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 10.0 110.641 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 59.2 mt -80.32 123.12 36.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.557 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 3.4 t -83.31 133.51 28.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.601 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 52.0 mt -70.8 130.49 41.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.566 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 84.65 10.15 79.91 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.103 -0.799 . . . . 10.0 111.103 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 93.55 -175.15 35.57 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 110.432 -1.067 . . . . 10.0 110.432 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 13.0 p -124.68 111.44 15.58 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 117.517 0.659 . . . . 10.0 110.539 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' TRP . . . . . 0.411 ' O ' HG22 ' A' ' 523' ' ' VAL . 41.7 p-90 -61.51 -20.2 62.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.049 0.452 . . . . 10.0 110.096 179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -59.63 -40.95 89.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.421 -0.809 . . . . 10.0 110.277 178.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -74.63 -32.44 62.3 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.755 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -70.43 -45.19 66.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.987 -0.551 . . . . 10.0 110.91 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 519' ' ' TRP . 27.7 m -69.3 -28.36 38.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.966 0.412 . . . . 10.0 110.265 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -75.11 -22.96 57.88 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.498 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -78.29 -24.13 46.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.009 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 63.0 mt -75.7 145.56 40.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.741 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -75.7 -46.0 33.62 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.018 0.437 . . . . 10.0 110.295 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -138.15 84.39 20.61 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.263 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 529' ' ' PRO . . . . . 0.443 ' HA ' ' OE1' ' A' ' 533' ' ' GLN . 64.6 Cg_endo -78.88 104.15 1.76 Allowed 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.758 2.305 . . . . 10.0 112.66 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 72.2 p -82.4 175.07 10.53 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.309 179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.11 -39.88 72.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.648 -0.251 . . . . 10.0 111.545 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 57.9 mp0 -60.89 -43.01 99.07 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.142 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . 0.443 ' OE1' ' HA ' ' A' ' 529' ' ' PRO . 52.4 mt-30 -69.72 -51.14 37.0 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.169 -0.468 . . . . 10.0 110.727 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 77.8 mt -59.04 -42.8 87.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.44 . . . . 10.0 111.024 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -64.13 -40.61 96.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.036 0.446 . . . . 10.0 110.45 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.449 ' HG3' ' N ' ' A' ' 537' ' ' ILE . 0.0 OUTLIER -67.1 -43.22 83.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.478 179.804 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . 0.449 ' N ' ' HG3' ' A' ' 536' ' ' LYS . 77.2 mt -64.21 -41.83 93.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-N 116.398 -0.365 . . . . 10.0 110.755 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 43.2 mtmt -59.84 -41.15 90.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.799 0.333 . . . . 10.0 110.547 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -67.36 -45.63 75.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.384 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.14 -42.31 99.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.348 0.594 . . . . 10.0 110.028 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 66.4 t90 -63.81 -38.72 92.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.274 -0.875 . . . . 10.0 110.59 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 31.7 tp60 -56.37 -44.41 80.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.551 -0.295 . . . . 10.0 110.591 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 16.9 t -59.77 -46.7 93.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.033 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -65.49 -44.6 86.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.572 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -57.88 -52.72 64.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.147 -0.933 . . . . 10.0 111.922 -179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.11 -27.12 63.36 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.657 -178.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.7 91.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.994 0.426 . . . . 10.0 110.065 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 64.7 t -65.5 -43.74 94.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.072 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 24.9 mt -62.29 -41.32 98.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.191 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -66.85 -36.06 81.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.808 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 551' ' ' ALA . . . . . 0.404 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -68.16 -38.38 82.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.963 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 148.26 6.74 0.24 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.379 -0.915 . . . . 10.0 113.584 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 553' ' ' GLY . . . . . 0.402 ' HA3' ' H ' ' A' ' 582' ' ' GLY . . . 82.75 -164.24 42.85 Favored Glycine 0 CA--C 1.516 0.103 0 C-N-CA 120.762 -0.732 . . . . 10.0 112.062 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 36.0 tp -74.06 118.09 16.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.27 0.557 . . . . 10.0 110.864 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -91.45 119.6 31.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.807 0.337 . . . . 10.0 110.808 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 29.9 mm -104.19 132.07 51.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.554 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 557' ' ' ILE . . . . . 0.455 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.1 mt -128.19 123.04 59.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.972 0.415 . . . . 10.0 110.052 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -106.02 129.72 9.88 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.741 -0.742 . . . . 10.0 111.667 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 23.7 p -86.13 -34.13 20.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.233 0.54 . . . . 10.0 110.584 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -134.14 162.28 32.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.335 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -109.46 138.68 45.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.511 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 562' ' ' HIS . . . . . 0.406 ' HB3' ' HB2' ' A' ' 568' ' ' ASP . 66.2 t60 -86.58 141.15 29.22 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -52.21 -63.85 1.01 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.607 0.567 . . . . 10.0 111.037 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.64 131.9 41.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.112 178.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 565' ' ' ARG . . . . . 0.489 ' HA ' ' HB3' ' A' ' 568' ' ' ASP . 9.3 tpt180 -64.1 -19.58 65.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.381 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 566' ' ' ARG . . . . . 0.535 ' HD3' ' OD2' ' A' ' 212' ' ' ASP . 9.9 ttm180 -52.08 -64.64 0.75 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.528 -179.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 25.8 mt -75.59 -28.28 19.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.965 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 568' ' ' ASP . . . . . 0.489 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 20.5 t70 -61.73 -49.28 77.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.245 0.545 . . . . 10.0 111.005 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 569' ' ' ASN . . . . . 0.519 HD22 ' HA ' ' A' ' 394' ' ' ALA . 40.2 t30 -73.12 -31.6 64.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.473 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -67.94 -29.45 68.51 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.773 179.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.495 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 32.1 tp -66.89 -34.08 77.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.443 0.639 . . . . 10.0 109.474 178.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 26.5 ttp180 -83.3 -22.82 32.84 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.15 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -71.88 12.94 2.66 Favored Glycine 0 CA--C 1.522 0.5 0 CA-C-N 115.862 -0.608 . . . . 10.0 113.972 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 574' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 1.5 mmt180 -77.15 -35.48 56.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 117.277 0.538 . . . . 10.0 109.806 179.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.593 ' OG ' ' HA3' ' A' ' 582' ' ' GLY . 41.2 t -94.96 165.29 12.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.422 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 576' ' ' GLY . . . . . 0.578 ' HA2' ' O ' ' A' ' 580' ' ' ASP . . . 76.64 39.07 30.53 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.718 -0.753 . . . . 10.0 111.281 -179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -111.07 136.71 49.69 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.56 0.219 . . . . 10.0 110.488 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 59.93 21.65 10.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.905 -0.589 . . . . 10.0 112.423 178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 105.31 1.75 41.17 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.404 -0.903 . . . . 10.0 113.338 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 580' ' ' ASP . . . . . 0.578 ' O ' ' HA2' ' A' ' 576' ' ' GLY . 2.8 t70 -66.06 148.01 52.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.726 0.298 . . . . 10.0 110.316 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . 0.558 ' O ' ' HA ' ' A' ' 420' ' ' ARG . . . -84.3 -85.54 0.13 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.79 -0.819 . . . . 10.0 108.79 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . 0.593 ' HA3' ' OG ' ' A' ' 575' ' ' SER . . . 83.77 174.71 50.54 Favored Glycine 0 N--CA 1.439 -1.133 0 C-N-CA 120.59 -0.814 . . . . 10.0 113.396 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 421' ' ' LYS . 0.1 OUTLIER -153.64 121.44 6.0 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 -179.68 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -97.97 110.34 22.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.872 0.367 . . . . 10.0 110.985 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 585' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 3.3 tpm_? -119.36 112.96 20.08 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.714 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -106.9 137.68 44.49 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.975 0.417 . . . . 10.0 111.012 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -124.75 141.93 51.76 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.831 -0.803 . . . . 10.0 108.831 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 588' ' ' LEU . . . . . 0.448 ' HB2' HG22 ' A' ' 427' ' ' VAL . 8.6 mt -142.71 171.32 14.21 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.923 0.392 . . . . 10.0 110.863 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.39 155.56 48.23 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.988 179.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 590' ' ' MET . . . . . 0.499 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 90.7 mmm -71.18 -5.37 31.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.771 0.32 . . . . 10.0 111.131 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -99.33 -4.39 31.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.408 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -73.13 149.73 42.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.369 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -60.25 -17.25 40.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.525 -0.761 . . . . 10.0 112.224 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.518 ' O ' HG12 ' A' ' 597' ' ' ILE . 20.4 tp -64.2 -28.35 69.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.831 0.348 . . . . 10.0 110.842 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.464 ' SD ' ' HB3' ' A' ' 604' ' ' SER . 14.8 mmt -81.75 5.37 18.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.984 0.421 . . . . 10.0 111.297 -179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -97.9 -15.92 19.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.439 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.518 HG12 ' O ' ' A' ' 594' ' ' LEU . 42.6 pt -86.41 11.34 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.188 0.518 . . . . 10.0 110.764 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -90.25 22.56 3.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.799 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.1 -58.42 0.57 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.684 0.794 . . . . 10.0 111.842 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.2 m -127.53 136.62 51.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.746 0.307 . . . . 10.0 110.567 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.11 -20.3 63.9 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.249 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 602' ' ' ARG . . . . . 0.423 ' O ' ' HD3' ' A' ' 602' ' ' ARG . 0.9 OUTLIER -64.64 -33.7 76.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.75 -179.793 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 16.2 t -67.57 -50.19 63.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.177 0.513 . . . . 10.0 109.752 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . 0.464 ' HB3' ' SD ' ' A' ' 595' ' ' MET . 0.0 OUTLIER -65.93 -35.8 81.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.08 179.173 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -61.25 -28.73 69.68 Favored Glycine 0 N--CA 1.45 -0.433 0 CA-C-N 115.788 -0.642 . . . . 10.0 112.637 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 14.9 tpt -66.6 -32.21 73.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.191 0.52 . . . . 10.0 110.253 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 67.5 mtt -74.12 -11.27 60.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.698 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -77.39 -0.61 26.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.08 0.467 . . . . 10.0 110.686 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -108.31 22.7 15.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.527 179.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.68 -12.29 57.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.436 -0.802 . . . . 10.0 111.235 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 93.67 -57.16 2.27 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.949 -0.643 . . . . 10.0 112.339 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 66.85 -79.34 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.27 0.628 . . . . 10.0 112.219 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? 67.62 95.4 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.34 0 O-C-N 123.67 0.606 . . . . 10.0 110.172 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 614' ' ' PRO . . . . . 0.443 ' HG3' ' HG2' ' A' ' 433' ' ' GLU . 53.6 Cg_exo -51.79 110.62 0.45 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.211 2.607 . . . . 10.0 113.412 -178.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 117.98 -22.21 9.92 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.012 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -92.79 98.44 11.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.189 0.518 . . . . 10.0 110.449 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -95.06 88.11 5.12 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.489 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -86.45 -12.2 11.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.777 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 69.62 142.41 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.66 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -144.13 93.25 6.04 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.337 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -62.73 -29.92 77.76 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.15 2.567 . . . . 10.0 113.805 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 64.8 p-90 -68.82 -17.72 64.05 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.055 0.391 . . . . 10.0 112.055 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.534 HG11 HG23 ' A' ' 427' ' ' VAL . 44.2 t -66.07 -51.25 62.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.779 0.323 . . . . 10.0 110.3 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 27.9 m -59.03 -34.65 72.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.233 0.54 . . . . 10.0 110.437 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -68.04 -41.93 81.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.988 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -65.45 -43.65 89.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.523 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 92.1 mt -63.34 -45.11 99.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.686 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -59.49 -42.68 92.71 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.914 0.388 . . . . 10.0 110.721 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -68.5 -39.41 81.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.351 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -62.11 -39.68 93.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.969 0.414 . . . . 10.0 110.154 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -61.46 -46.39 90.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.626 178.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.7 -34.09 69.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.432 -0.803 . . . . 10.0 110.915 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -62.75 -48.15 80.45 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.95 0.405 . . . . 10.0 110.519 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 48.1 t -62.97 -43.29 98.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.477 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 73.3 mt-10 -64.54 -43.23 94.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.676 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 49.9 m -62.91 -32.89 74.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.991 0.424 . . . . 10.0 110.161 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -67.89 -42.81 80.62 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -65.59 -40.29 92.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.302 179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -59.38 -40.57 86.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.255 178.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 640' ' ' ASP . . . . . 0.566 ' O ' ' HG2' ' A' ' 644' ' ' GLN . 33.1 t70 -60.11 -43.59 95.48 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 179.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 58.2 mt -66.11 -43.03 92.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.159 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 642' ' ' ARG . . . . . 0.431 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 7.6 mtm-85 -59.77 -40.71 89.11 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.142 -0.481 . . . . 10.0 109.731 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 19.7 ttpp -60.85 -41.98 96.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.494 -0.776 . . . . 10.0 110.599 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 644' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 9.8 mm100 -64.07 -43.33 95.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.577 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 87.3 mt -63.97 -44.14 93.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.198 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 646' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 97.1 mt -66.09 -30.24 70.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.277 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.07 -27.79 68.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.24 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -100.61 -32.41 10.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.888 0.375 . . . . 10.0 110.731 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -35.69 80.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.234 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -69.73 -22.98 63.34 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.988 0.423 . . . . 10.0 110.897 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 651' ' ' VAL . . . . . 0.432 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 48.5 t -64.71 -47.18 89.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.163 -0.68 . . . . 10.0 109.163 178.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -70.7 -28.49 64.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.517 -0.765 . . . . 10.0 109.503 178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -60.79 -52.31 65.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.362 -0.836 . . . . 10.0 110.617 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -60.04 -45.95 91.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.937 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 655' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 35.5 mt-30 -62.2 -41.73 98.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.626 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 11.4 ttp-105 -63.8 -48.53 76.52 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 52.0 ttp180 -57.54 -44.92 85.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.879 -0.6 . . . . 10.0 110.91 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.19 -53.55 51.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.902 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 8.5 tp -66.21 -33.31 62.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 121.028 -0.269 . . . . 10.0 111.356 -178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -69.86 -33.49 72.33 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 110.257 -0.275 . . . . 10.0 110.257 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 57.1 m -65.08 -39.13 92.78 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.78 -44.22 74.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.712 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 44.5 ttt-85 -62.97 -37.84 88.71 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.238 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -68.6 -35.71 77.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.325 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -63.62 -51.51 64.9 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.488 -0.56 . . . . 10.0 109.488 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 52.0 mt -65.91 -18.25 65.21 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.601 -0.727 . . . . 10.0 110.472 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 47.6 tp -80.42 -44.43 19.32 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.457 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.49 -43.15 60.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.991 -0.549 . . . . 10.0 112.351 -178.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 34.3 m -67.68 149.31 11.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-O 121.203 0.525 . . . . 10.0 111.73 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.47 -31.71 11.85 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.672 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -101.61 146.47 27.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.125 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 672' ' ' VAL . . . . . 0.443 ' O ' HG12 ' A' ' 676' ' ' ILE . 9.5 p -143.47 10.75 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.958 0.409 . . . . 10.0 110.69 -179.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.85 -43.61 86.01 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.036 0.446 . . . . 10.0 110.942 -179.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -62.33 -50.34 72.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.84 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 675' ' ' THR . . . . . 0.404 ' O ' HG12 ' A' ' 679' ' ' ILE . 1.8 m -56.95 -46.41 82.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.022 -0.536 . . . . 10.0 111.33 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 676' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 672' ' ' VAL . 46.4 mm -61.73 -44.23 98.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.942 0.401 . . . . 10.0 110.932 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -67.27 -41.41 85.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.311 -0.404 . . . . 10.0 111.459 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 40.2 m -62.35 -44.98 95.21 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 679' ' ' ILE . . . . . 0.459 ' O ' HG23 ' A' ' 683' ' ' VAL . 47.2 pt -74.79 -26.38 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 C-N-CA 120.535 -0.466 . . . . 10.0 110.669 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -59.63 -42.04 91.82 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.209 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -60.88 -47.13 87.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.657 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.75 -47.7 77.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.152 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 683' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 679' ' ' ILE . 81.0 t -58.66 -51.91 66.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.314 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -60.57 -42.84 97.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.126 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.1 tttm -63.39 -49.77 72.49 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 121.16 -0.216 . . . . 10.0 110.554 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.92 -41.85 88.3 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.44 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 23.9 m -65.41 -40.77 93.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.022 0.439 . . . . 10.0 110.597 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 84.1 mt -67.43 -42.2 86.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.487 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -57.23 -24.96 58.14 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 122.755 0.422 . . . . 10.0 111.946 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -75.63 -28.45 58.82 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -108.21 -24.64 11.43 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.096 0.474 . . . . 10.0 111.161 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 692' ' ' ILE . . . . . 0.5 HG23 ' CD1' ' A' ' 701' ' ' TRP . 84.6 mt -132.91 99.89 14.87 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.41 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -62.14 139.91 80.89 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.427 2.085 . . . . 10.0 111.571 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.82 113.88 1.59 Allowed 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.813 2.342 . . . . 10.0 112.855 -179.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 58.13 67.37 0.96 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.215 -0.902 . . . . 10.0 111.942 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 14.3 p -127.35 177.81 6.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.199 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 18.6 mt -75.88 154.54 35.99 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -59.18 -26.98 65.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.378 . . . . 10.0 111.598 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -67.06 -14.23 62.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.554 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 700' ' ' MET . . . . . 0.403 ' HA ' ' HB2' ' B' ' 2' ' ' MET . 1.7 mpt? -104.96 7.43 34.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.626 -0.261 . . . . 10.0 111.041 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 701' ' ' TRP . . . . . 0.5 ' CD1' HG23 ' A' ' 692' ' ' ILE . 41.7 m0 -101.23 106.3 17.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.742 0.306 . . . . 10.0 111.099 -179.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 58.7 t0 -82.51 77.58 9.26 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 703' ' ' ILE . . . . . 0.511 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 24.2 mm -57.76 -49.9 91.17 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.652 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 704' ' ' PRO . . . . . 0.511 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 32.2 Cg_exo -60.14 -42.0 46.9 Favored 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 121.894 1.729 . . . . 10.0 111.718 179.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -63.81 -44.8 95.67 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.622 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 55.6 tp -65.06 -40.99 95.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.189 -0.301 . . . . 10.0 110.189 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -62.04 -48.11 81.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.512 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -59.42 -42.23 91.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.02 -0.537 . . . . 10.0 110.235 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -63.46 -43.44 97.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.548 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 49.6 mt -64.07 -42.62 96.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.297 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 14.3 mtpp -76.1 -6.05 49.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.451 -0.341 . . . . 10.0 111.881 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -111.84 -56.54 2.37 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.484 0.55 . . . . 10.0 112.484 -178.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -83.73 -19.22 35.56 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 112.879 0.696 . . . . 10.0 112.879 -177.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -123.02 -8.92 8.27 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.465 -0.494 . . . . 10.0 112.123 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.98 21.79 12.59 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.019 0.438 . . . . 10.0 110.758 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 12.8 tp -97.65 109.88 22.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.407 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -91.47 92.32 8.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.918 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 40.0 mt -123.4 122.7 26.65 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.399 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -82.36 77.99 3.57 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.8 2.334 . . . . 10.0 112.186 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 44.7 mt -61.43 -37.24 77.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.197 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.45 4.35 4.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.883 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -109.18 -0.88 19.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.865 0.364 . . . . 10.0 110.211 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 15.9 m0 -114.44 -44.92 3.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.676 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 11.1 tp -60.33 -16.51 35.47 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.358 0.873 . . . . 10.0 113.358 -177.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -90.27 -32.67 16.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.994 0.426 . . . . 10.0 111.075 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 726' ' ' LYS . . . . . 0.519 ' O ' ' HD3' ' A' ' 728' ' ' PRO . 40.3 mttp -93.34 -23.19 18.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.925 -178.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -109.36 94.74 16.54 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-O 120.752 0.311 . . . . 10.0 110.725 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . 0.519 ' HD3' ' O ' ' A' ' 726' ' ' LYS . 11.7 Cg_exo -71.66 -16.81 30.06 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.939 2.426 . . . . 10.0 112.41 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.28 21.42 17.53 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.111 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.73 -28.35 66.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 178.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.71 -134.58 0.57 Allowed 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.44 179.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.35 -56.25 1.24 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.066 0.46 . . . . 10.0 110.564 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 733' ' ' GLU . . . . . 0.489 ' HG2' ' N ' ' A' ' 734' ' ' THR . 20.2 pm0 -60.67 -38.95 86.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.758 -0.655 . . . . 10.0 111.8 -178.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . 0.489 ' N ' ' HG2' ' A' ' 733' ' ' GLU . 0.1 OUTLIER -65.68 -27.59 68.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.974 0.416 . . . . 10.0 110.794 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 50.2 tp -69.04 -40.41 78.6 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 -64.38 -41.15 96.84 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.858 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -60.21 -40.82 91.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.687 -0.688 . . . . 10.0 110.701 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 21.6 mmm-85 -61.15 -50.64 72.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.795 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 55.4 mt -60.38 -43.6 94.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.652 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 740' ' ' LEU . . . . . 0.428 ' O ' HG13 ' A' ' 744' ' ' ILE . 16.5 tp -63.93 -50.95 66.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.001 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.83 86.54 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.24 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 742' ' ' GLN . . . . . 0.405 ' O ' HG23 ' A' ' 746' ' ' VAL . 16.6 tp60 -64.95 -39.51 93.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.744 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 24.5 p -63.44 -33.54 75.77 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.062 0.458 . . . . 10.0 110.033 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 744' ' ' ILE . . . . . 0.522 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 66.7 mt -70.41 -43.98 77.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -48.93 79.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.34 -0.846 . . . . 10.0 111.114 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 742' ' ' GLN . 57.9 t -64.32 -36.66 77.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.065 0.46 . . . . 10.0 110.261 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.48 -43.22 99.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.332 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 748' ' ' GLN . . . . . 0.522 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 23.4 mt-30 -58.75 -37.93 77.32 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.748 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 749' ' ' ARG . . . . . 0.447 ' O ' HG23 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -62.58 -46.01 90.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.477 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -65.5 -37.56 87.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.08 0.467 . . . . 10.0 109.888 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -64.1 -41.89 97.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.222 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -64.52 -29.82 70.85 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 749' ' ' ARG . 54.9 t -78.74 -48.96 21.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.824 0.345 . . . . 10.0 111.37 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 38.9 t -74.07 -52.04 21.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.961 0.41 . . . . 10.0 111.637 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 139.77 141.61 4.09 Favored Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.301 -0.719 . . . . 10.0 111.301 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 756' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -60.94 -63.2 1.38 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.783 0.291 . . . . 10.0 111.458 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -60.19 -37.87 81.54 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.729 0.299 . . . . 10.0 110.701 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 14.6 tpt -61.19 -45.21 95.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.046 -0.524 . . . . 10.0 110.27 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 45.0 mmm -65.23 -41.34 94.48 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.49 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.4 mmp_? -59.35 -41.4 89.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.255 0.55 . . . . 10.0 109.997 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -70.48 -33.86 71.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.897 -0.592 . . . . 10.0 109.829 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -65.24 -52.41 54.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.542 -0.754 . . . . 10.0 109.772 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -58.91 -45.31 90.64 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.175 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 764' ' ' LYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 768' ' ' LEU . 50.9 tttp -56.11 -47.7 77.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.494 -0.775 . . . . 10.0 110.163 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -68.64 -38.88 86.53 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 121.003 -0.617 . . . . 10.0 112.079 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 30.2 t -61.89 -45.41 98.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 110.523 -0.177 . . . . 10.0 110.523 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 37.8 mtp -59.2 -46.13 89.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.73 -0.213 . . . . 10.0 110.516 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 768' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 764' ' ' LYS . 85.1 mt -64.46 -47.92 77.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.494 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -58.42 -46.58 86.19 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.011 -0.541 . . . . 10.0 110.94 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 19.3 m -63.7 -38.77 92.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.925 0.393 . . . . 10.0 110.563 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.65 -50.56 72.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.788 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -63.46 -29.95 71.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.702 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 69.1 m -68.05 -43.86 77.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.911 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.16 -25.44 34.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.731 0.301 . . . . 10.0 111.109 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 27.2 t-105 -63.68 -49.45 73.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.565 -0.289 . . . . 10.0 111.3 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.456 ' HE2' ' HB3' ' B' ' 22' ' ' MET . 8.5 ptpp? -59.58 -39.26 83.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.81 0.338 . . . . 10.0 110.547 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 777' ' ' GLU . . . . . 0.499 ' HG2' ' HG3' ' A' ' 305' ' ' MET . 10.6 tt0 -68.42 -39.93 81.4 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 121.204 0.526 . . . . 10.0 109.985 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 68.0 t60 -62.24 -38.17 88.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.274 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 80.7 mt -65.41 -47.16 77.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.488 179.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -63.81 -46.16 86.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.759 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -60.56 -41.62 94.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.128 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 51.1 mmm -63.16 -42.33 99.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.734 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -68.31 -36.64 79.62 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.099 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -69.69 -32.99 71.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.43 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.55 -37.29 60.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.962 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -60.96 -50.79 71.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.35 -0.841 . . . . 10.0 111.075 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -70.29 -16.51 63.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.944 0.402 . . . . 10.0 110.986 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -97.93 11.23 64.24 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.015 -0.612 . . . . 10.0 112.224 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 16.3 tt -61.77 -19.71 21.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 121.056 0.455 . . . . 10.0 111.069 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -64.95 -25.8 68.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.332 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 34.9 tp -98.99 -16.47 18.71 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.314 0.578 . . . . 10.0 110.437 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 792' ' ' ARG . . . . . 0.502 ' HD2' ' OE2' ' A' ' 806' ' ' GLU . 12.8 mmt180 -82.91 -45.0 14.73 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.637 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -74.93 107.22 2.23 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.735 -0.745 . . . . 10.0 112.263 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 26.4 p90 -99.73 176.59 5.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.892 0.377 . . . . 10.0 111.046 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -63.36 149.31 46.12 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.348 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 65.33 25.65 12.1 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.648 -0.706 . . . . 10.0 111.094 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -147.01 152.73 39.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.601 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -100.26 134.52 20.72 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.137 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.99 -27.44 84.78 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.676 2.25 . . . . 10.0 112.0 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -81.46 155.39 25.86 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 73.09 -49.43 0.7 Allowed 'General case' 0 N--CA 1.468 0.448 0 O-C-N 123.578 0.549 . . . . 10.0 111.166 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . 0.46 ' OE2' ' HD3' ' A' ' 805' ' ' ARG . 3.1 tp10 -65.16 -47.65 76.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.069 0.461 . . . . 10.0 109.83 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -61.8 -34.73 76.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.858 -0.61 . . . . 10.0 109.87 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -63.63 -36.24 83.17 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.922 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 805' ' ' ARG . . . . . 0.46 ' HD3' ' OE2' ' A' ' 802' ' ' GLU . 44.8 mtp180 -58.5 -43.59 89.1 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.153 0.502 . . . . 10.0 109.718 178.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 806' ' ' GLU . . . . . 0.502 ' OE2' ' HD2' ' A' ' 792' ' ' ARG . 2.8 mm-40 -62.6 -44.79 95.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.964 179.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 6.2 m -61.02 -39.82 91.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.713 -0.676 . . . . 10.0 110.966 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -71.99 -38.01 69.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.865 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 40.2 m -62.94 -39.66 95.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.06 0.457 . . . . 10.0 109.946 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 18.9 ttm -66.74 -37.21 84.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.086 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 811' ' ' PHE . . . . . 0.43 ' O ' ' HG ' ' A' ' 815' ' ' LEU . 27.4 t80 -65.7 -41.98 91.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.348 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.29 -45.88 92.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.654 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.72 -37.27 85.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.13 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 22.9 ttt -62.83 -44.31 96.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.597 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 815' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 811' ' ' PHE . 94.1 mt -62.06 -41.53 98.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.846 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -64.21 -45.95 86.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.241 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 11.7 m -65.02 -35.8 82.34 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.992 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 63.6 tp -56.07 -51.01 69.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.639 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -62.49 -42.09 99.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.225 0.536 . . . . 10.0 110.399 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -58.88 -57.45 12.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.196 -0.911 . . . . 10.0 111.629 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -59.97 -42.95 95.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.076 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 30.4 t -58.44 -52.55 57.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.561 0.219 . . . . 10.0 110.614 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 35.4 mm -63.77 -41.24 91.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.695 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 37.1 t -56.83 -49.42 75.47 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.736 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 16.7 m -63.16 -37.96 89.28 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.323 -0.398 . . . . 10.0 111.75 -179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 93.5 mt -75.56 -17.03 60.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.553 -179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 16.3 m -95.94 -41.75 8.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.997 0.427 . . . . 10.0 110.627 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -77.34 -1.01 27.78 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.867 -0.606 . . . . 10.0 112.453 -178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.0 p -64.59 118.37 6.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.439 0.638 . . . . 10.0 110.065 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -80.44 106.16 12.25 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.237 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 61.5 t -119.66 137.87 52.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.148 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 27.9 ptt-85 -63.83 133.95 54.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.06 0.457 . . . . 10.0 110.635 179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -93.05 136.97 23.97 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.235 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -78.81 -162.45 0.18 Allowed 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.669 2.246 . . . . 10.0 112.363 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.55 105.95 4.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.66 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.5 -0.762 . . . . 10.0 110.188 179.788 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.614 ' HG3' ' SD ' ' B' ' 2' ' ' MET . 16.1 tpt . . . . . 0 N--CA 1.478 0.945 0 N-CA-C 110.287 -0.264 . . . . 10.0 110.287 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . 0.614 ' SD ' ' HG3' ' B' ' 1' ' ' MET . 0.4 OUTLIER -112.32 109.59 19.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.705 -0.225 . . . . 10.0 110.918 179.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 25.1 pt -136.11 158.85 38.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.186 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 23.9 p -93.0 153.9 18.46 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.368 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.446 ' O ' ' HD3' ' B' ' 7' ' ' LYS . 10.5 tp -66.24 131.31 45.85 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.711 -0.477 . . . . 10.0 109.711 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 1.5 tpp180 -94.68 86.58 4.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.193 0.521 . . . . 10.0 110.015 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . 0.446 ' HD3' ' O ' ' B' ' 5' ' ' LEU . 0.0 OUTLIER -85.64 154.67 21.53 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.565 -0.743 . . . . 10.0 110.352 -179.738 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 20.6 ttp-105 -80.14 -25.37 39.9 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.033 -0.728 . . . . 10.0 109.033 178.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -95.61 120.32 35.66 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.115 -0.948 . . . . 10.0 108.724 178.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 23.6 pttt -142.94 108.82 5.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.73 0.3 . . . . 10.0 110.78 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 18.2 tp -166.92 70.22 1.02 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.974 0.416 . . . . 10.0 110.546 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -71.79 -26.57 19.01 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.484 2.123 . . . . 10.0 111.688 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.59 1.57 22.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.333 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . 0.486 ' HB3' HD12 ' A' ' 291' ' ' ILE . . . -53.47 -36.57 61.78 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.398 -0.365 . . . . 10.0 111.904 -179.248 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 14.5 t -64.65 -60.38 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.788 0.328 . . . . 10.0 111.142 -179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.27 88.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.921 -0.581 . . . . 10.0 111.855 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.29 -42.39 95.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.733 0.301 . . . . 10.0 110.706 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . 0.48 ' HB1' ' HA ' ' A' ' 231' ' ' ASP . . . -66.73 -39.87 88.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.858 0.361 . . . . 10.0 111.144 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.83 -13.4 59.9 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.31 0.576 . . . . 10.0 110.764 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -89.15 -7.03 70.61 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.486 -0.779 . . . . 10.0 112.7 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 64.8 t -59.96 -39.41 80.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-O 120.958 0.409 . . . . 10.0 110.048 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.577 ' HG2' ' HB3' ' A' ' 229' ' ' ALA . 0.0 OUTLIER -78.04 77.89 4.53 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.114 0.483 . . . . 10.0 109.966 178.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.2 m -146.34 -164.91 2.08 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.251 -0.886 . . . . 10.0 109.323 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.1 123.75 18.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.943 0.401 . . . . 10.0 110.613 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -90.63 103.81 16.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.61 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -75.71 85.01 2.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.332 0.586 . . . . 10.0 110.736 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 50.3 mtm -80.31 113.91 18.83 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.652 -0.704 . . . . 10.0 111.073 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.56 -0.733 . . . . 10.0 110.267 179.375 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 38.3 t . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.614 0.245 . . . . 10.0 110.385 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -77.09 150.23 35.68 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.864 -179.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 142.58 165.16 10.46 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.898 -0.592 . . . . 10.0 111.842 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.44 ' H ' ' HD3' ' A' ' 16' ' ' ARG . 0.7 OUTLIER -57.28 133.45 55.11 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 122.413 0.285 . . . . 10.0 110.566 179.661 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.517 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 5.1 mmp_? -58.52 137.72 57.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.739 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 68.17 -83.67 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.328 -0.851 . . . . 10.0 112.543 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -41.08 -68.13 0.2 Allowed 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.497 1.295 . . . . 10.0 114.497 -177.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.44 ' HD3' ' H ' ' A' ' 12' ' ' SER . 44.0 ttt180 -64.32 -43.01 96.01 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.48 0.548 . . . . 10.0 112.48 -177.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.89 -39.34 88.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.15 0.426 . . . . 10.0 112.15 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.5 mt -61.17 -53.94 50.66 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.08 0.4 . . . . 10.0 112.08 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -66.66 -24.22 66.25 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.57 -0.452 . . . . 10.0 110.953 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.07 -42.44 56.89 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 60.5 mtt -68.5 -32.3 72.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.817 -0.628 . . . . 10.0 109.667 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -57.5 -32.96 67.54 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.502 -0.772 . . . . 10.0 110.453 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -63.36 -43.72 96.85 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.182 0.515 . . . . 10.0 109.843 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.64 -41.94 91.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.391 -0.822 . . . . 10.0 109.943 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.455 ' HA ' HD12 ' A' ' 28' ' ' ILE . 97.5 t -60.72 -37.07 74.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.681 -0.69 . . . . 10.0 110.117 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -63.24 -43.12 98.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.66 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 82.3 mt -61.95 -45.57 98.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.986 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.455 HD12 ' HA ' ' A' ' 25' ' ' VAL . 55.8 mt -59.66 -40.29 81.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.346 179.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -63.84 -33.55 75.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.862 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.439 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -82.56 -26.94 31.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.479 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 13.4 ttt -83.3 -16.42 46.32 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.69 0.281 . . . . 10.0 110.814 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.477 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 27.5 tt0 -59.49 -51.93 77.77 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 116.352 -0.385 . . . . 10.0 111.728 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.477 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 51.8 Cg_exo -56.28 -28.3 70.98 Favored 'Trans proline' 0 C--N 1.361 1.214 0 C-N-CA 121.844 1.696 . . . . 10.0 111.949 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -73.1 -42.09 63.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.835 -0.62 . . . . 10.0 109.908 179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 25.4 mmt -66.31 -27.83 68.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.435 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 83.7 mt-10 -62.48 -23.48 66.94 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.839 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 mtpt -86.17 -14.32 44.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.069 0.461 . . . . 10.0 110.589 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 7.8 mp -87.48 140.51 29.45 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.321 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.6 p -76.28 171.67 14.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.649 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.04 -38.24 82.18 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.894 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -70.55 -32.01 69.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.554 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -66.94 -34.74 78.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.276 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.2 mt -62.93 -44.79 95.12 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.896 -0.779 . . . . 10.0 108.896 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -63.4 -28.05 69.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.926 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -69.65 -34.3 72.65 Favored Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 115.421 -0.808 . . . . 10.0 111.449 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -68.89 -39.34 79.82 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.6 m -60.21 -44.24 95.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.103 0.478 . . . . 10.0 109.915 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -38.32 88.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.653 -0.703 . . . . 10.0 110.055 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -60.5 -40.07 90.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.388 -0.824 . . . . 10.0 110.375 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -62.77 -43.42 98.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.321 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -58.48 -46.83 85.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.357 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.571 ' O ' ' HG3' ' A' ' 56' ' ' LYS . . . -68.83 -44.39 73.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.302 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 33.5 mtp180 -58.23 -40.27 81.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.786 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 72.6 mt -62.76 -38.5 90.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 10.0 110.626 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -72.45 -23.93 61.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.301 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' A' ' 52' ' ' ALA . 20.5 mtpp -83.22 -66.96 0.83 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.77 0.319 . . . . 10.0 110.422 179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 178.22 67.07 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 121.071 -0.585 . . . . 10.0 111.918 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -133.39 150.6 51.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.809 0.338 . . . . 10.0 110.203 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.1 t -100.15 133.66 42.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.892 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.563 HD11 ' O ' ' A' ' 118' ' ' LEU . 17.1 tp -60.35 -41.41 93.57 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.096 0.474 . . . . 10.0 110.608 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.7 mp0 -68.04 -8.99 42.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.255 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -100.15 -15.18 18.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.38 0.61 . . . . 10.0 109.963 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 55.4 mt -89.1 -5.49 57.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.829 -0.623 . . . . 10.0 111.516 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.498 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 66.6 mt -49.54 -51.01 62.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 113.256 0.835 . . . . 10.0 113.256 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.498 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 32.1 Cg_exo -57.3 -48.19 18.83 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.829 1.686 . . . . 10.0 112.957 -179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.451 ' O ' HG23 ' A' ' 70' ' ' VAL . 39.4 mt-10 -71.01 -43.47 67.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.719 -178.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.497 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -61.88 -51.44 68.19 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.061 0.393 . . . . 10.0 112.061 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -61.92 -34.17 75.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.325 -178.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.44 -45.01 92.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.415 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 66' ' ' GLU . 85.6 t -60.86 -46.39 96.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.334 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 67' ' ' ALA . 29.1 t -60.87 -46.08 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.677 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.415 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 2.7 ttt180 -59.82 -43.02 94.76 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.682 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.3 tp10 -64.49 -47.56 78.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.83 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.41 72.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.572 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.5 m -58.45 -40.94 83.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.301 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -71.14 -21.21 62.22 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -178.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -96.21 -44.38 7.3 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.841 -0.344 . . . . 10.0 111.731 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 67.1 t -74.1 -53.13 18.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.647 0.261 . . . . 10.0 111.628 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -98.87 -47.47 5.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.131 0.491 . . . . 10.0 111.213 -178.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 119.54 -34.24 4.33 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.217 -0.753 . . . . 10.0 111.217 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.6 mpt? -77.99 139.62 39.15 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.01 -0.367 . . . . 10.0 110.01 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.1 ttp180 -91.13 139.04 31.13 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.583 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.89 114.96 3.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.079 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -61.31 152.48 29.16 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.056 0.455 . . . . 10.0 111.822 -178.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -41.83 94.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.511 -0.768 . . . . 10.0 111.77 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -63.65 -31.61 53.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.116 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.532 HE22 HD23 ' A' ' 110' ' ' LEU . 97.9 mt-30 -70.19 -31.34 68.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.253 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.22 -31.75 73.07 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.465 ' O ' HG23 ' A' ' 93' ' ' VAL . 39.1 mt -73.77 -48.82 28.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.806 -0.634 . . . . 10.0 109.438 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.88 -40.84 99.38 Favored Glycine 0 N--CA 1.451 -0.318 0 CA-C-N 115.779 -0.646 . . . . 10.0 112.508 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.32 -28.66 73.34 Favored Glycine 0 N--CA 1.444 -0.826 0 N-CA-C 112.026 -0.43 . . . . 10.0 112.026 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 16.4 ttm -74.34 -37.6 63.5 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.818 -0.438 . . . . 10.0 109.818 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 89' ' ' LEU . 58.8 t -66.82 -33.78 65.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.03 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.1 mt -74.29 -2.69 26.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.562 -0.745 . . . . 10.0 112.141 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -83.13 -35.05 25.9 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 178.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -96.35 178.02 5.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.194 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -79.07 71.33 5.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.066 0.46 . . . . 10.0 110.443 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 56.2 m -143.74 154.35 43.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.27 -0.423 . . . . 10.0 111.445 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.553 HD12 HG11 ' A' ' 211' ' ' VAL . 41.1 mm -103.29 136.48 35.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 178.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -116.18 126.99 54.42 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 111.929 0.344 . . . . 10.0 111.929 -179.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -87.54 121.04 29.46 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.106 -0.701 . . . . 10.0 109.106 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.42 ' SD ' ' HG2' ' A' ' 108' ' ' LYS . 45.5 ttm -112.63 158.58 19.82 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.974 0.416 . . . . 10.0 111.271 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 103' ' ' ARG . 9.9 mmm180 -95.02 157.38 15.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.25 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.43 108.04 7.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.39 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 132.31 -28.36 3.47 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.485 -0.864 . . . . 10.0 112.926 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.601 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 4.4 mm-40 -60.47 -51.02 71.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.018 0.437 . . . . 10.0 110.542 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 114.71 99.52 2.28 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.806 -0.711 . . . . 10.0 112.469 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.42 ' HG2' ' SD ' ' A' ' 102' ' ' MET . 40.2 mtmt -69.8 -45.5 67.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.657 0.265 . . . . 10.0 111.054 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 73.4 m -62.07 -34.16 75.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.269 0.556 . . . . 10.0 110.68 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.532 HD23 HE22 ' A' ' 87' ' ' GLN . 13.3 tp -81.14 -1.99 46.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.998 -179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 42.2 m -110.81 -42.71 3.95 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.895 0.378 . . . . 10.0 110.464 179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.52 -13.56 59.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.975 -0.557 . . . . 10.0 112.155 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -24.98 63.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.462 -0.335 . . . . 10.0 111.799 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.416 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 55.5 mt -73.63 -57.16 2.68 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 31.6 Cg_endo -62.11 -32.34 83.31 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.108 1.872 . . . . 10.0 112.118 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -63.92 -48.29 77.16 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.385 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.415 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 57.1 t80 -63.47 -46.97 83.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.488 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.563 ' O ' HD11 ' A' ' 60' ' ' LEU . 52.1 tp -58.85 -51.1 71.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.706 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -72.26 -21.78 61.32 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.693 0.257 . . . . 10.0 111.693 -178.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.472 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -70.22 -26.64 63.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.877 0.37 . . . . 10.0 110.861 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 58.8 mt -58.72 -32.32 69.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.218 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 69.0 p -64.23 -35.56 81.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.244 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.06 19.26 59.51 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.914 -0.66 . . . . 10.0 112.303 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 64.1 mmtt -87.36 -26.77 23.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.938 0.399 . . . . 10.0 110.881 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 109.1 105.77 2.99 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.771 -0.728 . . . . 10.0 112.922 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 78.4 t -79.35 115.66 22.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 109.779 -0.452 . . . . 10.0 109.779 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -93.56 99.05 11.58 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.741 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 40.5 t -92.21 118.9 38.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.957 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 52.4 t -104.8 119.71 54.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.854 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.11 155.7 19.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.275 -0.42 . . . . 10.0 110.764 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 5.1 m -64.71 -36.94 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.899 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -139.0 162.66 34.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.766 0.317 . . . . 10.0 110.631 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.88 -24.12 63.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.406 -178.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -62.68 -55.24 28.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.82 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 83.2 mt -68.71 -33.08 73.34 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.595 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.75 -50.8 69.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.976 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -72.55 -35.63 68.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.725 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -58.92 -57.33 13.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.724 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.76 -32.63 74.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.001 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.7 -49.15 77.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.997 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.415 ' O ' ' HD3' ' A' ' 145' ' ' PRO . 54.4 mm-40 -78.53 -28.26 46.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.472 -179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -71.38 -43.0 67.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.015 0.436 . . . . 10.0 111.08 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 -88.77 -1.66 58.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.119 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.499 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 60.6 ttm-85 -64.87 -50.16 64.68 Favored Pre-proline 0 CA--C 1.535 0.404 0 N-CA-C 112.484 0.55 . . . . 10.0 112.484 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' PRO . . . . . 0.499 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 32.4 Cg_exo -60.69 -14.39 31.28 Favored 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 122.102 1.868 . . . . 10.0 112.62 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 14.3 tp -89.07 -56.49 3.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.405 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -65.87 -46.74 77.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 10.0 112.186 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -64.95 -25.57 67.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.781 0.324 . . . . 10.0 111.591 -178.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -77.45 -22.93 50.68 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.071 0.462 . . . . 10.0 110.306 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 81.8 mt -93.17 -6.73 47.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.659 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 103.74 8.16 40.45 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.515 -0.85 . . . . 10.0 113.585 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 91.8 mt -96.91 138.7 34.06 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.1 0.45 . . . . 10.0 110.592 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.35 130.65 34.44 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.279 -179.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.426 HG21 ' HA ' ' A' ' 144' ' ' ARG . 47.2 t -111.45 123.03 66.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.941 0.4 . . . . 10.0 110.689 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -120.57 150.46 17.37 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.993 -0.622 . . . . 10.0 112.278 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 4.3 tp -123.81 133.2 69.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 110.006 -0.368 . . . . 10.0 110.006 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -118.98 116.48 26.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.451 -0.34 . . . . 10.0 110.407 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.505 ' O ' ' HB2' ' A' ' 161' ' ' MET . 94.7 mt -109.06 146.07 33.08 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.482 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' PRO . . . . . 0.567 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 15.2 Cg_endo -58.46 115.08 2.28 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 C-N-CA 122.655 2.236 . . . . 10.0 112.22 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.85 5.24 56.6 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.785 -0.722 . . . . 10.0 112.746 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . 0.505 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.3 OUTLIER -65.87 151.96 94.15 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.555 0.177 . . . . 10.0 110.809 179.496 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -61.33 147.0 96.69 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.496 2.131 . . . . 10.0 111.866 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . 0.487 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -53.82 -49.71 87.79 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 112.384 0.513 . . . . 10.0 112.384 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.487 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 52.2 Cg_exo -56.59 -44.87 41.45 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 121.819 1.68 . . . . 10.0 112.205 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -61.81 -41.69 98.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.67 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -62.25 -44.47 96.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.456 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' ARG . . . . . 0.438 ' CG ' ' HA ' ' A' ' 199' ' ' VAL . 74.9 mtt180 -59.68 -40.52 88.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.005 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.99 -35.07 74.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.882 0.373 . . . . 10.0 110.437 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -68.62 -39.11 80.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.746 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -80.94 -12.84 59.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.59 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -85.66 -9.6 56.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.32 0.581 . . . . 10.0 109.463 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -80.13 165.03 22.87 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.285 -0.87 . . . . 10.0 109.895 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . 0.472 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 17.2 m-20 -70.54 -37.05 74.0 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.805 0.336 . . . . 10.0 110.76 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.3 mp -126.52 122.59 61.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.061 179.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 5.8 m -115.7 121.01 41.24 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.886 0.374 . . . . 10.0 111.18 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -99.74 141.67 32.23 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -177.83 172.62 45.26 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.34 -0.933 . . . . 10.0 112.895 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.87 153.45 21.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.805 0.336 . . . . 10.0 111.15 179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -63.31 -35.92 81.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.899 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -59.49 -52.19 66.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.169 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.567 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.8 tp10 -69.79 -37.53 76.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.566 -0.288 . . . . 10.0 111.102 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -56.8 -36.04 69.43 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.974 0.416 . . . . 10.0 110.834 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -77.88 -40.03 22.66 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.804 -0.713 . . . . 10.0 111.694 178.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -64.3 -40.03 95.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.581 0.229 . . . . 10.0 110.58 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -60.43 -41.43 93.99 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.104 0.478 . . . . 10.0 109.973 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . 0.434 ' HA ' HE22 ' A' ' 200' ' ' GLN . 43.7 t80 -62.25 -39.54 93.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.518 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' LEU . . . . . 0.4 HD22 ' HB1' ' A' ' 373' ' ' ALA . 87.1 mt -67.4 -44.02 79.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.989 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 64.1 mtm-85 -65.48 -43.56 89.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.953 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' ASP . . . . . 0.411 ' OD1' ' HA ' ' A' ' 198' ' ' ARG . 16.3 m-20 -62.93 -32.91 74.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.79 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -85.27 -0.61 55.24 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.484 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 24.8 ttp -121.58 10.6 10.44 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.819 0.343 . . . . 10.0 110.848 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -69.74 172.18 7.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.07 -0.513 . . . . 10.0 111.111 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -107.09 -30.02 9.04 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.167 0.508 . . . . 10.0 110.394 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 197' ' ' GLU . 0.1 OUTLIER -115.42 140.07 25.4 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.734 -0.667 . . . . 10.0 109.577 179.136 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.15 -28.61 87.33 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.696 2.264 . . . . 10.0 113.031 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.02 0.63 52.87 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 121.151 -0.219 . . . . 10.0 111.417 -179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 194' ' ' SER . 32.9 mt-10 -80.06 -11.32 59.78 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 121.234 -0.186 . . . . 10.0 110.71 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' ARG . . . . . 0.411 ' HA ' ' OD1' ' A' ' 189' ' ' ASP . 66.2 mtt180 -58.17 142.42 47.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.622 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 199' ' ' VAL . . . . . 0.438 ' HA ' ' CG ' ' A' ' 167' ' ' ARG . 28.9 m -94.77 -26.7 4.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.482 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' GLN . . . . . 0.434 HE22 ' HA ' ' A' ' 186' ' ' TYR . 4.1 pt20 -107.63 159.73 16.23 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.889 0.376 . . . . 10.0 110.705 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 55.3 mtm180 -82.4 -66.18 0.92 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.75 172.82 7.61 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.497 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . 0.436 HD22 ' CZ ' ' A' ' 384' ' ' TYR . 19.5 mt -102.68 124.97 49.21 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -140.59 -56.5 0.52 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.916 0.388 . . . . 10.0 110.325 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -127.12 136.37 52.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.64 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.493 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -132.05 127.29 35.84 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.084 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 47.5 tp -125.65 109.89 13.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.702 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.16 132.26 46.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.214 0.53 . . . . 10.0 111.109 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -49.54 77.38 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.237 -0.892 . . . . 10.0 112.243 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.52 103.97 6.44 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.927 0.394 . . . . 10.0 110.362 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.553 HG11 HD12 ' A' ' 99' ' ' ILE . 30.9 m -74.05 -18.35 17.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.754 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . 0.437 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.3 m-20 -46.11 -74.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.772 -0.649 . . . . 10.0 112.561 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 66.0 m -86.84 -19.86 28.34 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.78 0.659 . . . . 10.0 112.78 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 50.3 mt -77.7 -38.98 26.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.316 0.488 . . . . 10.0 112.316 -178.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 215' ' ' LEU . . . . . 0.409 ' O ' ' HB2' ' A' ' 219' ' ' ALA . 18.4 mt -98.44 -42.35 7.37 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -178.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 216' ' ' ILE . . . . . 0.437 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 49.5 mm -81.83 -59.04 3.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 112.575 0.583 . . . . 10.0 112.575 -178.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -67.6 -34.36 76.85 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.05 0.759 . . . . 10.0 113.05 -177.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 218' ' ' GLU . . . . . 0.436 ' O ' ' HB2' ' A' ' 377' ' ' PHE . 7.5 mm-40 -97.69 15.8 22.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.66 0.267 . . . . 10.0 111.718 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 215' ' ' LEU . . . -60.14 -49.54 77.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.936 0.398 . . . . 10.0 111.84 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 220' ' ' ARG . . . . . 0.562 ' O ' ' HD3' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -97.59 32.8 2.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.1 0.476 . . . . 10.0 111.511 -178.436 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 10.0 m -105.25 106.69 56.79 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 109.969 -0.382 . . . . 10.0 109.969 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -91.52 125.65 0.92 Allowed 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.918 2.412 . . . . 10.0 113.318 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 223' ' ' LEU . . . . . 0.538 ' O ' ' HA ' ' A' ' 374' ' ' SER . 88.0 mt -79.8 110.43 15.15 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 178.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 55.7 mt -108.48 130.64 60.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.035 0.445 . . . . 10.0 111.715 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 9.4 mt -101.19 144.88 12.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 1.5 m -81.24 119.97 24.3 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.903 0.382 . . . . 10.0 111.581 -179.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 227' ' ' GLY . . . . . 0.439 ' H ' ' C ' ' A' ' 370' ' ' GLN . . . -108.23 -157.0 19.08 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 121.249 -0.5 . . . . 10.0 112.665 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -87.99 -32.07 0.18 Allowed 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 123.125 2.55 . . . . 10.0 114.216 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . 65.58 -159.46 0.27 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.046 0.539 . . . . 10.0 111.487 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -68.75 102.04 1.45 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.222 0.534 . . . . 10.0 110.987 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.11 -47.05 10.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.61 -0.723 . . . . 10.0 111.256 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.67 87.3 2.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.357 -178.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 69.8 m -78.16 40.43 0.34 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.297 0.57 . . . . 10.0 111.489 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . 0.453 ' HB3' HD21 ' B' ' 13' ' ' LEU . 7.3 mm-40 -65.82 -25.78 67.37 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.806 -0.634 . . . . 10.0 111.262 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 12.7 ttm -70.32 -31.79 69.25 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.815 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . 0.448 ' CE2' ' HB3' ' A' ' 355' ' ' GLN . 0.3 OUTLIER -63.31 -48.58 77.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.383 -179.232 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.44 -7.7 27.44 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.019 0.377 . . . . 10.0 112.019 -179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -98.9 -40.29 8.16 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.487 -0.324 . . . . 10.0 110.77 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 239' ' ' VAL . . . . . 0.52 HG21 HG12 ' A' ' 310' ' ' VAL . 11.4 p -82.79 -33.73 10.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-O 120.986 0.422 . . . . 10.0 111.462 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -73.38 -6.64 47.49 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.936 0.347 . . . . 10.0 111.936 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.9 -11.3 19.89 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.986 0.365 . . . . 10.0 111.986 -179.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 242' ' ' ILE . . . . . 0.49 HG22 ' O ' ' A' ' 239' ' ' VAL . 12.7 tt -90.62 -22.05 6.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.092 0.472 . . . . 10.0 110.954 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 243' ' ' ILE . . . . . 0.497 ' C ' ' H ' ' A' ' 245' ' ' HIS . 37.4 mt -68.24 -44.78 38.11 Favored Pre-proline 0 CA--C 1.54 0.569 0 N-CA-C 112.776 0.658 . . . . 10.0 112.776 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 244' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -67.89 22.65 0.12 Allowed 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 122.289 1.993 . . . . 10.0 112.775 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 245' ' ' HIS . . . . . 0.497 ' H ' ' C ' ' A' ' 243' ' ' ILE . 18.2 t-80 -122.5 9.34 9.64 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.186 -0.672 . . . . 10.0 109.186 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 41.1 mt -100.59 -178.35 3.76 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.035 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 53.4 mt -117.02 128.75 74.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.046 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -67.56 75.88 0.18 Allowed 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.617 0.573 . . . . 10.0 111.335 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -173.3 -34.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.103 -0.498 . . . . 10.0 111.028 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -157.59 -179.81 8.52 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.261 -0.274 . . . . 10.0 110.261 -179.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 281' ' ' LEU . 14.2 mmtt 59.52 65.69 1.12 Allowed 'General case' 0 C--O 1.233 0.219 0 O-C-N 123.742 0.651 . . . . 10.0 111.576 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 252' ' ' GLU . . . . . 0.45 ' OE2' HD13 ' A' ' 281' ' ' LEU . 8.3 mm-40 71.12 -37.28 0.39 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.982 0.913 . . . . 10.0 112.653 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -74.49 5.18 4.96 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.223 0.535 . . . . 10.0 110.724 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.36 -4.12 59.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.092 178.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 55.79 -142.35 0.79 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.387 -0.824 . . . . 10.0 111.032 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.9 7.54 44.6 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.763 0.316 . . . . 10.0 111.184 -179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -67.86 -40.31 83.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.116 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 53.39 -103.61 0.17 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.474 -0.784 . . . . 10.0 111.693 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -129.52 29.01 3.9 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.708 -0.758 . . . . 10.0 111.868 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -143.45 -64.04 0.39 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.026 0.441 . . . . 10.0 110.458 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 78.33 -117.25 4.6 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.832 -0.699 . . . . 10.0 111.865 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -169.05 -80.52 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -163.68 160.84 23.2 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 4.5 m -69.19 116.25 9.41 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.925 0.393 . . . . 10.0 110.994 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 14.5 p -160.58 -33.45 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.25 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -155.06 -169.2 3.11 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -120.59 -1.88 10.02 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.337 0.589 . . . . 10.0 109.809 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 268' ' ' LYS . . . . . 0.57 ' HE3' ' OG1' ' A' ' 321' ' ' THR . 0.1 OUTLIER -141.95 145.57 34.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.372 -179.37 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 7.5 m -87.82 144.89 26.36 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.947 0.403 . . . . 10.0 110.413 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -88.84 5.67 42.66 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.178 0.513 . . . . 10.0 110.399 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -118.05 -65.3 1.19 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.681 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 272' ' ' VAL . . . . . 0.651 HG12 ' H ' ' A' ' 274' ' ' LEU . 58.4 t 70.89 -60.52 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.962 179.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 50.2 20.56 0.65 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.238 1.015 . . . . 10.0 112.982 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 274' ' ' LEU . . . . . 0.651 ' H ' HG12 ' A' ' 272' ' ' VAL . 83.4 mt 69.18 166.53 0.27 Allowed 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.598 0.759 . . . . 10.0 112.251 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 275' ' ' THR . . . . . 0.451 HG23 ' H ' ' A' ' 276' ' ' GLU . 0.0 OUTLIER -121.88 -72.26 0.69 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.148 -0.478 . . . . 10.0 112.046 -179.068 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 276' ' ' GLU . . . . . 0.451 ' H ' HG23 ' A' ' 275' ' ' THR . 0.7 OUTLIER 62.42 22.94 13.58 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.042 0.449 . . . . 10.0 111.499 -179.566 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -145.56 158.27 43.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.802 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . 134.53 -52.05 0.82 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.199 -0.524 . . . . 10.0 111.887 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 279' ' ' LEU . 3.4 mm? 70.55 -58.58 0.55 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.691 0.796 . . . . 10.0 112.675 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 11.0 p -58.02 -24.11 22.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 N-CA-C 112.445 0.535 . . . . 10.0 112.445 -178.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 281' ' ' LEU . . . . . 0.45 HD13 ' OE2' ' A' ' 252' ' ' GLU . 0.1 OUTLIER -80.31 -44.27 19.83 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.079 0.4 . . . . 10.0 112.079 -179.028 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 282' ' ' ILE . . . . . 0.409 ' H ' HD12 ' A' ' 281' ' ' LEU . 34.9 pt -80.05 -4.38 7.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 112.398 0.518 . . . . 10.0 112.398 -178.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.98 -60.06 3.08 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.483 0.549 . . . . 10.0 112.483 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -100.49 5.44 44.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.017 0.437 . . . . 10.0 111.332 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 285' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 285' ' ' LEU . 0.3 OUTLIER -77.56 -39.87 44.35 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.866 -0.79 . . . . 10.0 108.866 178.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 16.5 mt -73.07 160.28 32.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.35 -0.841 . . . . 10.0 110.87 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 287' ' ' VAL . . . . . 0.418 HG12 ' N ' ' A' ' 288' ' ' LYS . 17.0 t 66.03 160.99 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.491 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 288' ' ' LYS . . . . . 0.418 ' N ' HG12 ' A' ' 287' ' ' VAL . 0.0 OUTLIER 76.98 138.56 0.07 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.846 0.858 . . . . 10.0 112.72 178.356 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 68.86 -58.55 0.49 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.713 -1.131 . . . . 10.0 112.842 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -81.38 -148.25 6.15 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.794 -0.717 . . . . 10.0 112.663 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 291' ' ' ILE . . . . . 0.523 ' O ' ' HB3' ' A' ' 292' ' ' MET . 18.3 tt -88.03 161.31 2.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 292' ' ' MET . . . . . 0.605 ' SD ' ' HB2' ' A' ' 296' ' ' GLU . 20.7 ttp 76.04 95.82 0.07 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.578 0.704 . . . . 10.0 110.981 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 11.2 p30 -109.88 3.23 20.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.439 -0.8 . . . . 10.0 109.468 178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -85.11 -68.76 0.7 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.959 -1.018 . . . . 10.0 109.901 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 146.48 114.01 0.82 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.91 -0.662 . . . . 10.0 112.248 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . 0.605 ' HB2' ' SD ' ' A' ' 292' ' ' MET . 1.3 mm-40 -148.19 176.8 9.93 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 110.098 -0.334 . . . . 10.0 110.098 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.97 153.99 20.7 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.052 0.454 . . . . 10.0 111.453 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.3 tp -70.35 -29.36 66.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.238 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -89.75 19.77 4.51 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.278 0.473 . . . . 10.0 112.278 -178.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 62.7 m -80.63 137.79 51.11 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.96 -0.385 . . . . 10.0 109.96 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.6 -26.73 66.2 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.997 2.465 . . . . 10.0 113.104 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -71.63 -12.29 61.27 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.138 0.494 . . . . 10.0 110.961 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -106.65 94.08 4.93 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.57 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 304' ' ' ILE . . . . . 0.46 HG12 ' HB1' ' A' ' 781' ' ' ALA . 6.7 tp -127.47 -52.35 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.526 -0.306 . . . . 10.0 110.973 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -50.0 69.49 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.367 -0.605 . . . . 10.0 109.367 178.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.4 -42.12 99.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.8 178.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 307' ' ' MET . . . . . 0.511 ' O ' HG22 ' A' ' 310' ' ' VAL . 15.5 tpt -59.05 -50.53 73.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.498 -0.774 . . . . 10.0 111.096 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 308' ' ' HIS . . . . . 0.46 ' HE2' ' CG ' ' A' ' 351' ' ' ASP . 9.5 t60 -62.05 -21.15 64.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.482 -0.327 . . . . 10.0 111.176 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.67 -40.99 32.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.5 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 310' ' ' VAL . . . . . 0.52 HG12 HG21 ' A' ' 239' ' ' VAL . 7.1 m -72.01 -34.21 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.143 0 C-N-CA 121.074 -0.25 . . . . 10.0 110.737 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 2.2 m -64.17 -34.98 79.32 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.384 0.611 . . . . 10.0 109.961 179.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 312' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' A' ' 315' ' ' ARG . . . -68.77 -42.93 76.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.347 -0.842 . . . . 10.0 110.854 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 313' ' ' ALA . . . . . 0.436 ' HA ' ' HB1' ' A' ' 356' ' ' ALA . . . -65.67 -25.39 67.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.5 -179.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 34.7 tp -81.47 -44.22 17.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.074 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 315' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 312' ' ' ALA . 33.8 ptt180 -64.77 -24.45 67.56 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.793 0.33 . . . . 10.0 110.76 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -90.11 13.84 13.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.948 0.404 . . . . 10.0 110.676 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -123.67 -0.85 8.54 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.002 -0.545 . . . . 10.0 111.055 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -142.79 -62.9 0.42 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.679 0.276 . . . . 10.0 111.268 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.41 -57.94 9.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.745 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -85.27 112.81 21.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.943 0.402 . . . . 10.0 110.417 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 321' ' ' THR . . . . . 0.576 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 1.0 OUTLIER -104.17 138.78 40.16 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.277 -179.409 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 322' ' ' ARG . . . . . 0.562 ' HD3' ' OE1' ' A' ' 361' ' ' GLU . 7.0 tpt180 -62.0 141.29 58.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.846 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 323' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 0.7 OUTLIER 78.69 -45.35 0.39 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.991 0.916 . . . . 10.0 113.165 177.541 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 324' ' ' VAL . . . . . 0.576 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 7.1 p -83.99 -37.46 13.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.73 -0.388 . . . . 10.0 111.852 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 321' ' ' THR . 9.8 m-20 -95.53 -31.43 13.33 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-O 120.983 0.42 . . . . 10.0 110.869 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 53.8 p90 -151.83 142.09 22.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.706 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 327' ' ' ILE . . . . . 0.449 HG23 ' HB ' ' A' ' 334' ' ' ILE . 6.6 tp -115.8 124.18 71.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.057 -0.719 . . . . 10.0 109.057 178.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 49.8 t -102.26 119.6 50.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.19 -179.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 5.9 ptmm? -126.06 119.79 28.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.684 -0.689 . . . . 10.0 109.669 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 1.9 p30 48.93 29.14 2.22 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.145 0.978 . . . . 10.0 113.087 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 102.8 -23.04 35.08 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.743 -0.742 . . . . 10.0 112.857 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -77.81 114.31 16.55 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.953 0.406 . . . . 10.0 110.315 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 31.3 t -88.65 107.32 17.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.77 -0.65 . . . . 10.0 110.386 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 334' ' ' ILE . . . . . 0.449 ' HB ' HG23 ' A' ' 327' ' ' ILE . 68.3 mt -99.96 127.84 52.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.103 -0.499 . . . . 10.0 109.904 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 77.1 mt -78.51 132.86 31.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.699 0.285 . . . . 10.0 110.534 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 44.9 t -102.14 115.65 44.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 109.512 -0.551 . . . . 10.0 109.512 179.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -66.2 127.01 30.52 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.271 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 338' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 338' ' ' GLU . 17.4 tt0 -80.82 -7.65 59.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.71 -178.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 70.6 m80 -84.64 -60.8 1.95 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.27 -0.269 . . . . 10.0 111.717 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 30.1 p -111.89 3.72 17.77 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 65.93 41.35 95.43 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.602 -0.809 . . . . 10.0 112.079 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -101.53 138.44 38.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.899 0.38 . . . . 10.0 110.672 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -86.86 117.68 25.76 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.976 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 66.4 mtt -106.05 97.97 7.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.993 0.425 . . . . 10.0 110.223 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -89.54 -20.38 23.87 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.525 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -101.31 32.41 7.52 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.384 -0.687 . . . . 10.0 111.384 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -145.07 135.97 24.68 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.0 129.43 14.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.73 -0.214 . . . . 10.0 110.594 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 36.0 m95 -74.73 149.77 39.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.661 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.62 -161.26 0.82 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.185 -0.462 . . . . 10.0 110.579 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 351' ' ' ASP . . . . . 0.46 ' CG ' ' HE2' ' A' ' 308' ' ' HIS . 28.6 t70 64.4 10.11 5.46 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.364 0.602 . . . . 10.0 111.052 179.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 71.43 27.61 71.11 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.734 -0.746 . . . . 10.0 111.552 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.51 HD12 ' CZ ' ' A' ' 315' ' ' ARG . 4.2 tp -57.16 -41.98 80.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.817 0.341 . . . . 10.0 110.966 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 354' ' ' HIS . . . . . 0.479 ' CE1' HE22 ' A' ' 355' ' ' GLN . 13.6 p80 -98.58 -5.64 31.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.412 -0.358 . . . . 10.0 110.98 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 355' ' ' GLN . . . . . 0.479 HE22 ' CE1' ' A' ' 354' ' ' HIS . 1.4 mp0 -65.77 -38.91 90.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.441 0.638 . . . . 10.0 109.981 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 356' ' ' ALA . . . . . 0.436 ' HB1' ' HA ' ' A' ' 313' ' ' ALA . . . -70.33 -21.66 62.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.237 179.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 357' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 354' ' ' HIS . 33.7 t -73.23 -49.85 35.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.34 178.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.586 ' HA ' HG23 ' A' ' 363' ' ' VAL . 4.6 mt-10 -65.55 -26.15 67.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.432 -0.804 . . . . 10.0 110.671 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -80.35 -30.37 37.98 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.852 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -74.88 -47.7 28.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.602 -0.726 . . . . 10.0 111.074 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 361' ' ' GLU . . . . . 0.562 ' OE1' ' HD3' ' A' ' 322' ' ' ARG . 14.4 mt-10 -94.1 176.98 6.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.888 -179.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -84.01 75.2 2.4 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.084 -0.579 . . . . 10.0 112.861 -178.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 363' ' ' VAL . . . . . 0.586 HG23 ' HA ' ' A' ' 358' ' ' GLU . 0.0 OUTLIER -147.06 167.27 5.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 110.317 -0.253 . . . . 10.0 110.317 179.298 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.37 122.73 29.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.277 -0.42 . . . . 10.0 110.376 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 365' ' ' ILE . . . . . . . . . . . . . 53.4 mt -64.46 126.49 23.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.37 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -71.01 124.01 23.4 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.162 -0.472 . . . . 10.0 109.922 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -68.71 124.24 23.09 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.218 -179.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -79.66 154.86 28.35 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.483 ' O ' ' HB2' ' A' ' 370' ' ' GLN . 2.3 t-20 -127.69 -175.05 3.35 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 121.073 -0.251 . . . . 10.0 110.604 -179.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 370' ' ' GLN . . . . . 0.483 ' HB2' ' O ' ' A' ' 369' ' ' ASN . 5.1 mt-30 77.33 -175.1 0.1 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.396 0.678 . . . . 10.0 110.651 -179.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 3.0 m 73.64 93.86 0.08 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.006 -0.543 . . . . 10.0 112.21 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 372' ' ' LEU . . . . . 0.703 ' O ' ' HD2' ' A' ' 776' ' ' LYS . 0.4 OUTLIER -134.48 -69.24 0.53 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.838 178.751 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 373' ' ' ALA . . . . . 0.4 ' HB1' HD22 ' A' ' 187' ' ' LEU . . . -138.37 150.83 46.94 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.858 -0.423 . . . . 10.0 109.858 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 374' ' ' SER . . . . . 0.538 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 16.4 m -152.04 136.53 16.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.655 0.264 . . . . 10.0 111.161 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 17.2 tt -155.83 137.17 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.337 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.38 145.64 27.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.398 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 377' ' ' PHE . . . . . 0.436 ' HB2' ' O ' ' A' ' 218' ' ' GLU . 36.2 m-85 -57.53 -37.65 73.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.654 0.264 . . . . 10.0 110.657 179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -57.32 -39.94 76.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.404 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -74.38 -39.16 62.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.74 -0.664 . . . . 10.0 111.024 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -63.68 -46.43 85.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.378 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -74.65 -16.78 60.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.831 0.308 . . . . 10.0 111.831 -179.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -80.7 -3.29 50.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.856 0.36 . . . . 10.0 110.539 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 60.7 mt -99.37 4.76 46.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.385 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.493 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 21.1 m-85 -99.79 143.68 29.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.147 179.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -79.27 -70.8 0.48 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.928 0.394 . . . . 10.0 110.526 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -89.13 91.92 8.99 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.627 -0.508 . . . . 10.0 109.627 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 54.5 tp -103.27 110.03 21.86 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.012 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -128.96 161.68 29.33 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.18 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.83 165.26 37.01 Favored Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.255 -0.974 . . . . 10.0 112.158 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 46.0 mtm -107.65 143.32 36.28 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 110.119 -0.326 . . . . 10.0 110.119 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 391' ' ' THR . . . . . 0.452 ' HB ' ' CG2' ' A' ' 211' ' ' VAL . 7.1 t -129.51 155.57 45.54 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -80.66 163.57 46.23 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.501 -0.856 . . . . 10.0 112.044 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.63 91.58 0.43 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.166 -0.309 . . . . 10.0 110.166 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . 0.602 ' HA ' HD22 ' A' ' 569' ' ' ASN . . . -151.58 -28.72 0.18 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.229 0.455 . . . . 10.0 112.229 -178.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 31.9 t70 58.83 -108.94 0.43 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 109.205 -0.665 . . . . 10.0 109.205 -178.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 6.7 m 58.81 -89.8 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.239 0.829 . . . . 10.0 113.239 177.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -88.76 22.75 2.53 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.003 0.371 . . . . 10.0 112.003 -178.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -60.84 -35.19 75.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.044 0.449 . . . . 10.0 110.946 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -66.51 -20.05 65.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.487 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.64 -22.36 46.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.712 -0.222 . . . . 10.0 110.847 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -63.64 -46.69 84.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 10.0 110.556 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.36 -20.74 58.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.599 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 41.7 m -87.6 -42.5 12.66 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.328 0.492 . . . . 10.0 112.328 -178.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 56.4 mt -91.44 -61.56 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 N-CA-C 112.763 0.653 . . . . 10.0 112.763 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -88.11 -4.76 58.72 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt 60.48 44.42 11.95 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.788 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 407' ' ' LEU . . . . . 0.502 HD13 HD11 ' A' ' 99' ' ' ILE . 20.7 mt -109.8 141.4 42.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.828 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . 0.517 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 47.7 t0 -76.87 166.87 22.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.082 -0.71 . . . . 10.0 109.082 178.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 6.9 m -134.35 101.49 5.01 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.057 0.456 . . . . 10.0 111.149 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 62.0 t -106.84 133.53 51.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.068 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 23.6 t -87.15 126.08 40.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.509 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 54.2 t -86.69 128.46 56.43 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.385 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.96 146.35 82.38 Favored 'Trans proline' 0 N--CA 1.463 -0.292 0 C-N-CA 122.436 2.091 . . . . 10.0 112.095 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.75 145.4 45.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.873 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 415' ' ' ASN . . . . . 0.424 ' HB3' ' HG2' ' A' ' 578' ' ' GLN . 62.8 t30 -56.89 -38.03 72.21 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.268 0.556 . . . . 10.0 110.514 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 416' ' ' ARG . . . . . 0.437 ' HB2' ' O ' ' A' ' 578' ' ' GLN . 71.1 mtm180 -129.66 151.32 77.86 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.451 179.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -61.77 116.26 3.33 Favored 'Trans proline' 0 N--CA 1.465 -0.167 0 C-N-CA 122.6 2.2 . . . . 10.0 111.84 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 48.8 mtm -64.32 118.53 8.81 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.969 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 419' ' ' ILE . . . . . 0.437 HG13 ' HA ' ' A' ' 581' ' ' ALA . 6.4 pt -108.29 30.9 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.359 0.6 . . . . 10.0 110.348 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 420' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 420' ' ' ARG . 36.1 ttp180 -77.2 122.66 25.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.279 -0.873 . . . . 10.0 109.45 179.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 27.0 mmtp -88.76 101.47 14.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.996 0.427 . . . . 10.0 111.104 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -88.4 114.99 25.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.01 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 74.5 mt -94.32 156.09 39.14 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.493 -0.322 . . . . 10.0 110.542 -179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -65.94 170.28 11.88 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.694 2.263 . . . . 10.0 113.006 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -85.67 129.15 34.9 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.461 -0.791 . . . . 10.0 110.596 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.28 92.08 4.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.353 0.596 . . . . 10.0 110.189 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 427' ' ' VAL . . . . . 0.628 HG22 ' HB2' ' A' ' 588' ' ' LEU . 25.6 t -87.75 122.04 38.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.545 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 428' ' ' TYR . . . . . 0.424 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 2.5 m-85 -105.36 -176.71 3.16 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . 0.426 ' HB2' ' OE2' ' A' ' 433' ' ' GLU . 12.8 mmt -78.09 -74.16 0.28 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.94 0.4 . . . . 10.0 111.342 -178.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 73.2 p -89.53 174.01 8.01 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.869 -178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -71.91 -36.04 69.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.39 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.63 -41.12 85.23 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.571 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 433' ' ' GLU . . . . . 0.426 ' OE2' ' HB2' ' A' ' 429' ' ' MET . 33.1 mt-10 -62.51 -45.38 93.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.143 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 434' ' ' LYS . . . . . 0.539 ' O ' HG13 ' A' ' 438' ' ' ILE . 38.7 ttpt -58.67 -50.46 73.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.706 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 435' ' ' ILE . . . . . 0.479 ' O ' HG12 ' A' ' 439' ' ' ILE . 49.7 mm -62.33 -43.48 98.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.905 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -59.6 -39.92 85.78 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.615 0.245 . . . . 10.0 110.886 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.35 87.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.338 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 438' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 434' ' ' LYS . 70.1 mt -65.53 -45.88 91.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.952 179.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 439' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 435' ' ' ILE . 50.2 mm -58.31 -40.48 78.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.893 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -63.96 -50.42 68.66 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.389 -0.368 . . . . 10.0 110.707 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -58.36 -42.06 86.1 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.127 0.489 . . . . 10.0 110.557 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.442 HG12 HG11 ' A' ' 452' ' ' VAL . 79.2 mt -67.26 -50.7 60.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.637 179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -50.01 -49.31 51.21 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.372 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.431 ' O ' ' HD3' ' A' ' 448' ' ' LYS . 0.0 OUTLIER -56.74 -47.22 80.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.528 -179.674 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 47.8 mtt-85 -74.34 -22.24 59.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.016 -0.538 . . . . 10.0 112.19 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 27.4 m -69.4 -39.46 77.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.175 0.512 . . . . 10.0 109.917 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -74.06 -34.17 63.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.943 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 444' ' ' GLU . 14.0 mptt -70.13 -58.57 3.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.143 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 127.88 35.9 0.5 Allowed Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.667 -0.778 . . . . 10.0 112.267 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -113.43 126.53 28.02 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 110.158 -0.312 . . . . 10.0 110.158 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.44 140.6 58.31 Favored 'Trans proline' 0 C--O 1.237 0.455 0 C-N-CA 122.524 2.149 . . . . 10.0 111.503 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.442 HG11 HG12 ' A' ' 442' ' ' ILE . 85.4 t -125.28 126.62 71.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.246 -178.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 37.6 tp -112.99 107.75 16.41 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.781 -0.645 . . . . 10.0 109.352 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 20.8 t -93.72 126.0 46.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.266 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -106.56 109.48 3.11 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.7 -0.762 . . . . 10.0 111.996 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 2.7 p -97.66 142.15 29.81 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.733 0.302 . . . . 10.0 110.72 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 30.3 pt -84.39 -20.76 8.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.789 0.328 . . . . 10.0 111.229 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' SER . . . . . 0.487 ' HB3' ' OE2' ' A' ' 460' ' ' GLU . 57.7 m -134.38 145.43 48.94 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.962 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' ILE . . . . . 0.407 HG12 HG21 ' A' ' 504' ' ' THR . 16.8 mt -62.93 -33.86 62.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.249 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.487 ' OE2' ' HB3' ' A' ' 458' ' ' SER . 2.7 mp0 -59.03 -35.73 73.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.343 -0.844 . . . . 10.0 111.143 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.61 -29.11 51.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.751 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 9.8 m -63.45 -41.21 98.63 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.342 0.591 . . . . 10.0 110.067 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -68.46 -30.58 69.47 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.488 -0.778 . . . . 10.0 110.656 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 57.0 tp -70.64 -53.81 14.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.828 -0.624 . . . . 10.0 111.144 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 14.6 p -63.51 -31.4 52.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 120.884 0.374 . . . . 10.0 110.836 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 12.9 t -66.3 -38.35 87.53 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.881 0.372 . . . . 10.0 110.021 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -61.67 -49.19 77.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.764 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -65.12 -40.49 94.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.329 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 27.0 mt -61.69 -34.94 76.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.939 0.399 . . . . 10.0 110.329 179.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 23.4 m -72.26 -33.55 67.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.162 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -67.39 -37.37 83.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.455 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -77.62 -23.73 49.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.141 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 87.41 33.78 11.26 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.948 -0.644 . . . . 10.0 111.844 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 78.3 mt -100.68 131.19 48.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.669 0.271 . . . . 10.0 110.828 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -63.05 124.64 21.64 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.116 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 50.2 p-80 -154.85 159.42 40.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.802 0.334 . . . . 10.0 111.216 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . 0.462 ' ND2' HG21 ' A' ' 490' ' ' ILE . 8.5 t30 -141.37 132.77 26.73 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.166 178.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . 0.455 HG22 HD12 ' A' ' 502' ' ' ILE . 40.0 t -97.81 123.69 50.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.751 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.514 HD22 ' HG3' ' A' ' 487' ' ' GLU . 55.5 mt -81.36 146.48 30.31 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.419 -0.585 . . . . 10.0 109.419 179.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -157.78 135.78 10.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.124 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -60.04 -25.87 65.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.434 . . . . 10.0 111.352 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -62.32 -33.44 74.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.231 0.539 . . . . 10.0 110.305 179.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -116.64 35.27 4.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.629 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -58.0 -24.86 59.94 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.289 -178.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -62.92 -42.97 99.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.928 0.395 . . . . 10.0 110.84 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -86.03 -28.24 24.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.956 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.514 ' HG3' HD22 ' A' ' 479' ' ' LEU . 19.0 tt0 -55.42 -40.32 71.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.22 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -57.92 -29.11 64.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.942 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -84.03 -36.54 23.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.128 0.49 . . . . 10.0 110.418 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' ILE . . . . . 0.462 HG21 ' ND2' ' A' ' 477' ' ' ASN . 53.9 mt -69.17 -45.93 78.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.679 -0.691 . . . . 10.0 111.095 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 71.9 t -61.09 -34.21 59.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.085 0.469 . . . . 10.0 110.946 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -65.91 -24.28 66.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.48 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' GLN . . . . . 0.474 ' NE2' ' H ' ' A' ' 518' ' ' SER . 53.7 mm-40 -115.44 16.84 16.63 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.826 0.346 . . . . 10.0 110.753 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.87 -12.97 61.85 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.402 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -89.19 7.69 81.53 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.781 -0.723 . . . . 10.0 112.211 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -69.84 141.53 89.91 Favored Pre-proline 0 C--N 1.328 -0.364 0 C-N-CA 122.319 0.248 . . . . 10.0 110.515 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -52.54 126.22 20.21 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.718 2.279 . . . . 10.0 113.04 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 67.92 24.92 7.88 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.487 -0.778 . . . . 10.0 112.57 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -94.88 110.28 22.18 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 10.0 110.261 178.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 38.6 t -92.16 109.71 21.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.106 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 1.2 m -116.4 130.16 56.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.799 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' ILE . . . . . 0.455 HD12 HG22 ' A' ' 478' ' ' VAL . 28.9 mt -105.6 115.26 47.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.042 -0.526 . . . . 10.0 109.734 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -103.67 111.3 23.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.907 0.384 . . . . 10.0 111.191 -178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' THR . . . . . 0.407 HG21 HG12 ' A' ' 459' ' ' ILE . 13.1 m -82.32 110.94 17.93 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.411 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 13.3 t30 62.79 91.61 0.07 Allowed 'General case' 0 N--CA 1.465 0.275 0 O-C-N 123.686 0.616 . . . . 10.0 111.0 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 1.3 mmt -75.05 113.8 12.8 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.762 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -64.95 168.71 6.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.98 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -58.98 142.11 46.63 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 121.165 -0.541 . . . . 10.0 113.026 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 69.26 -80.1 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.354 0.662 . . . . 10.0 111.502 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.17 143.42 11.4 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.732 -0.747 . . . . 10.0 112.165 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.81 147.02 35.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.905 0.383 . . . . 10.0 111.349 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -76.23 93.92 3.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.528 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 55.0 mt -69.55 121.85 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.482 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 7.4 t -90.27 133.52 31.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.671 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 61.2 mt -70.45 135.54 48.76 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.412 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 85.85 0.34 87.57 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.085 -0.579 . . . . 10.0 111.773 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 106.6 -170.0 15.83 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 110.784 -0.927 . . . . 10.0 110.784 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . 0.474 ' H ' ' NE2' ' A' ' 493' ' ' GLN . 2.8 p -128.07 98.99 5.3 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 117.235 0.517 . . . . 10.0 110.918 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 33.2 p-90 -59.55 -28.47 67.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.076 0.465 . . . . 10.0 110.206 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -62.57 -32.26 73.22 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.646 -0.707 . . . . 10.0 110.681 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -85.12 -35.91 21.46 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.225 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -63.6 -45.56 89.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.899 -0.591 . . . . 10.0 111.013 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 33.8 m -70.74 -22.35 23.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-O 120.99 0.424 . . . . 10.0 110.806 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -81.13 -23.26 38.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.64 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -73.32 -21.83 60.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.532 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 91.7 mt -79.44 127.02 31.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.176 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -63.55 -33.76 76.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.299 0.571 . . . . 10.0 109.462 179.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -120.46 93.92 48.54 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 115.307 -0.861 . . . . 10.0 109.258 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -80.72 75.09 5.22 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.114 2.542 . . . . 10.0 111.956 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.97 144.6 55.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.598 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.97 -43.49 60.48 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.328 0.492 . . . . 10.0 112.328 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -59.8 -44.4 94.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.989 0.423 . . . . 10.0 110.949 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.08 -40.77 91.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.717 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 91.4 mt -60.92 -43.55 96.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -66.6 -41.86 87.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.319 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -62.04 -47.37 85.02 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.275 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 85.2 mt -66.29 -33.8 65.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.787 0.327 . . . . 10.0 110.544 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 31.4 ttmt -63.66 -49.81 71.73 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.721 -0.474 . . . . 10.0 109.721 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -66.37 -36.14 82.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.317 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . 0.6 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 19.7 t70 -62.9 -52.06 64.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.718 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 47.8 t90 -61.87 -37.96 86.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.866 179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -50.98 -49.86 59.36 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.297 -0.41 . . . . 10.0 111.107 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 47.4 t -64.58 -45.1 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.994 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 544' ' ' ARG . . . . . 0.6 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 5.8 mtm180 -64.23 -35.79 81.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.936 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -68.94 -48.4 63.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.741 -0.663 . . . . 10.0 111.178 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -69.11 -26.01 64.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.626 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -65.46 -36.79 84.94 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.266 0.555 . . . . 10.0 109.576 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.2 -32.75 55.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.709 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 85.4 mt -61.84 -47.19 86.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.904 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -76.49 -18.9 58.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.737 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -75.4 -33.68 61.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.641 179.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 134.55 10.36 1.65 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.444 -0.884 . . . . 10.0 113.21 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 73.07 -168.28 53.74 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.859 -0.686 . . . . 10.0 112.672 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 40.9 tp -72.78 117.11 14.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.958 0.408 . . . . 10.0 110.078 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -92.7 113.79 26.16 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.011 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 10.9 mm -94.87 137.63 22.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.31 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 557' ' ' ILE . . . . . 0.486 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 23.7 mt -127.74 128.87 69.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.64 0.257 . . . . 10.0 110.343 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -106.8 120.25 6.18 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 111.404 -0.678 . . . . 10.0 111.404 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 17.3 p -74.71 -37.38 62.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.126 0.489 . . . . 10.0 110.907 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -138.61 140.76 39.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.081 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 561' ' ' ARG . . . . . 0.461 ' H ' HD21 ' A' ' 588' ' ' LEU . 23.4 mmt180 -82.81 141.39 32.34 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.74 151.15 23.64 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.9 -0.32 . . . . 10.0 110.377 -179.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -41.99 68.21 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 179.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 36.3 t -81.18 115.65 20.7 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.398 -0.819 . . . . 10.0 109.064 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -66.33 -27.87 68.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.657 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 566' ' ' ARG . . . . . 0.494 ' HA ' ' HB1' ' A' ' 394' ' ' ALA . 8.3 ttm180 -62.03 -37.09 83.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.064 0.459 . . . . 10.0 110.37 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 44.1 mt -88.71 -31.23 5.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.324 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -66.02 -44.77 83.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.185 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 569' ' ' ASN . . . . . 0.602 HD22 ' HA ' ' A' ' 394' ' ' ALA . 46.3 t30 -71.25 -23.64 62.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.885 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -63.2 -29.15 70.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.84 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 29.2 tp -72.1 -35.98 69.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.072 0.463 . . . . 10.0 110.167 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 572' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 572' ' ' ARG . 12.7 ttp180 -75.36 -31.09 60.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.256 0.55 . . . . 10.0 110.031 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -76.26 0.68 62.84 Favored Glycine 0 CA--C 1.519 0.303 0 CA-C-N 115.659 -0.701 . . . . 10.0 113.188 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.52 -33.35 72.68 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.794 0.33 . . . . 10.0 110.397 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 2.6 t -98.68 169.93 9.15 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.165 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 63.96 50.87 57.87 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.693 -0.765 . . . . 10.0 111.47 -179.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 577' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' A' ' 580' ' ' ASP . 27.6 mtt180 -79.6 126.24 30.65 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.751 0.31 . . . . 10.0 110.996 -179.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 578' ' ' GLN . . . . . 0.601 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 7.4 tt0 56.76 32.6 21.51 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.626 -0.715 . . . . 10.0 110.746 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 78.18 43.08 14.06 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.797 -0.638 . . . . 10.0 112.651 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 580' ' ' ASP . . . . . 0.468 ' HB2' ' O ' ' A' ' 577' ' ' ARG . 0.9 OUTLIER -100.11 -170.3 1.86 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.714 0.292 . . . . 10.0 110.841 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . 0.437 ' HA ' HG13 ' A' ' 419' ' ' ILE . . . -83.89 172.37 12.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.114 -179.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 146.94 174.13 18.76 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.783 -0.723 . . . . 10.0 112.107 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 2.0 p -157.69 155.48 30.05 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.872 -0.418 . . . . 10.0 109.872 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 79.9 p -131.15 135.85 47.82 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.052 0.453 . . . . 10.0 110.578 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 585' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 1.6 tpm_? -139.29 116.97 11.47 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -108.47 148.02 30.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.99 0.424 . . . . 10.0 111.147 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 587' ' ' TYR . . . . . 0.535 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 84.4 m-85 -129.16 158.98 37.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.486 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 588' ' ' LEU . . . . . 0.628 ' HB2' HG22 ' A' ' 427' ' ' VAL . 13.2 mt -157.62 169.29 24.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.857 0.361 . . . . 10.0 110.922 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 589' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.7 OUTLIER -123.85 155.92 37.14 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.328 178.703 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 60.9 mmm -72.59 -15.22 61.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.292 0.568 . . . . 10.0 110.73 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 591' ' ' GLU . . . . . 0.41 ' H ' ' HG2' ' A' ' 591' ' ' GLU . 4.1 pt-20 -118.79 29.86 7.49 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.243 -0.89 . . . . 10.0 109.017 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 592' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 589' ' ' SER . 1.0 OUTLIER -82.25 176.96 9.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.188 -0.914 . . . . 10.0 111.798 -178.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.03 77.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.525 -0.761 . . . . 10.0 111.606 -179.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.556 ' O ' HG12 ' A' ' 597' ' ' ILE . 5.2 tp -68.69 -21.74 64.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.859 0.361 . . . . 10.0 110.945 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 13.1 mmt -77.27 9.58 3.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.416 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -106.16 -12.69 15.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.642 0.258 . . . . 10.0 110.542 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 594' ' ' LEU . 18.8 pt -88.33 -1.71 8.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.855 0.36 . . . . 10.0 111.375 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -82.29 -9.15 59.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.964 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 69.84 -59.63 0.5 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.99 0.806 . . . . 10.0 111.908 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 18.5 m -88.79 115.03 26.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.713 0.292 . . . . 10.0 110.864 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -64.06 -23.3 67.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.197 0.522 . . . . 10.0 110.538 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 3.0 mmt180 -59.01 -24.48 62.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.732 -0.667 . . . . 10.0 111.481 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 76.4 t -68.17 -49.68 65.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 1.4 m -65.27 -36.94 85.66 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.551 -0.75 . . . . 10.0 110.0 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -63.47 -39.11 97.34 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.911 -0.662 . . . . 10.0 112.01 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 61.1 tpp -74.52 -27.92 60.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.121 0.486 . . . . 10.0 110.619 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 39.7 mtt -74.29 -18.94 60.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.347 179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 74.5 mtt-85 -77.5 6.11 7.68 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.053 0.454 . . . . 10.0 110.704 179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -94.76 2.58 55.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.859 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 77.1 mt -80.93 -9.79 59.79 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.343 -0.389 . . . . 10.0 111.037 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 611' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 83.85 -50.84 4.47 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.914 -0.66 . . . . 10.0 111.934 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 612' ' ' MET . . . . . 0.442 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.7 OUTLIER 73.66 -61.07 0.51 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.834 0.853 . . . . 10.0 111.847 179.145 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? 62.85 93.17 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.301 0 O-C-N 123.536 0.523 . . . . 10.0 110.603 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 614' ' ' PRO . . . . . 0.424 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 38.2 Cg_exo -57.09 94.94 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.136 2.558 . . . . 10.0 112.269 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 142.85 -29.47 2.1 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.831 -0.699 . . . . 10.0 111.916 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.59 140.66 37.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.943 0.402 . . . . 10.0 110.981 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -95.72 114.15 25.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.071 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.08 -37.62 78.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.795 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 51.78 74.67 0.25 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.763 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.97 105.23 20.39 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 120.86 0.362 . . . . 10.0 110.726 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.91 -21.27 25.67 Favored 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.659 2.906 . . . . 10.0 114.585 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 9.5 p-90 -60.43 -29.3 68.91 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 120.662 -0.415 . . . . 10.0 110.493 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 60.3 t -65.54 -48.85 81.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 85.1 m -61.36 -37.97 85.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.408 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -64.67 -42.47 95.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.122 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.09 94.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.641 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.1 -50.44 76.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.447 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -62.76 -35.73 80.76 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.116 0.484 . . . . 10.0 110.797 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 629' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' A' ' 633' ' ' LYS . 63.2 t30 -65.85 -44.56 85.12 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.493 -0.776 . . . . 10.0 109.849 179.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -67.15 -42.11 84.91 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.08 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -58.64 -40.54 83.68 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.379 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -61.57 -38.45 87.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.377 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 633' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 629' ' ' ASN . 26.1 mmtp -65.37 -37.79 88.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.166 -179.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 53.7 t -62.34 -47.1 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.081 0.467 . . . . 10.0 110.36 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -69.24 -35.78 76.48 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.67 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 49.1 m -64.63 -36.51 84.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.019 0.438 . . . . 10.0 110.04 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -67.89 -31.92 72.05 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -66.95 -38.14 85.58 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -65.02 -37.14 86.67 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.006 -0.543 . . . . 10.0 109.735 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 640' ' ' ASP . . . . . 0.633 ' O ' ' HG2' ' A' ' 644' ' ' GLN . 25.6 t0 -60.54 -35.84 76.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.636 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 59.1 mt -80.02 -38.57 18.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.325 179.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 642' ' ' ARG . . . . . 0.474 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 14.0 mtm-85 -61.71 -43.14 99.42 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.648 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 12.1 pttm -66.0 -26.88 67.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.868 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 644' ' ' GLN . . . . . 0.633 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 16.2 mm100 -65.03 -45.75 84.18 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 48.5 mt -65.63 -41.7 92.37 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.039 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 646' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 90.7 mt -63.5 -29.63 70.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.372 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.69 -28.32 69.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.078 0.465 . . . . 10.0 110.738 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -96.84 -28.28 14.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.621 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -75.38 -34.64 61.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.184 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 650' ' ' ASP . . . . . 0.505 ' O ' ' HB3' ' A' ' 653' ' ' ASN . 2.6 t0 -66.36 -23.51 66.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.13 0.49 . . . . 10.0 110.512 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 36.2 t -67.2 -42.01 87.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.319 0.58 . . . . 10.0 109.466 178.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -73.71 -22.5 59.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.473 -0.785 . . . . 10.0 109.912 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 653' ' ' ASN . . . . . 0.505 ' HB3' ' O ' ' A' ' 650' ' ' ASP . 18.1 t30 -61.39 -48.95 78.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.441 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -62.09 -46.85 87.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.62 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -62.67 -45.48 92.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.781 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 656' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 656' ' ' ARG . 11.2 ttp-105 -63.57 -40.76 97.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.332 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 30.9 ttp85 -61.74 -50.49 72.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.64 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -62.02 -49.08 77.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.732 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 659' ' ' ILE . . . . . 0.444 ' O ' ' HB2' ' A' ' 663' ' ' ARG . 8.7 tp -66.1 -34.52 70.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 116.628 -0.26 . . . . 10.0 111.6 -178.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -69.84 -34.21 73.33 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.731 0.301 . . . . 10.0 110.266 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.3 m -63.0 -54.26 41.05 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.112 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 662' ' ' GLN . . . . . 0.406 HE21 ' HB2' ' A' ' 662' ' ' GLN . 5.8 tt0 -62.12 -39.2 91.74 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.688 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 659' ' ' ILE . 2.2 tmt_? -60.44 -34.07 73.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.621 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -83.36 -37.75 22.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.714 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 665' ' ' GLU . . . . . 0.443 ' O ' HG22 ' A' ' 669' ' ' VAL . 35.3 mt-10 -57.86 -48.44 79.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.418 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 45.7 mt -72.21 -14.72 61.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.21 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 34.9 tp -86.16 -44.38 12.25 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.492 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -68.1 -53.94 21.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.898 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 665' ' ' GLU . 29.4 m -59.99 150.9 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 112.26 0.467 . . . . 10.0 112.26 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.57 -50.6 5.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.482 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -83.48 150.37 26.05 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.238 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 672' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 676' ' ' ILE . 6.6 p -141.07 8.74 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.287 -0.415 . . . . 10.0 111.051 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 15.4 m -49.84 -49.28 49.62 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.681 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.94 -51.85 67.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.702 -0.681 . . . . 10.0 111.767 -178.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 675' ' ' THR . . . . . 0.488 ' O ' HG12 ' A' ' 679' ' ' ILE . 2.0 m -60.48 -50.49 73.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.158 -0.474 . . . . 10.0 112.084 -179.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 676' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 672' ' ' VAL . 14.1 mm -62.13 -38.59 81.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 121.152 -0.219 . . . . 10.0 111.518 -178.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -68.36 -42.77 78.72 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.913 -0.315 . . . . 10.0 111.167 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 45.0 m -58.09 -44.03 87.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.911 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 679' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 675' ' ' THR . 24.3 pt -79.6 -24.71 12.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.953 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 18.8 mtm-85 -61.32 -50.45 72.91 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.147 0.499 . . . . 10.0 110.059 178.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.98 -35.4 74.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.377 -0.829 . . . . 10.0 110.692 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -66.03 -47.21 75.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.949 -0.569 . . . . 10.0 111.639 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 44.5 t -61.9 -45.75 98.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.189 -0.459 . . . . 10.0 111.444 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -59.78 -42.68 93.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.585 -0.28 . . . . 10.0 110.618 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -62.47 -46.01 90.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.09 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -63.15 -42.59 99.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.472 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 21.0 m -65.22 -45.92 82.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.695 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.98 -39.32 85.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 10.0 110.253 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.31 -28.1 62.76 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.788 -0.642 . . . . 10.0 112.111 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -70.26 -22.9 62.83 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.479 0.548 . . . . 10.0 112.479 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -119.86 -19.33 7.97 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.704 0.288 . . . . 10.0 111.544 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 692' ' ' ILE . . . . . 0.425 HG23 ' CD1' ' A' ' 701' ' ' TRP . 42.8 mt -128.82 103.67 19.0 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.908 179.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -67.45 139.39 49.16 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.675 2.25 . . . . 10.0 111.745 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -50.23 106.27 0.12 Allowed 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.05 2.5 . . . . 10.0 113.215 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 61.7 86.99 0.1 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.478 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 2.3 p -142.9 -165.86 2.16 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.193 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 62.4 mt -99.17 161.79 13.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.465 0.174 . . . . 10.0 110.945 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . 0.543 ' HA ' ' CE3' ' A' ' 701' ' ' TRP . 15.0 tt0 -58.07 -31.27 66.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.314 -179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -66.13 -24.14 66.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.179 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 54.9 mtp -95.57 4.57 53.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.389 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 701' ' ' TRP . . . . . 0.543 ' CE3' ' HA ' ' A' ' 698' ' ' GLU . 50.2 m0 -103.2 111.88 24.48 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.733 0.301 . . . . 10.0 111.297 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -81.91 78.59 8.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.75 -0.833 . . . . 10.0 108.75 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 703' ' ' ILE . . . . . 0.557 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 44.5 mm -56.39 -51.9 77.35 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.243 -0.889 . . . . 10.0 111.951 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 704' ' ' PRO . . . . . 0.557 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 35.9 Cg_exo -60.65 -44.33 27.14 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.679 1.586 . . . . 10.0 111.836 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -61.1 -39.2 96.79 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.947 -0.644 . . . . 10.0 112.744 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 64.1 tp -78.1 -45.17 24.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.655 0.264 . . . . 10.0 111.392 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -59.67 -49.68 76.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.277 -0.42 . . . . 10.0 111.017 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -65.98 -30.3 70.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.88 0.372 . . . . 10.0 110.291 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 709' ' ' ARG . 5.2 tpt180 -62.74 -49.69 74.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.164 179.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 710' ' ' LEU . . . . . 0.411 HD12 HD11 ' A' ' 720' ' ' ILE . 65.3 mt -67.23 -29.25 68.84 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.007 -179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . 0.408 ' HG2' ' HA ' ' A' ' 717' ' ' ASP . 20.1 mtpp -78.13 -18.15 56.0 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.402 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -108.09 -53.3 2.65 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.197 0.443 . . . . 10.0 112.197 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.1 -35.96 69.34 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.665 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -105.87 -12.57 15.8 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 121.061 -0.256 . . . . 10.0 111.348 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 63.43 24.08 13.98 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.887 -0.597 . . . . 10.0 112.261 178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 23.7 tp -113.7 126.95 55.81 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.689 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 717' ' ' ASP . . . . . 0.408 ' HA ' ' HG2' ' A' ' 711' ' ' LYS . 1.5 t0 -81.03 100.71 9.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.792 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.417 HD13 HG23 ' A' ' 739' ' ' ILE . 95.3 mt -113.57 114.15 47.58 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.914 -0.584 . . . . 10.0 110.432 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.69 66.57 8.05 Favored 'Trans proline' 0 CA--C 1.536 0.575 0 C-N-CA 122.93 2.42 . . . . 10.0 112.665 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 720' ' ' ILE . . . . . 0.411 HD11 HD12 ' A' ' 710' ' ' LEU . 68.0 mt -60.5 -46.83 94.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.65 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -64.0 -31.19 72.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.918 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -69.87 -40.88 75.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.566 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 45.0 m0 -66.86 -54.14 25.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.672 -0.694 . . . . 10.0 111.477 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 16.9 tp -63.01 -18.57 63.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 10.0 112.144 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -77.88 -37.39 48.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.48 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 17.6 mttp -102.21 -25.97 13.5 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.131 0.419 . . . . 10.0 112.131 -178.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -122.11 78.58 42.73 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 121.01 0.433 . . . . 10.0 110.222 179.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -72.49 -9.05 23.61 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.845 2.363 . . . . 10.0 112.564 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -78.55 -10.84 59.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.836 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 93.4 mt -69.64 -29.37 66.83 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.222 0.534 . . . . 10.0 109.829 178.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 51.53 -95.64 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.624 -1.171 . . . . 10.0 112.147 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -56.01 0.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.611 0.243 . . . . 10.0 111.526 -178.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -56.38 -54.34 46.78 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.797 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.46 -27.22 68.84 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.027 0.441 . . . . 10.0 110.756 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 25.3 tp -67.39 -43.49 81.19 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 33.7 mtt180 -61.65 -40.23 94.16 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.996 -0.547 . . . . 10.0 109.642 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -60.28 -45.51 93.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.379 -0.828 . . . . 10.0 110.687 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 23.1 mmm-85 -61.08 -45.43 94.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.807 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 739' ' ' ILE . . . . . 0.417 HG23 HD13 ' A' ' 718' ' ' LEU . 97.0 mt -60.99 -52.78 57.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.707 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 21.1 tp -58.25 -46.33 86.16 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.789 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -62.57 -41.61 99.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.376 -0.374 . . . . 10.0 111.181 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -62.98 -42.2 99.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.314 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.14 -41.71 98.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.701 0.286 . . . . 10.0 110.797 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 82.3 mt -67.05 -43.18 89.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.84 0.352 . . . . 10.0 110.232 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.97 -44.9 83.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.868 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 85.0 t -70.4 -40.22 77.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.716 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -59.19 -41.45 88.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.795 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -60.48 -31.54 70.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.439 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 749' ' ' ARG . . . . . 0.479 ' O ' HG23 ' A' ' 753' ' ' VAL . 0.1 OUTLIER -66.23 -45.8 79.41 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 179.16 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -64.77 -37.79 88.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.719 -0.673 . . . . 10.0 109.516 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.516 ' HA ' ' HG3' ' A' ' 759' ' ' MET . 27.1 tt0 -62.57 -41.78 99.15 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.17 -0.923 . . . . 10.0 110.963 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -63.22 -41.08 99.08 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.511 -0.313 . . . . 10.0 111.4 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 749' ' ' ARG . 39.6 t -67.22 -47.17 82.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.272 -0.422 . . . . 10.0 112.021 -179.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 39.7 t -77.26 -42.06 30.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.207 0.527 . . . . 10.0 111.106 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 120.51 122.55 2.96 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 110.527 -1.029 . . . . 10.0 110.527 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 756' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -51.01 -46.03 61.39 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.163 0.431 . . . . 10.0 112.163 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.61 -46.15 91.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.984 0.421 . . . . 10.0 110.949 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 15.6 tpt -66.62 -39.66 88.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.283 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 759' ' ' MET . . . . . 0.516 ' HG3' ' HA ' ' A' ' 751' ' ' GLU . 80.9 mmm -61.79 -41.24 97.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.211 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.9 mmp_? -60.29 -39.0 85.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.236 0.541 . . . . 10.0 110.119 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -73.2 -34.83 66.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.802 -0.635 . . . . 10.0 109.644 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 762' ' ' PHE . . . . . 0.415 ' O ' HG23 ' A' ' 766' ' ' VAL . 45.5 t80 -66.86 -48.21 69.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.318 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -57.19 -46.06 83.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.082 0.467 . . . . 10.0 110.294 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -60.73 -42.57 97.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.082 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -64.72 -43.3 96.5 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 111.408 -0.677 . . . . 10.0 111.408 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 766' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 762' ' ' PHE . 63.8 t -60.74 -43.23 94.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 11.9 mtp -60.96 -48.2 82.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.085 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 80.9 mt -60.55 -46.64 89.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.704 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -60.88 -52.68 64.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.361 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 9.4 m -60.2 -44.26 95.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.847 0.356 . . . . 10.0 111.358 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.3 tt -64.32 -42.62 96.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.238 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 772' ' ' ASP . . . . . 0.621 ' O ' ' HG2' ' A' ' 776' ' ' LYS . 15.7 t70 -61.97 -51.27 68.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.479 -0.782 . . . . 10.0 110.806 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 773' ' ' SER . . . . . 0.549 ' HA ' ' HB3' ' B' ' 22' ' ' MET . 68.5 m -59.12 -44.48 92.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.079 -0.51 . . . . 10.0 112.371 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 23.5 mt -66.53 -35.02 79.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.712 0.291 . . . . 10.0 111.113 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -64.38 -37.6 88.08 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.991 0.424 . . . . 10.0 110.009 179.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.703 ' HD2' ' O ' ' A' ' 372' ' ' LEU . 26.6 mmtp -66.63 -41.32 88.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.398 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -63.02 -48.25 79.59 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 108.89 -0.781 . . . . 10.0 108.89 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 778' ' ' HIS . . . . . 0.608 ' O ' ' HG2' ' A' ' 782' ' ' MET . 72.0 t60 -58.78 -35.97 73.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.034 -0.984 . . . . 10.0 111.199 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 21.3 mt -59.55 -47.92 83.66 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.872 0.368 . . . . 10.0 110.306 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -69.51 -38.61 77.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.165 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 781' ' ' ALA . . . . . 0.46 ' HB1' HG12 ' A' ' 304' ' ' ILE . . . -59.32 -36.03 74.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.412 -0.813 . . . . 10.0 111.192 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 782' ' ' MET . . . . . 0.608 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 98.6 mmm -60.56 -41.16 94.03 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.048 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.93 -41.67 70.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 10.0 110.096 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -62.15 -42.01 98.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.286 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 789' ' ' ILE . 11.6 tp -67.94 -39.34 83.46 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.154 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 23.4 ttt180 -55.12 -36.53 65.83 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.721 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -76.19 -36.86 58.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.535 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -70.65 -16.27 73.96 Favored Glycine 0 N--CA 1.452 -0.24 0 CA-C-N 115.748 -0.66 . . . . 10.0 112.956 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 789' ' ' ILE . . . . . 0.519 HG12 ' O ' ' A' ' 785' ' ' LEU . 38.6 mm -58.97 -22.78 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 CA-C-O 121.128 0.489 . . . . 10.0 110.97 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 16.6 m80 -65.23 -21.24 66.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.695 179.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' A' ' 274' ' ' LEU . 73.7 mt -110.42 -35.54 6.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.495 179.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 3.7 mmt85 -65.4 -37.86 88.22 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.458 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -86.93 72.31 2.62 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.854 -0.688 . . . . 10.0 111.4 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 23.8 p90 -69.6 177.5 2.94 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.958 0.408 . . . . 10.0 111.175 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 795' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' A' ' 796' ' ' GLN . . . -60.11 149.71 31.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.7 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 796' ' ' GLN . . . . . 0.42 ' HB2' ' O ' ' A' ' 795' ' ' ALA . 11.8 mm100 72.24 16.72 5.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.579 -0.737 . . . . 10.0 111.299 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -139.01 147.09 41.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.064 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 798' ' ' ASP . . . . . 0.401 ' OD2' ' HB2' ' A' ' 800' ' ' LYS . 27.2 t70 -91.73 114.21 61.2 Favored Pre-proline 0 C--N 1.324 -0.531 0 C-N-CA 121.087 -0.245 . . . . 10.0 110.574 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -53.17 -31.25 54.35 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.15 2.567 . . . . 10.0 113.131 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 800' ' ' LYS . . . . . 0.401 ' HB2' ' OD2' ' A' ' 798' ' ' ASP . 28.1 mtmm -66.26 -55.23 17.15 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -63.64 -38.6 91.74 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.211 -0.449 . . . . 10.0 110.677 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.7 -48.39 82.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.04 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -59.91 -40.64 89.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.406 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -62.83 -47.81 81.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.792 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 37.0 ttp85 -62.44 -44.55 96.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.68 0.276 . . . . 10.0 111.002 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -58.5 -52.78 64.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.261 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 11.5 p -65.28 -39.56 92.74 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.297 0.481 . . . . 10.0 112.297 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -65.99 -44.68 84.14 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 121.032 -0.267 . . . . 10.0 110.89 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 17.5 m -65.71 -38.26 88.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.167 0.508 . . . . 10.0 110.102 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 35.0 ttm -63.85 -35.32 80.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.197 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -65.97 -38.9 89.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.271 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.88 92.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.353 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.46 73.86 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.468 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 17.7 ttp -64.53 -42.87 95.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.823 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 815' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 818' ' ' LEU . 81.0 mt -66.07 -36.27 82.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.414 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -64.57 -38.05 89.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.227 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 13.0 m -73.51 -30.14 62.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.105 179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 818' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 815' ' ' LEU . 14.1 tp -58.77 -61.64 2.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.134 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 819' ' ' LYS . . . . . 0.415 ' O ' HG12 ' A' ' 823' ' ' ILE . 44.0 pttt -60.01 -36.24 76.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.011 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -60.08 -57.41 12.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.196 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -63.74 -37.67 88.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.836 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 41.1 t -57.91 -51.85 65.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.891 0.377 . . . . 10.0 110.71 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 823' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 819' ' ' LYS . 30.4 mm -68.22 -37.92 78.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.647 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 46.4 t -60.01 -48.42 81.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.169 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 24.6 m -60.43 -40.61 91.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.494 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 96.0 mt -69.65 -23.03 63.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.275 -0.421 . . . . 10.0 111.812 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 7.5 m -93.4 -36.42 12.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.801 0.334 . . . . 10.0 110.481 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 51.2 mttm -67.5 -28.3 67.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.783 -0.644 . . . . 10.0 112.133 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 6.6 p -65.51 112.13 1.68 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 121.573 0.701 . . . . 10.0 109.842 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -94.97 117.59 30.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.188 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 12.1 t -110.28 141.5 25.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.559 -0.746 . . . . 10.0 109.214 179.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.85 114.62 1.48 Allowed 'General case' 0 C--N 1.33 -0.249 0 O-C-N 123.636 0.585 . . . . 10.0 110.639 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 77.8 mtp -102.36 113.99 65.62 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.633 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.36 161.69 44.82 Favored 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 122.591 2.194 . . . . 10.0 112.074 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -69.07 113.73 6.71 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.07 179.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 . . . . . 0 C--O 1.245 0.858 0 CA-C-O 118.666 -0.683 . . . . 10.0 110.774 -179.437 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 110.32 -0.252 . . . . 10.0 110.32 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -65.55 127.24 31.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.209 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 pt -72.94 94.79 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.503 0.668 . . . . 10.0 110.987 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.65 27.48 0.97 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.086 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 88.5 mt -77.37 71.45 3.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.638 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -154.67 123.28 6.12 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.461 -0.79 . . . . 10.0 109.739 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 ttpt -58.82 112.64 1.71 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.962 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -103.52 70.54 1.04 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.961 0.41 . . . . 10.0 111.599 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.46 ' HA ' ' HE ' ' B' ' 9' ' ' ARG . 0.0 OUTLIER -156.49 129.01 7.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.832 -0.622 . . . . 10.0 109.533 178.782 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -60.47 134.49 57.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.741 -0.663 . . . . 10.0 112.575 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 61.0 tp -96.27 109.94 49.93 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.422 178.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -61.14 -25.59 81.26 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.008 2.472 . . . . 10.0 112.626 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.453 HD21 ' HB3' ' A' ' 234' ' ' GLU . 62.7 tp -60.08 -27.15 66.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.973 -0.558 . . . . 10.0 111.628 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . 0.435 ' HB3' ' HB ' ' A' ' 291' ' ' ILE . . . -66.59 -46.33 76.33 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.747 0.277 . . . . 10.0 111.747 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -74.14 -27.48 22.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.758 0.313 . . . . 10.0 110.847 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.34 -26.85 68.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.098 0.475 . . . . 10.0 110.429 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 13' ' ' LEU . 95.3 t -81.24 -39.77 17.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.073 178.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.13 -48.66 80.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.557 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.59 -1.28 45.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.812 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -86.44 4.86 85.72 Favored Glycine 0 N--CA 1.45 -0.407 0 CA-C-N 116.063 -0.517 . . . . 10.0 112.977 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 87.5 t -63.33 -29.71 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.476 0.655 . . . . 10.0 110.277 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.549 ' HB3' ' HA ' ' A' ' 773' ' ' SER . 17.0 tpt -114.5 92.53 3.99 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.511 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 1.1 m -71.36 143.83 50.08 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.345 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.62 -8.55 59.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.068 0.461 . . . . 10.0 110.626 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -85.41 90.93 8.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.355 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.17 131.01 55.47 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.401 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -98.6 12.22 35.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.548 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.364 -0.827 . . . . 10.0 111.014 -179.75 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.48 1.032 0 CA-C-O 120.878 0.371 . . . . 10.0 110.441 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -90.39 140.33 29.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.569 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.41 176.0 14.22 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.899 -0.667 . . . . 10.0 112.541 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.5 127.72 32.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.946 0.403 . . . . 10.0 110.506 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.581 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 8.7 mmt180 -70.22 144.52 51.86 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.62 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.6 m120 73.35 -63.13 0.44 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.097 -0.956 . . . . 10.0 112.059 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.94 -54.47 21.67 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 -178.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -86.31 -25.86 25.22 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.966 0.728 . . . . 10.0 112.966 -178.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.0 p -60.61 -46.68 89.37 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.72 -0.392 . . . . 10.0 110.685 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.2 mt -64.46 -31.79 73.15 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.784 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -67.62 -45.78 74.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.072 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -67.4 -44.17 79.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.51 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 39.6 mtt -63.55 -34.04 76.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.88 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.5 tpp180 -61.32 -35.7 78.1 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.944 0.402 . . . . 10.0 110.304 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -65.52 -39.8 92.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 10.0 109.808 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -69.04 -39.45 79.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.915 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.42 HG13 HD12 ' A' ' 88' ' ' LEU . 52.7 t -58.33 -37.51 63.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-O 121.277 0.56 . . . . 10.0 109.935 178.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -65.45 -38.74 90.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.334 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 72.1 mt -66.64 -45.02 89.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.075 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.5 mt -59.33 -41.76 85.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.642 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -67.55 -27.69 67.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.074 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.25 -26.66 30.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.064 0.459 . . . . 10.0 110.597 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 8.6 tpt -83.95 -18.72 36.34 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.629 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.493 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 37.2 tt0 -56.98 -52.01 77.32 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.304 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.493 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 71.5 Cg_exo -53.47 -33.41 67.37 Favored 'Trans proline' 0 C--N 1.36 1.159 0 C-N-CA 121.927 1.751 . . . . 10.0 112.178 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 tp10 -70.52 -40.31 73.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.168 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.3 mmt -66.59 -29.83 69.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.579 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -66.14 -23.09 66.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.562 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.0 mtpt -83.32 -24.2 32.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.046 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp -76.92 142.19 40.2 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.542 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.7 p -82.48 171.12 14.48 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.041 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -57.03 -38.78 73.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.312 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -68.43 -36.33 78.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.904 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.9 -32.11 70.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.285 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.98 -45.4 94.93 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -67.44 -31.45 71.63 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.951 -1.022 . . . . 10.0 109.725 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.81 -37.59 95.11 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.56 -0.746 . . . . 10.0 111.736 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -67.28 -36.26 81.18 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.724 -0.472 . . . . 10.0 109.724 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 19.1 m -58.18 -48.16 81.16 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.162 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.54 -35.25 80.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.342 179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.18 -43.2 99.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.553 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -58.79 -43.06 90.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.738 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.7 mtp180 -61.81 -44.23 97.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.656 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' A' ' 56' ' ' LYS . . . -66.67 -39.41 88.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.267 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 -62.83 -39.29 93.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.555 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 mt -58.09 -37.36 74.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.317 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -71.15 -37.14 72.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.321 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 52' ' ' ALA . 28.4 mtpp -72.72 -9.19 58.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.958 -0.565 . . . . 10.0 111.204 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.67 61.67 0.66 Allowed Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.757 -0.735 . . . . 10.0 111.983 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -116.91 146.1 43.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.718 -0.475 . . . . 10.0 109.718 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 38.2 t -85.84 133.18 30.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.182 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.417 HD11 ' O ' ' A' ' 118' ' ' LEU . 17.8 tp -61.09 -43.89 98.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.918 0.389 . . . . 10.0 110.464 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -65.83 -21.54 66.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.291 -0.413 . . . . 10.0 111.17 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -81.23 -17.36 49.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.243 0.544 . . . . 10.0 110.151 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.1 mt -84.65 -13.29 51.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.079 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.51 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 73.9 mt -50.23 -52.55 52.91 Favored Pre-proline 0 CA--C 1.542 0.67 0 N-CA-C 113.054 0.761 . . . . 10.0 113.054 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.51 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.0 Cg_exo -53.46 -34.77 73.35 Favored 'Trans proline' 0 C--N 1.36 1.151 0 C-N-CA 122.362 2.041 . . . . 10.0 113.444 -179.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.471 ' O ' HG23 ' A' ' 70' ' ' VAL . 38.4 mt-10 -89.58 -46.59 8.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.44 -0.345 . . . . 10.0 111.46 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.482 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -58.8 -47.92 83.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.996 -178.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -63.33 -32.34 73.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.675 -179.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.91 -43.63 78.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.257 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 66' ' ' GLU . 58.3 t -61.08 -47.72 92.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.107 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 67' ' ' ALA . 46.7 t -59.5 -45.21 94.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.34 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.431 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 19.0 ttm180 -61.0 -44.86 96.8 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.604 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 29.1 tp10 -61.05 -48.4 81.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.376 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.99 -33.27 74.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.079 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 29.8 m -61.04 -35.89 78.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.746 0.307 . . . . 10.0 111.059 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -75.06 -16.89 60.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.296 -0.411 . . . . 10.0 112.028 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -104.24 -35.83 7.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.762 0.315 . . . . 10.0 111.518 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 92.8 t -81.41 -52.52 13.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.614 -0.266 . . . . 10.0 111.64 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -104.22 -14.05 15.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.656 0.265 . . . . 10.0 111.562 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 72.22 29.09 66.96 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.714 -0.755 . . . . 10.0 111.552 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.5 mtt -126.49 141.23 51.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.799 0.333 . . . . 10.0 110.791 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 37.0 ttt85 -85.59 122.67 30.03 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.95 111.06 1.52 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -47.23 141.12 4.76 Favored 'General case' 0 N--CA 1.463 0.211 0 O-C-N 124.139 0.9 . . . . 10.0 112.307 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -64.17 -34.42 78.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.338 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.6 m -69.58 -25.19 28.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.847 0.355 . . . . 10.0 110.839 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -71.67 -28.4 63.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.826 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.42 HD12 HG13 ' A' ' 25' ' ' VAL . 85.2 mt -62.03 -36.78 82.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.055 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 36.0 mt -66.15 -47.88 72.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.826 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -63.14 -36.45 93.46 Favored Glycine 0 N--CA 1.451 -0.334 0 CA-C-N 115.712 -0.677 . . . . 10.0 112.164 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.76 -34.57 89.12 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.112 -0.566 . . . . 10.0 112.195 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.416 ' HG3' ' O ' ' A' ' 88' ' ' LEU . 38.4 mtt -74.21 -35.87 63.93 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.2 t -65.47 -43.05 94.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 10.0 110.02 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 84.3 mt -72.92 -5.35 37.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.268 -0.878 . . . . 10.0 111.966 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -83.29 -24.67 32.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.892 0.377 . . . . 10.0 110.383 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -103.37 -146.33 0.37 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.299 -0.409 . . . . 10.0 110.585 -179.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 97' ' ' ARG . 28.7 ttt85 -108.07 58.98 0.61 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.168 0.509 . . . . 10.0 110.189 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 408' ' ' ASP . 0.0 OUTLIER -137.57 150.19 47.28 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.335 0.588 . . . . 10.0 111.981 -178.862 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.552 HD12 HG11 ' A' ' 211' ' ' VAL . 50.7 mm -93.46 132.55 37.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.373 -0.831 . . . . 10.0 108.881 178.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -107.6 120.11 41.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.735 0.302 . . . . 10.0 111.703 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -85.47 125.68 33.22 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.4 mtm -122.48 140.6 52.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.076 0.465 . . . . 10.0 110.886 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.497 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 11.5 mmm180 -77.1 152.19 35.08 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.563 -0.744 . . . . 10.0 111.082 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.65 94.68 1.03 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.9 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 148.2 -33.48 1.23 Allowed Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.824 -0.703 . . . . 10.0 112.353 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.623 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 2.2 mm-40 -65.56 -49.42 68.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.013 0.435 . . . . 10.0 110.292 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 143.79 168.03 12.08 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 120.753 -0.737 . . . . 10.0 112.085 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.97 -82.63 0.65 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.93 0.395 . . . . 10.0 110.461 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.03 -20.86 66.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.166 0.508 . . . . 10.0 111.117 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 27.7 tp -70.02 -19.96 63.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.252 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 3.2 m -95.72 -36.6 11.13 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.194 0.521 . . . . 10.0 110.654 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.624 ' HB1' HD21 ' A' ' 207' ' ' LEU . . . -75.98 -4.66 42.35 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.863 0.69 . . . . 10.0 112.863 -178.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.06 -24.28 61.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.947 0.403 . . . . 10.0 111.27 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.409 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 17.7 mt -71.15 -57.13 4.95 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-N 116.11 -0.495 . . . . 10.0 111.795 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 29.4 Cg_endo -61.92 -30.62 83.98 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 122.17 1.914 . . . . 10.0 112.222 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.55 -47.16 73.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.635 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.434 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 65.4 t80 -61.25 -46.15 91.59 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.068 0.461 . . . . 10.0 110.477 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.417 ' O ' HD11 ' A' ' 60' ' ' LEU . 20.5 tp -61.86 -50.39 72.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.629 -0.714 . . . . 10.0 112.007 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -68.2 -28.42 67.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.24 -28.51 67.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.396 0.141 . . . . 10.0 111.34 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 85.9 mt -55.38 -29.24 58.08 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 112.058 0.392 . . . . 10.0 112.058 -179.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 76.7 p -66.29 -26.82 67.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.632 -0.258 . . . . 10.0 111.363 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 86.36 -1.33 87.41 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.389 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -76.53 -21.41 55.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.717 0.294 . . . . 10.0 110.953 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 101.12 138.04 10.05 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.708 -0.758 . . . . 10.0 113.778 178.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 68.4 t -107.04 121.39 59.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -98.41 102.7 14.52 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.67 0.271 . . . . 10.0 110.782 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 26.2 t -95.59 125.06 48.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.905 0.384 . . . . 10.0 110.447 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 79.3 t -110.48 117.59 55.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.453 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.87 160.76 14.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.955 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 13.2 m -67.24 -35.25 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 112.064 0.394 . . . . 10.0 112.064 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -145.63 161.35 40.03 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.518 -0.31 . . . . 10.0 110.187 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -67.37 -28.83 68.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.697 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -55.3 -53.7 52.83 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.132 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.3 mt -74.23 -32.92 63.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.251 -0.432 . . . . 10.0 110.877 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -53.83 -49.98 67.19 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.833 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -72.1 -36.41 69.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.856 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 17.6 ttp180 -62.61 -59.64 4.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.966 -0.561 . . . . 10.0 112.13 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.63 -29.31 69.32 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.667 -178.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.45 88.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 10.0 110.55 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -75.8 -26.0 56.88 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.154 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . 0.435 ' O ' ' HD2' ' A' ' 145' ' ' PRO . 11.3 t30 -73.43 -40.82 63.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.021 0.439 . . . . 10.0 110.634 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -86.92 -6.81 58.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.367 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.512 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 61.7 ttm-85 -60.01 -49.46 91.06 Favored Pre-proline 0 CA--C 1.537 0.467 0 N-CA-C 112.026 0.38 . . . . 10.0 112.026 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' PRO . . . . . 0.512 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 34.1 Cg_exo -63.81 -10.37 22.25 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 122.155 1.903 . . . . 10.0 112.886 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 20.3 tp -96.07 -48.92 5.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.935 0.398 . . . . 10.0 110.424 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -71.54 -51.11 25.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.012 -0.54 . . . . 10.0 112.18 -178.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -65.27 -23.48 67.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.677 0.275 . . . . 10.0 111.438 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -67.17 -28.92 68.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.105 0.479 . . . . 10.0 110.037 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 43.9 mt -96.9 -2.41 43.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.006 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 98.82 22.8 12.81 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.598 -0.811 . . . . 10.0 113.502 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 43.2 mt -109.76 121.8 46.05 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.7 p -78.4 130.32 35.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.016 0.436 . . . . 10.0 112.024 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 48.3 t -104.74 127.88 58.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.933 -0.576 . . . . 10.0 109.971 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -123.02 142.72 14.73 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.613 -0.803 . . . . 10.0 112.264 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 6.6 tp -112.85 134.55 55.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -121.34 110.29 15.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.856 0.36 . . . . 10.0 110.247 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 161' ' ' MET . 94.1 mt -102.4 147.75 34.44 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.617 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' PRO . . . . . 0.519 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 16.7 Cg_endo -58.49 114.26 1.91 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.7 2.267 . . . . 10.0 112.232 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 99.63 6.96 54.36 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.771 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . 0.49 ' HB2' ' O ' ' A' ' 158' ' ' LEU . 0.1 OUTLIER -67.27 144.8 98.36 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 110.529 -0.174 . . . . 10.0 110.529 179.57 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -57.3 149.56 64.0 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.635 2.223 . . . . 10.0 112.301 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . 0.507 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.09 -49.86 82.03 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 112.769 0.655 . . . . 10.0 112.769 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.507 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 53.0 Cg_exo -57.15 -41.39 74.66 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 121.774 1.65 . . . . 10.0 112.029 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -63.08 -44.42 95.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.661 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.459 ' HE2' ' O ' ' A' ' 161' ' ' MET . 59.6 mttm -60.86 -45.44 94.53 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.432 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -57.83 -42.69 84.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.821 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 164' ' ' PRO . 58.2 mt-10 -66.28 -39.12 89.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.784 0.326 . . . . 10.0 111.024 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -69.44 -42.56 74.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.584 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -74.7 -31.2 61.8 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.449 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -79.12 3.26 18.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.882 0.372 . . . . 10.0 110.832 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -84.59 -179.17 7.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.148 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -79.22 -42.59 25.62 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 110.071 -0.344 . . . . 10.0 110.071 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.1 mp -128.78 121.51 54.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.281 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.7 m -108.74 123.34 48.85 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.84 0.352 . . . . 10.0 111.353 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -102.71 131.26 49.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.747 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.62 176.74 44.05 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.568 -0.825 . . . . 10.0 112.202 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.79 155.79 16.63 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.77 0.319 . . . . 10.0 111.158 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -59.99 -35.4 74.95 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.237 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -55.63 -57.87 10.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.037 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.519 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 3.6 tp10 -69.53 -36.61 76.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.381 -178.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -58.1 -38.87 77.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.904 0.383 . . . . 10.0 111.308 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -78.23 -42.4 15.29 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.715 -0.755 . . . . 10.0 111.921 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -64.56 -38.17 90.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.767 0.318 . . . . 10.0 111.077 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . 0.412 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 10.9 m-20 -60.6 -41.55 94.98 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.47 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -64.51 -38.33 90.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.411 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 18.6 mt -63.85 -44.78 92.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.777 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 39.0 mtm-85 -72.03 -36.05 69.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.868 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -64.14 -47.29 80.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.287 0.565 . . . . 10.0 110.917 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.69 -8.91 57.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.804 -0.634 . . . . 10.0 112.258 -178.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 17.8 ttp -101.08 14.71 31.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.169 0.509 . . . . 10.0 110.75 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -76.42 160.13 29.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.843 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -102.69 -24.16 13.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.176 0.513 . . . . 10.0 110.029 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 67.7 m -129.0 140.84 39.8 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.716 -0.674 . . . . 10.0 109.625 178.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.0 -24.96 75.83 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.847 2.364 . . . . 10.0 112.846 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.83 -9.35 58.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.585 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -91.66 -6.93 51.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.854 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 198' ' ' ARG . 19.4 mtt85 -58.97 155.94 12.52 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.148 0.499 . . . . 10.0 111.875 -179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 16.1 m -137.43 -16.29 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.514 -0.766 . . . . 10.0 111.047 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -84.87 -178.5 6.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.324 0.583 . . . . 10.0 111.799 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -143.02 177.22 8.51 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.218 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 32.9 tttm -60.88 133.74 56.39 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.203 0.525 . . . . 10.0 111.201 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 17.4 mt -84.94 69.93 10.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.612 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . 0.409 ' HA ' ' OE2' ' A' ' 385' ' ' GLU . 18.3 t-80 -81.09 -64.66 1.14 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.905 -178.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -124.69 133.76 53.1 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.935 0.397 . . . . 10.0 111.288 -178.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.582 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -119.99 123.3 43.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.645 -0.707 . . . . 10.0 109.626 179.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . 0.624 HD21 ' HB1' ' A' ' 112' ' ' ALA . 53.6 tp -117.09 100.36 7.68 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.073 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -94.04 128.59 45.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.052 0.454 . . . . 10.0 110.579 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -55.99 -72.15 0.08 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.324 -0.853 . . . . 10.0 111.905 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.39 105.45 13.14 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.638 0.256 . . . . 10.0 110.681 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.552 HG11 HD12 ' A' ' 99' ' ' ILE . 27.4 m -68.38 -22.32 27.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.537 -0.302 . . . . 10.0 111.178 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . 0.567 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.2 m-20 -45.04 -64.08 0.79 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.026 0.828 . . . . 10.0 111.878 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.449 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 68.7 m -96.62 -37.08 10.5 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.801 0.667 . . . . 10.0 112.801 -178.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 73.4 mt -64.21 -38.62 82.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -178.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 12.7 mt -102.25 -50.82 3.52 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 216' ' ' ILE . . . . . 0.567 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 50.5 mm -73.62 -56.31 9.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.979 0.733 . . . . 10.0 112.979 -177.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 217' ' ' ASP . . . . . 0.449 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 79.0 m-20 -63.45 -45.74 89.47 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.133 0.42 . . . . 10.0 112.133 -178.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -93.26 28.91 2.05 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.115 0.413 . . . . 10.0 112.115 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -66.97 -48.38 68.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.972 0.415 . . . . 10.0 111.644 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 220' ' ' ARG . . . . . 0.41 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 0.0 OUTLIER -98.59 18.8 15.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.063 -179.007 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 85.0 m -84.57 113.0 46.41 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.319 -0.401 . . . . 10.0 110.465 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -92.82 135.1 1.25 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 122.806 2.337 . . . . 10.0 113.17 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 223' ' ' LEU . . . . . 0.642 ' O ' ' HA ' ' A' ' 374' ' ' SER . 96.9 mt -94.48 120.17 34.3 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 21.6 mt -113.99 132.76 62.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.241 0.46 . . . . 10.0 112.241 -178.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 27.9 mt -113.51 107.4 22.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 108.767 -0.827 . . . . 10.0 108.767 177.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 4.3 m -114.01 109.84 19.1 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.98 0.419 . . . . 10.0 111.453 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 227' ' ' GLY . . . . . 0.734 ' H ' HD12 ' A' ' 372' ' ' LEU . . . -125.42 80.09 0.36 Allowed Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 111.277 -0.729 . . . . 10.0 111.277 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -62.34 130.32 29.88 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.718 2.279 . . . . 10.0 112.525 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -98.3 93.05 6.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.839 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 74.22 116.93 0.05 Allowed 'General case' 0 N--CA 1.467 0.378 0 O-C-N 124.185 0.928 . . . . 10.0 111.786 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 231' ' ' ASP . . . . . 0.437 ' HA ' ' HB2' ' A' ' 367' ' ' ASN . 2.0 m-20 -74.67 72.64 1.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.351 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 38.1 m -156.79 104.74 2.15 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.341 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 49.1 m -140.35 83.82 1.93 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.94 0.4 . . . . 10.0 110.888 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . 0.469 ' HA ' HD12 ' A' ' 365' ' ' ILE . 1.4 tp10 -70.08 -2.8 13.93 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.125 -0.488 . . . . 10.0 111.63 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -57.98 -41.87 83.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.914 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -65.81 -26.87 67.88 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.012 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 237' ' ' LYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 241' ' ' LYS . 4.2 ttmt -69.34 -37.29 77.61 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 52.0 mmm-85 -67.57 -47.75 68.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.61 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 239' ' ' VAL . . . . . 0.416 ' O ' HG12 ' A' ' 242' ' ' ILE . 4.2 p -69.37 -21.33 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 116.286 -0.415 . . . . 10.0 111.5 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -89.39 -14.33 35.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.444 0.64 . . . . 10.0 109.572 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 241' ' ' LYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 237' ' ' LYS . 0.1 OUTLIER -97.98 9.89 41.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.21 -179.132 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 242' ' ' ILE . . . . . 0.467 HG22 ' HG3' ' A' ' 289' ' ' GLU . 26.5 pt -75.23 -16.4 15.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.063 0.458 . . . . 10.0 109.966 178.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 243' ' ' ILE . . . . . . . . . . . . . 5.5 pt -124.36 74.98 61.29 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.996 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 244' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -81.54 -19.72 7.37 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.209 1.939 . . . . 10.0 112.144 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -110.84 105.25 14.01 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.712 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 246' ' ' LEU . . . . . 0.422 HD22 ' HB3' ' A' ' 253' ' ' ASP . 23.6 mt -83.93 167.42 16.98 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.161 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 66.3 mt -125.05 -32.82 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.66 -0.245 . . . . 10.0 110.853 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? 57.33 33.92 23.99 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.706 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 -153.77 -57.33 0.12 Allowed 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.936 -0.306 . . . . 10.0 111.268 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -136.53 132.15 34.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.566 -179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.539 ' H ' HD22 ' A' ' 281' ' ' LEU . 55.7 pttt 51.08 -178.55 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.982 1.313 . . . . 10.0 113.953 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 252' ' ' GLU . . . . . 0.507 ' HG2' ' HG3' ' A' ' 251' ' ' LYS . 5.3 mm-40 64.11 -74.36 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 114.813 -1.085 . . . . 10.0 113.267 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 253' ' ' ASP . . . . . 0.422 ' HB3' HD22 ' A' ' 246' ' ' LEU . 6.1 p-10 -113.76 29.59 7.89 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.285 0.846 . . . . 10.0 113.285 -177.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 9.7 m -73.57 144.1 46.18 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 122.093 -0.379 . . . . 10.0 110.498 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . 0.402 ' HB3' ' CB ' ' A' ' 318' ' ' ALA . 0.0 OUTLIER -85.78 -43.88 12.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.486 0.66 . . . . 10.0 109.944 179.722 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 55.0 m -156.24 -50.4 0.08 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.383 -0.826 . . . . 10.0 109.124 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 9.6 t80 60.02 -81.51 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.268 -0.878 . . . . 10.0 112.115 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 10.7 tp60 63.1 15.07 8.19 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.023 0.529 . . . . 10.0 110.766 -179.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 86.92 -16.42 47.15 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.834 -0.621 . . . . 10.0 113.078 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -101.75 -47.59 4.56 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.719 0.295 . . . . 10.0 111.682 -178.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 87.13 -132.32 11.1 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.555 -0.831 . . . . 10.0 111.632 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -145.51 172.05 13.78 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.357 -0.238 . . . . 10.0 110.357 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -74.79 171.69 13.52 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 110.164 -0.31 . . . . 10.0 110.164 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 18.3 m -77.17 67.56 3.16 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.107 0.479 . . . . 10.0 110.819 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 5.3 m -133.22 -32.72 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.293 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -168.31 -173.42 1.98 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.493 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -131.13 5.87 4.52 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.757 0.313 . . . . 10.0 111.133 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 268' ' ' LYS . . . . . . . . . . . . . 19.9 mttp -114.57 105.99 13.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.295 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 58.0 m -81.51 89.94 6.21 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 47.3 mtp85 -85.18 60.49 6.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.924 -178.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.28 -18.07 20.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.01 179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 15.3 t 51.65 76.51 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.33 -0.85 . . . . 10.0 110.78 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -153.94 -51.56 0.1 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.077 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 74.5 mt 71.1 153.04 0.12 Allowed 'General case' 0 N--CA 1.472 0.675 0 O-C-N 123.697 0.623 . . . . 10.0 110.446 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -149.88 -84.95 0.09 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.76 0.652 . . . . 10.0 112.76 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 57.69 52.37 8.3 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.76 0.79 . . . . 10.0 109.838 -177.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -85.64 13.21 7.34 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.203 -0.908 . . . . 10.0 110.182 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . -102.87 -21.33 10.35 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.514 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 59.05 40.79 21.71 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.215 0.531 . . . . 10.0 109.856 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 13.6 p -124.15 -18.67 3.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.805 -0.634 . . . . 10.0 111.14 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 281' ' ' LEU . . . . . 0.539 HD22 ' H ' ' A' ' 251' ' ' LYS . 47.1 mt -92.98 -42.27 9.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.826 0.346 . . . . 10.0 110.277 -179.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 32.8 pt -82.03 9.07 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.21 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -66.6 -59.54 3.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.57 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -87.58 11.82 14.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.189 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 1.7 tt -72.75 -27.66 62.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.047 0.451 . . . . 10.0 110.074 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 286' ' ' LEU . . . . . 0.441 HD21 ' HB2' ' A' ' 298' ' ' LEU . 48.8 mt -86.79 -169.97 2.87 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.854 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 287' ' ' VAL . . . . . . . . . . . . . 3.3 t 60.37 34.81 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 CA-C-O 121.802 0.811 . . . . 10.0 110.372 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm -138.16 128.29 25.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.446 -0.797 . . . . 10.0 109.675 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 289' ' ' GLU . . . . . 0.467 ' HG3' HG22 ' A' ' 242' ' ' ILE . 3.0 mm-40 67.78 -165.81 0.2 Allowed 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.827 0.704 . . . . 10.0 111.379 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -88.01 141.25 16.88 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.893 -0.67 . . . . 10.0 111.942 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 291' ' ' ILE . . . . . . . . . . . . . 1.4 tt 90.85 143.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 124.389 1.076 . . . . 10.0 109.394 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 60.4 mtm 68.7 16.99 8.95 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.864 0.84 . . . . 10.0 108.851 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -102.83 -4.33 25.03 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.5 -1.227 . . . . 10.0 110.434 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -85.95 -34.97 20.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.487 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 133.21 28.92 0.52 Allowed Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.609 -0.805 . . . . 10.0 113.165 179.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -86.23 172.05 10.8 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.864 0.332 . . . . 10.0 110.379 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 297' ' ' SER . . . . . 0.421 ' HB3' ' CE1' ' A' ' 299' ' ' TYR . 44.8 m -113.24 131.2 56.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.882 0.372 . . . . 10.0 110.717 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.441 ' HB2' HD21 ' A' ' 286' ' ' LEU . 20.4 tp -75.37 -29.13 59.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.873 -0.603 . . . . 10.0 112.027 -178.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 299' ' ' TYR . . . . . 0.421 ' CE1' ' HB3' ' A' ' 297' ' ' SER . 55.2 p90 -79.74 -7.73 58.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.446 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 44.7 m -89.39 146.95 37.01 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.969 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 301' ' ' PRO . . . . . 0.46 ' HA ' ' HB ' ' A' ' 304' ' ' ILE . 18.6 Cg_endo -59.8 -14.83 28.91 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 123.441 2.761 . . . . 10.0 113.13 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -68.71 -41.28 79.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.04 0.448 . . . . 10.0 110.744 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -110.81 26.85 10.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.558 -179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 304' ' ' ILE . . . . . 0.46 ' HB ' ' HA ' ' A' ' 301' ' ' PRO . 9.3 tp -60.82 -26.39 38.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.512 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -44.07 95.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.091 0.472 . . . . 10.0 109.745 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -67.88 -36.15 79.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.757 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 13.5 tpt -60.68 -36.94 80.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.828 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -78.01 -15.14 59.19 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.603 -0.272 . . . . 10.0 110.813 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -84.14 -42.98 15.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.897 0.38 . . . . 10.0 110.121 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 18.0 m -71.05 -33.5 51.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.108 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.83 -26.35 66.01 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.319 0.58 . . . . 10.0 109.868 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 312' ' ' ALA . . . . . 0.624 ' O ' ' HG2' ' A' ' 315' ' ' ARG . . . -72.46 -43.16 64.13 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 178.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -62.8 -38.05 89.12 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.392 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 3.7 mp -70.07 -43.48 71.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.335 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 315' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 312' ' ' ALA . 12.1 ptp180 -64.33 -28.31 69.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.824 0.345 . . . . 10.0 110.49 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -85.92 9.18 17.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.929 0.395 . . . . 10.0 110.898 179.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -110.55 -42.66 4.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.392 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.402 ' CB ' ' HB3' ' A' ' 255' ' ' GLU . . . -113.65 -31.62 6.43 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.019 0.748 . . . . 10.0 113.019 -178.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 319' ' ' LEU . . . . . 0.562 ' HB2' ' O ' ' A' ' 315' ' ' ARG . 3.7 mm? -79.64 -58.09 3.36 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.858 -0.337 . . . . 10.0 110.383 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -86.45 108.06 18.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.87 0.367 . . . . 10.0 110.088 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 321' ' ' THR . . . . . 0.535 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 0.2 OUTLIER -94.97 140.77 29.48 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.176 -179.383 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 322' ' ' ARG . . . . . 0.43 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 6.8 tpt180 -64.49 141.83 58.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.688 -0.687 . . . . 10.0 111.48 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 323' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 94.1 m-20 77.71 -53.19 0.53 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.228 1.011 . . . . 10.0 113.189 177.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 324' ' ' VAL . . . . . 0.535 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 3.0 p -74.66 -46.78 41.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.543 0 N-CA-C 112.742 0.645 . . . . 10.0 112.742 -178.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -87.06 -26.27 23.78 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.822 0.344 . . . . 10.0 111.515 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 47.8 p90 -158.56 152.49 23.65 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.418 -0.356 . . . . 10.0 110.31 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 327' ' ' ILE . . . . . 0.43 HG23 ' HB ' ' A' ' 334' ' ' ILE . 6.9 tp -124.49 119.52 56.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.232 0.539 . . . . 10.0 110.105 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 55.3 t -95.26 108.62 21.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.023 -0.535 . . . . 10.0 109.989 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.13 140.39 34.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.554 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 63.43 16.6 9.68 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.044 0.45 . . . . 10.0 110.452 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 85.84 2.26 86.57 Favored Glycine 0 N--CA 1.449 -0.447 0 N-CA-C 111.557 -0.617 . . . . 10.0 111.557 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -100.07 137.89 37.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.666 0.269 . . . . 10.0 110.497 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 42.8 t -100.0 91.93 2.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.134 0.493 . . . . 10.0 109.698 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 334' ' ' ILE . . . . . 0.43 ' HB ' HG23 ' A' ' 327' ' ' ILE . 87.2 mt -86.88 128.47 39.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.432 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 4.2 mp -80.74 133.85 28.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.411 -0.358 . . . . 10.0 110.478 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 60.2 t -111.72 127.15 69.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.39 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 337' ' ' ASP . . . . . 0.567 ' HB3' ' H ' ' A' ' 342' ' ' ARG . 0.9 OUTLIER -72.83 122.4 21.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.916 178.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -75.65 -16.09 60.24 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.844 -0.616 . . . . 10.0 112.184 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -75.67 -58.57 3.2 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.383 0.512 . . . . 10.0 112.383 -178.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -122.69 13.19 9.99 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.67 0.619 . . . . 10.0 112.67 -178.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 61.78 59.29 9.95 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.552 -0.832 . . . . 10.0 111.911 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.567 ' H ' ' HB3' ' A' ' 337' ' ' ASP . 0.0 OUTLIER -103.25 141.92 35.07 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.702 0.287 . . . . 10.0 110.606 -179.756 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 6.9 m -88.75 116.81 27.29 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.228 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 43.7 mtm -118.52 82.04 1.78 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.023 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -90.28 -20.71 22.62 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.769 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -105.04 53.59 0.66 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.595 -0.812 . . . . 10.0 112.13 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -146.41 145.15 30.15 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -117.04 156.81 26.89 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.023 0.439 . . . . 10.0 110.725 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 349' ' ' TRP . . . . . 0.464 ' O ' ' HD2' ' A' ' 354' ' ' HIS . 68.5 m95 -128.25 105.39 8.32 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.427 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 24.2 m -72.47 -171.61 0.82 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.619 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 35.4 t70 70.04 6.71 5.89 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.586 0.708 . . . . 10.0 110.834 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 84.39 16.07 67.43 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.717 -0.674 . . . . 10.0 112.836 179.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 4.5 mp -55.98 -60.82 2.93 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.782 0.325 . . . . 10.0 111.726 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 354' ' ' HIS . . . . . 0.464 ' HD2' ' O ' ' A' ' 349' ' ' TRP . 13.6 p80 -75.47 -19.81 59.19 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.923 -0.311 . . . . 10.0 111.379 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 355' ' ' GLN . . . . . 0.563 ' HA ' ' NE2' ' A' ' 355' ' ' GLN . 0.0 OUTLIER -66.35 -32.23 73.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.896 0.379 . . . . 10.0 110.829 -179.177 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -73.12 -28.15 62.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.82 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 93.6 t -69.52 -49.11 62.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.068 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.504 ' OE1' ' HG2' ' A' ' 366' ' ' GLN . 15.7 mt-10 -66.8 -15.74 63.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.967 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -91.68 -25.47 19.1 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.135 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -78.04 -54.46 6.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.745 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -94.87 178.28 5.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.811 -179.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -79.11 69.69 2.9 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.202 -0.523 . . . . 10.0 112.543 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 2.1 t -126.55 156.54 37.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.972 -0.381 . . . . 10.0 109.972 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 6.5 tm0? -76.15 125.11 28.54 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.264 -0.643 . . . . 10.0 109.264 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 365' ' ' ILE . . . . . 0.469 HD12 ' HA ' ' A' ' 234' ' ' GLU . 25.9 mt -86.63 132.68 31.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.866 0.365 . . . . 10.0 111.849 -178.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 366' ' ' GLN . . . . . 0.504 ' HG2' ' OE1' ' A' ' 358' ' ' GLU . 32.0 mm-40 -79.21 -172.59 3.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.583 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 367' ' ' ASN . . . . . 0.528 ' OD1' HG13 ' B' ' 21' ' ' VAL . 2.2 t-20 -103.2 -2.61 26.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.796 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 66.6 -171.45 0.19 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.556 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -90.92 -59.17 2.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.967 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 67.58 151.85 0.08 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.425 0.898 . . . . 10.0 113.425 178.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 1.7 m -101.77 69.61 1.21 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.048 -0.978 . . . . 10.0 108.934 178.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 372' ' ' LEU . . . . . 0.734 HD12 ' H ' ' A' ' 227' ' ' GLY . 33.1 mt -66.52 -27.1 67.5 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.9 -1.045 . . . . 10.0 112.791 -177.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -161.21 131.16 4.92 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.798 -0.445 . . . . 10.0 109.798 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 374' ' ' SER . . . . . 0.642 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 1.4 t -156.41 142.55 18.16 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.115 0.483 . . . . 10.0 111.516 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 14.3 tt -146.9 147.39 17.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.462 -0.79 . . . . 10.0 109.794 178.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.96 142.37 30.54 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -56.74 -49.18 76.0 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 123.036 0.21 . . . . 10.0 111.215 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 378' ' ' GLN . . . . . 0.441 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.5 tm0? -57.07 -43.89 82.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.028 0.442 . . . . 10.0 110.715 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -73.54 -11.36 60.42 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.72 -0.673 . . . . 10.0 111.768 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -93.69 -44.88 7.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.911 0.386 . . . . 10.0 110.329 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -69.36 -21.7 63.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.136 -0.483 . . . . 10.0 111.313 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 63.5 mtp180 -72.88 -4.18 30.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.134 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 56.9 mt -97.42 8.57 44.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.937 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.582 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 27.6 m-85 -99.17 146.44 26.15 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.818 0.342 . . . . 10.0 110.793 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 385' ' ' GLU . . . . . 0.409 ' OE2' ' HA ' ' A' ' 204' ' ' HIS . 34.4 mt-10 -70.37 -65.8 0.68 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.091 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -102.63 104.09 14.43 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.213 -0.662 . . . . 10.0 109.213 178.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.45 HD23 HD21 ' A' ' 407' ' ' LEU . 61.5 tp -110.72 110.61 21.33 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.641 -179.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -131.92 165.66 23.41 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.783 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -163.84 162.7 35.31 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.403 -0.903 . . . . 10.0 112.409 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 63.3 mtm -107.82 156.85 18.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.989 0.424 . . . . 10.0 110.399 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 391' ' ' THR . . . . . 0.41 ' HB ' HG22 ' A' ' 211' ' ' VAL . 15.3 t -153.59 165.68 35.15 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.737 -0.665 . . . . 10.0 109.21 179.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -101.9 -171.25 27.58 Favored Glycine 0 N--CA 1.441 -1.006 0 N-CA-C 110.613 -0.995 . . . . 10.0 110.613 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 393' ' ' THR . . . . . 0.497 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 3.1 m -74.67 66.26 1.43 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.536 0.684 . . . . 10.0 110.589 179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . 0.533 ' HB1' ' HG2' ' A' ' 566' ' ' ARG . . . -102.76 -45.72 4.92 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.125 -0.943 . . . . 10.0 110.274 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 395' ' ' ASP . . . . . 0.426 ' CG ' ' H ' ' A' ' 396' ' ' THR . 10.0 t70 56.78 -144.35 0.66 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.615 -0.721 . . . . 10.0 110.214 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 396' ' ' THR . . . . . 0.426 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 3.0 m 70.02 -79.88 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.851 0.686 . . . . 10.0 112.851 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -79.31 26.98 0.26 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.879 0.371 . . . . 10.0 111.683 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 398' ' ' ALA . . . . . 0.465 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -66.21 -35.89 81.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.138 0.494 . . . . 10.0 110.992 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -72.76 -15.58 61.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.598 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -83.88 -21.32 31.99 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.651 -0.25 . . . . 10.0 111.047 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 401' ' ' PHE . . . . . 0.465 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 24.7 m-85 -59.61 -46.67 88.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.056 0.455 . . . . 10.0 110.546 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.55 -0.15 36.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.733 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.3 m -108.26 -43.71 4.3 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.772 0.286 . . . . 10.0 111.772 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 44.6 mt -86.41 -55.18 6.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 405' ' ' TYR . . . . . 0.441 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 60.8 m-85 -100.04 -4.81 29.14 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.132 0.419 . . . . 10.0 112.132 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 31.4 mmtt 60.98 51.09 4.69 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.365 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 407' ' ' LEU . . . . . 0.476 HD13 HD11 ' A' ' 99' ' ' ILE . 26.4 mt -117.65 149.77 40.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.896 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . 0.581 ' OD2' ' HD2' ' A' ' 13' ' ' ARG . 21.0 t70 -85.2 170.25 13.04 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.938 -0.764 . . . . 10.0 108.938 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 18.2 m -138.71 120.73 15.59 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.835 -0.541 . . . . 10.0 111.605 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 14.0 t -127.35 137.11 58.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.326 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 87.4 t -93.45 133.33 34.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.648 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 59.2 t -91.3 127.07 52.52 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.795 -0.446 . . . . 10.0 109.795 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.66 142.1 69.18 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.522 2.148 . . . . 10.0 112.634 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' A' ' 416' ' ' ARG . 0.2 OUTLIER -64.1 151.55 42.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.584 -0.735 . . . . 10.0 111.604 -179.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -70.0 -26.85 64.27 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.178 0.514 . . . . 10.0 110.492 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 416' ' ' ARG . . . . . 0.509 ' HB2' ' O ' ' A' ' 578' ' ' GLN . 58.3 mtm180 -134.14 157.9 76.55 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.84 122.49 11.06 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.28 1.987 . . . . 10.0 111.445 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 3.8 mtm -76.53 100.42 5.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.034 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.6 pt -95.24 51.39 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.303 0.573 . . . . 10.0 110.602 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 30.4 ttp-105 -94.2 116.02 28.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.494 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -84.43 105.04 14.95 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.148 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -88.54 112.47 23.05 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.087 -0.709 . . . . 10.0 109.087 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 26.5 mt -93.06 150.62 39.53 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.547 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -62.68 163.69 20.75 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.52 2.147 . . . . 10.0 112.381 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -83.7 133.97 34.78 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.937 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 31.3 mt -105.88 94.72 5.33 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.148 0.499 . . . . 10.0 110.389 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 427' ' ' VAL . . . . . 0.641 HG22 ' HB3' ' A' ' 588' ' ' LEU . 21.8 t -90.24 119.43 37.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.345 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 428' ' ' TYR . . . . . 0.533 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 3.3 m-85 -105.22 177.86 4.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.043 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 8.8 mmm -77.21 -77.62 0.14 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.862 -0.335 . . . . 10.0 111.409 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 41.4 p -86.09 165.65 16.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.972 0.415 . . . . 10.0 111.431 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 431' ' ' GLU . . . . . 0.448 ' O ' HG12 ' A' ' 435' ' ' ILE . 2.9 tp10 -62.44 -40.17 95.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.691 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.62 -39.97 82.01 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.129 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -60.96 -42.03 97.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.272 0.558 . . . . 10.0 109.972 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 434' ' ' LYS . . . . . 0.54 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 28.4 ttpt -65.79 -52.42 50.94 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.369 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 435' ' ' ILE . . . . . 0.602 ' O ' HG12 ' A' ' 439' ' ' ILE . 32.3 mm -61.04 -44.1 97.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.342 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.56 -36.99 74.77 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.72 0.295 . . . . 10.0 110.985 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -71.91 -37.36 70.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.312 179.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 438' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 434' ' ' LYS . 81.1 mt -62.65 -45.59 98.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.155 179.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 439' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 435' ' ' ILE . 37.8 mm -59.89 -39.95 81.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.6 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -65.66 -43.78 88.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.601 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -60.35 -40.75 91.86 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.167 0.508 . . . . 10.0 110.136 179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.414 HG12 HG11 ' A' ' 452' ' ' VAL . 71.9 mt -70.74 -42.48 77.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.724 179.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt -60.07 -42.52 94.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.035 -0.529 . . . . 10.0 111.147 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -73.38 0.79 11.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.159 -0.473 . . . . 10.0 112.202 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 70.3 mtt-85 -117.41 -31.25 5.31 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.855 0.359 . . . . 10.0 110.917 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.19 -28.31 65.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.229 0.538 . . . . 10.0 109.859 179.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -80.82 -3.47 51.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.38 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -108.89 -38.85 5.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.876 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 121.05 18.6 3.8 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.722 -0.752 . . . . 10.0 113.004 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -98.5 125.51 42.68 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 122.541 -0.388 . . . . 10.0 111.081 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -71.12 144.96 48.18 Favored 'Trans proline' 0 C--O 1.236 0.385 0 C-N-CA 122.767 2.311 . . . . 10.0 111.226 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.414 HG11 HG12 ' A' ' 442' ' ' ILE . 84.0 t -125.62 128.04 72.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.978 0.418 . . . . 10.0 111.464 -178.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 58.2 tp -108.46 111.2 22.96 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.182 -0.673 . . . . 10.0 109.182 178.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 47.5 t -94.72 124.42 47.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.523 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -111.3 114.52 3.68 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.839 -0.696 . . . . 10.0 111.898 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 22.8 p -106.17 145.21 31.81 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.712 0.291 . . . . 10.0 110.882 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 23.1 pt -92.71 -2.63 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.781 0.324 . . . . 10.0 111.142 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 59.5 m -149.66 141.48 23.69 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.433 -0.348 . . . . 10.0 110.234 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 17.1 mt -61.69 -34.38 61.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-O 121.111 0.482 . . . . 10.0 110.603 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -56.89 -40.31 75.99 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.539 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.407 ' HG2' ' OE2' ' A' ' 560' ' ' GLU . 0.6 OUTLIER -71.36 -33.53 69.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.475 179.833 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.5 m -62.44 -48.08 81.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.352 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -62.55 -37.78 87.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.203 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 55.8 tp -62.94 -54.85 32.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.482 -0.781 . . . . 10.0 111.341 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.5 p -65.7 -32.65 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 116.621 -0.263 . . . . 10.0 111.632 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 60.0 m -65.68 -37.56 86.82 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.777 0.322 . . . . 10.0 110.644 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -64.41 -48.47 75.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.523 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . 0.519 ' HG3' HG21 ' A' ' 435' ' ' ILE . 20.9 mm-40 -61.91 -41.24 97.68 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.122 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 26.4 mt -60.91 -36.05 78.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.675 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.3 m -70.45 -34.89 72.96 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.11 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 42.5 mtpt -63.98 -37.21 86.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.336 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.48 -16.68 51.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.901 -0.59 . . . . 10.0 111.129 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 81.47 29.02 41.43 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.905 -0.664 . . . . 10.0 112.307 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 60.9 mt -94.64 121.31 45.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 110.263 -0.273 . . . . 10.0 110.263 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -59.16 125.67 24.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.658 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 53.0 p-80 -148.6 151.59 35.29 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.762 -178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -134.8 141.06 46.32 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.4 t -105.81 131.29 55.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.818 0.342 . . . . 10.0 110.836 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.45 HD12 ' HB2' ' A' ' 503' ' ' ALA . 67.8 mt -73.08 105.53 4.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.107 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.89 123.84 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.48 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -82.58 -8.82 59.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.043 -0.526 . . . . 10.0 112.209 -178.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -92.85 -53.09 4.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.174 0.512 . . . . 10.0 110.014 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -102.49 96.61 7.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.37 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' HIS . . . . . 0.425 ' HA ' ' HB3' ' A' ' 487' ' ' GLU . 9.9 m170 -66.6 -15.48 63.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.685 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -57.98 -49.26 77.44 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.032 0.444 . . . . 10.0 110.6 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' ASN . . . . . 0.495 ' O ' HG13 ' A' ' 490' ' ' ILE . 64.8 t30 -72.56 -41.52 65.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.73 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.425 ' HB3' ' HA ' ' A' ' 484' ' ' HIS . 1.7 tt0 -55.36 -57.14 13.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.575 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -57.94 -34.2 69.64 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.571 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -67.88 -41.84 82.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.776 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 486' ' ' ASN . 45.7 mt -69.5 -45.81 77.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.809 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 487' ' ' GLU . 89.8 t -56.22 -38.38 54.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.402 -179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -60.82 -26.47 67.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.238 -0.437 . . . . 10.0 111.743 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -124.3 27.61 6.98 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.818 0.342 . . . . 10.0 110.721 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -73.72 -19.81 60.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.124 0.487 . . . . 10.0 110.943 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -90.58 10.39 74.74 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.669 -0.777 . . . . 10.0 112.023 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -67.26 140.29 95.33 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 110.269 -0.271 . . . . 10.0 110.269 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -51.9 123.91 13.47 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.616 2.211 . . . . 10.0 112.918 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 63.62 39.96 8.37 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.388 -0.824 . . . . 10.0 112.483 178.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -109.03 118.86 37.89 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 37.1 t -97.07 112.81 29.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.029 0.442 . . . . 10.0 110.426 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.8 m -111.91 128.37 56.12 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.41 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 43.4 mt -109.34 124.76 66.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.896 0.379 . . . . 10.0 110.328 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . 0.45 ' HB2' HD12 ' A' ' 479' ' ' LEU . . . -120.45 128.98 53.67 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.865 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 14.4 m -103.86 120.75 41.65 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.578 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 58.49 77.19 0.31 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.368 0.604 . . . . 10.0 110.453 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.56 133.3 34.45 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.449 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -75.67 -178.37 4.15 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.806 -0.633 . . . . 10.0 110.945 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -73.07 164.15 54.93 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.856 -0.688 . . . . 10.0 112.166 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 68.89 -75.44 0.07 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.116 0.567 . . . . 10.0 111.34 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 84.24 143.86 6.05 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.976 -0.631 . . . . 10.0 112.095 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.93 150.73 23.55 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.853 0.359 . . . . 10.0 111.463 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -75.67 95.93 3.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.014 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 71.4 mt -85.47 115.71 27.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.986 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 19.0 t -90.51 140.15 16.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.94 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 61.0 mt -67.91 128.85 38.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.302 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 87.28 9.11 73.59 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.438 -0.665 . . . . 10.0 111.438 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 91.8 -171.7 34.79 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 111.064 -0.814 . . . . 10.0 111.064 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 25.5 p -128.65 110.59 12.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.121 0.46 . . . . 10.0 110.441 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 61.7 p-90 -59.31 -25.32 64.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.568 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -41.63 91.44 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.451 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -73.23 -32.8 64.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.921 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -70.06 -47.49 61.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.194 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.8 m -68.14 -25.5 32.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.937 0.398 . . . . 10.0 110.232 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -80.52 -8.58 59.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.574 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -97.19 10.08 40.42 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.276 0.56 . . . . 10.0 110.645 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 70.8 mt -105.16 141.18 37.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.941 179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 48.8 mp0 -73.99 -33.05 63.68 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.248 0.547 . . . . 10.0 109.769 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -137.96 82.08 26.18 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.547 -0.751 . . . . 10.0 109.692 179.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -78.18 95.01 1.06 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.835 2.357 . . . . 10.0 111.734 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 1.4 p -77.69 160.15 28.66 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.68 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.08 -44.12 70.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 10.0 111.437 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -63.55 -39.95 95.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.437 -0.347 . . . . 10.0 111.238 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -64.71 -42.37 95.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.669 0.271 . . . . 10.0 110.65 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 92.3 mt -59.88 -44.77 95.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.192 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.19 -36.97 69.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.149 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -64.26 -47.63 78.85 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.583 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 87.9 mt -64.04 -40.41 88.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.652 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -60.78 -37.63 82.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.826 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -65.32 -39.83 92.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.725 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.43 -40.02 67.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.013 -0.54 . . . . 10.0 109.978 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 56.8 t90 -57.69 -40.34 79.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.243 -0.89 . . . . 10.0 110.68 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 64.6 tp60 -56.43 -42.74 78.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.497 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.5 -44.67 93.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.451 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 9.4 mtm180 -69.93 -37.49 75.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.8 -0.637 . . . . 10.0 110.525 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 17.6 t-80 -61.26 -51.18 70.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.855 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -68.19 -31.36 70.84 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.639 -0.71 . . . . 10.0 111.312 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -63.67 -36.24 83.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.161 0.505 . . . . 10.0 110.179 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 71.7 t -78.74 -40.1 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.466 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 19.4 tp -59.3 -48.02 83.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.543 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -78.48 2.32 19.38 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.613 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -101.15 -5.06 26.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.808 0.337 . . . . 10.0 110.979 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 116.71 3.31 18.47 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.639 -0.791 . . . . 10.0 112.861 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 75.04 -162.5 53.81 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.993 -0.622 . . . . 10.0 112.632 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 44.3 tp -73.89 120.5 19.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.875 0.369 . . . . 10.0 110.576 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -94.47 123.28 37.79 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.999 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 36.7 mm -103.2 129.63 54.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.264 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 557' ' ' ILE . . . . . 0.4 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 10.7 mt -123.84 118.22 53.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.923 0.392 . . . . 10.0 110.207 178.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.16 118.27 5.81 Favored Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 111.28 -0.728 . . . . 10.0 111.28 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 18.8 p -68.89 -38.83 79.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.144 0.497 . . . . 10.0 110.195 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . 0.407 ' OE2' ' HG2' ' A' ' 461' ' ' LYS . 28.0 mp0 -144.34 158.86 43.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.124 -0.944 . . . . 10.0 109.638 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 561' ' ' ARG . . . . . 0.44 ' H ' HD22 ' A' ' 594' ' ' LEU . 93.0 mtt-85 -104.89 -160.12 0.74 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.62 -0.881 . . . . 10.0 108.62 178.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -152.32 150.92 30.26 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.769 -0.372 . . . . 10.0 110.552 178.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . 0.432 ' H ' ' CD ' ' A' ' 563' ' ' GLU . 1.8 mp0 -51.14 -47.54 62.04 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 123.882 0.739 . . . . 10.0 110.377 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . 0.45 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.7 OUTLIER -69.2 104.45 2.2 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.225 178.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 565' ' ' ARG . . . . . 0.409 ' HB3' ' CG2' ' A' ' 396' ' ' THR . 25.4 tpt180 -69.86 -19.99 63.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.105 -178.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 566' ' ' ARG . . . . . 0.533 ' HG2' ' HB1' ' A' ' 394' ' ' ALA . 16.1 ttm180 -59.01 -40.92 86.43 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.3 0.572 . . . . 10.0 109.771 178.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 48.0 mt -79.09 -36.33 18.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.718 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -56.59 -54.79 41.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.642 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 -61.97 -40.1 94.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.149 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -65.0 -31.55 72.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.816 0.341 . . . . 10.0 110.884 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.41 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 37.2 tp -76.06 -31.28 58.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.136 0.493 . . . . 10.0 110.355 179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 9.6 ttp180 -76.81 -36.4 56.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.66 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.15 36.61 2.37 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 121.071 -0.585 . . . . 10.0 114.137 -178.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 574' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 574' ' ' ARG . 3.2 mmt180 -83.89 -44.02 14.7 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 117.134 0.467 . . . . 10.0 110.095 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 5.9 m -81.76 175.55 10.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.072 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 67.5 45.93 73.87 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.435 -0.888 . . . . 10.0 111.689 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -70.64 118.28 13.24 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.354 -0.239 . . . . 10.0 110.354 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 578' ' ' GLN . . . . . 0.623 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 9.7 tt0 62.45 30.48 17.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.471 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 82.11 51.93 4.25 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.836 -0.62 . . . . 10.0 112.266 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -110.41 -167.62 1.21 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.375 -0.231 . . . . 10.0 110.375 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -87.03 175.44 8.11 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.252 0.549 . . . . 10.0 111.87 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 153.65 164.62 12.83 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.546 -0.752 . . . . 10.0 111.924 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.0 p -148.06 125.41 11.59 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 110.368 -0.234 . . . . 10.0 110.368 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.17 128.08 54.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.527 -0.306 . . . . 10.0 111.169 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 585' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 1.2 ttm180 -138.62 120.61 15.54 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -111.14 155.53 22.74 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.022 0.439 . . . . 10.0 110.61 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 587' ' ' TYR . . . . . 0.54 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 56.6 m-85 -129.27 166.17 19.97 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.852 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 588' ' ' LEU . . . . . 0.641 ' HB3' HG22 ' A' ' 427' ' ' VAL . 15.8 tp -161.69 158.31 25.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.533 -0.303 . . . . 10.0 110.274 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 589' ' ' SER . . . . . 0.448 ' OG ' ' HD3' ' A' ' 434' ' ' LYS . 0.7 OUTLIER -123.34 143.82 49.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.306 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 590' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 92.0 mmm -71.39 -11.64 61.0 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.361 -0.381 . . . . 10.0 111.252 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -108.76 7.64 26.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.538 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -81.66 158.24 24.35 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.341 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -67.38 -30.05 69.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.816 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.44 HD22 ' H ' ' A' ' 561' ' ' ARG . 13.4 tp -66.89 -25.14 66.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.698 0.285 . . . . 10.0 111.53 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 4.1 tpt -74.2 0.65 13.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.128 0.489 . . . . 10.0 111.127 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -94.52 1.07 55.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.269 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 594' ' ' LEU . 41.5 pt -72.99 -7.79 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-O 120.637 0.255 . . . . 10.0 111.664 -179.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -81.07 -7.67 59.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.61 -0.268 . . . . 10.0 110.842 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.4 -64.56 0.38 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.498 0.719 . . . . 10.0 111.196 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 600' ' ' SER . . . . . 0.509 ' HB2' HG23 ' A' ' 603' ' ' VAL . 4.0 m -77.64 116.59 18.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.795 0.331 . . . . 10.0 110.473 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -62.71 -26.04 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.125 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 76.0 mmt-85 -60.45 -29.44 69.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.21 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 603' ' ' VAL . . . . . 0.509 HG23 ' HB2' ' A' ' 600' ' ' SER . 59.9 t -66.68 -51.66 53.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . 0.555 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 0.7 OUTLIER -63.25 -38.05 89.65 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.989 179.063 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -61.48 -38.69 96.2 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.922 -0.581 . . . . 10.0 112.507 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 42.5 tpp -74.29 -33.52 63.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.955 0.407 . . . . 10.0 110.679 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 51.2 mtt -68.68 -17.91 64.17 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.047 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 608' ' ' ARG . . . . . 0.555 ' HG3' ' O ' ' A' ' 604' ' ' SER . 63.7 mtt180 -77.6 -5.46 50.33 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.155 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -91.92 8.46 37.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.986 0.422 . . . . 10.0 110.306 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 25.0 tp -73.15 -16.33 61.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 10.0 111.186 -179.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 98.79 -43.78 1.82 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.981 -0.628 . . . . 10.0 111.671 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 70.62 -54.97 0.64 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.687 0.795 . . . . 10.0 112.596 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 4.6 mmmt 59.64 76.13 0.45 Allowed Pre-proline 0 N--CA 1.463 0.219 0 O-C-N 123.448 0.467 . . . . 10.0 110.485 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 614' ' ' PRO . . . . . 0.533 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 32.3 Cg_exo -58.38 96.95 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.454 2.769 . . . . 10.0 113.064 -178.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 130.17 -13.66 5.72 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.778 -0.725 . . . . 10.0 111.92 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -117.16 142.54 46.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.86 0.362 . . . . 10.0 110.253 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -80.59 107.32 13.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.387 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -66.63 -30.31 49.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.962 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 41.5 74.25 0.11 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.564 0.746 . . . . 10.0 112.68 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 22.6 m170 -117.61 100.37 52.53 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -57.01 -29.28 82.24 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 123.415 2.744 . . . . 10.0 113.982 -178.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 68.3 p-90 -68.79 -20.4 64.33 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.746 -0.382 . . . . 10.0 111.075 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.88 -48.96 73.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.705 -0.48 . . . . 10.0 109.705 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.28 -39.27 82.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.42 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 48.7 mttm -69.68 -36.29 75.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.891 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -65.15 -44.7 87.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.402 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 75.7 mt -64.44 -42.99 96.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.024 -0.534 . . . . 10.0 110.254 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -60.81 -38.63 86.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.482 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -67.47 -39.92 85.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.141 179.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -65.69 -44.11 87.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.652 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -61.45 -42.32 98.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.109 0.481 . . . . 10.0 109.743 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -62.28 -30.38 71.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.632 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 633' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' A' ' 633' ' ' LYS . 66.1 mmtt -64.7 -39.32 93.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.521 179.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 13.3 t -64.52 -43.13 96.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.565 -0.531 . . . . 10.0 109.565 179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.45 ' OE2' ' HA ' ' A' ' 564' ' ' SER . 3.6 mm-40 -65.0 -35.7 82.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.865 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 27.9 m -62.92 -42.95 99.97 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.701 178.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 637' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 637' ' ' ARG . 41.7 ttm180 -63.33 -41.74 98.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.394 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . 0.57 HD21 ' NH2' ' A' ' 642' ' ' ARG . 0.6 OUTLIER -59.01 -43.5 91.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.298 -0.865 . . . . 10.0 110.322 179.189 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -67.76 -39.3 84.18 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.869 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 640' ' ' ASP . . . . . 0.53 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 27.0 t70 -60.06 -35.56 75.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.202 -0.453 . . . . 10.0 110.394 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 66.6 mt -83.29 -36.16 12.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.795 178.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 642' ' ' ARG . . . . . 0.57 ' NH2' HD21 ' A' ' 638' ' ' ASN . 1.7 ttp180 -57.74 -40.47 79.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.419 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 20.2 pttm -69.15 -28.34 66.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.312 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 644' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 16.0 mm100 -66.9 -38.26 85.9 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.908 0.385 . . . . 10.0 110.181 -179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 26.8 mt -66.73 -38.41 86.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.878 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 646' ' ' LEU . . . . . . . . . . . . . 94.9 mt -64.0 -35.02 79.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.589 -0.732 . . . . 10.0 110.698 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -63.73 -19.81 65.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.969 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -100.57 -45.86 5.39 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.323 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -72.1 -28.47 63.32 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.029 0.751 . . . . 10.0 113.029 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -67.16 -22.79 65.75 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.05 0.452 . . . . 10.0 110.554 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 18.7 t -68.88 -48.87 68.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -68.18 -29.52 68.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.437 -0.801 . . . . 10.0 109.579 178.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -60.12 -51.53 69.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.615 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -60.92 -45.83 93.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.769 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -61.32 -42.78 99.24 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.458 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 4.3 ttp-105 -63.39 -42.55 98.82 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.924 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -62.21 -44.35 96.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.592 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -63.73 -48.68 76.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.592 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.7 tp -70.45 -34.64 58.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.599 -0.273 . . . . 10.0 111.547 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -64.98 -44.34 89.64 Favored 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.095 -0.335 . . . . 10.0 110.095 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.0 m -61.62 -41.75 97.91 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.014 -0.539 . . . . 10.0 109.921 179.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -65.05 -46.64 80.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.727 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 23.8 ttt-85 -65.08 -43.62 91.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.724 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -66.61 -35.12 79.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.734 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -62.65 -51.2 68.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.081 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 666' ' ' LEU . . . . . 0.485 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 54.4 mt -65.28 -28.81 69.6 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.227 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 27.9 tp -71.21 -40.76 70.95 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.962 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.8 -41.8 74.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.812 -178.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 33.0 m -82.6 158.7 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.897 0.38 . . . . 10.0 111.223 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 50.8 m -102.97 -34.04 9.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.752 0.31 . . . . 10.0 111.111 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -90.31 117.07 28.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.848 0.356 . . . . 10.0 110.409 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 8.1 p -123.21 -1.01 6.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.656 0.741 . . . . 10.0 109.947 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 673' ' ' SER . . . . . 0.431 ' OG ' ' HD3' ' A' ' 760' ' ' ARG . 0.3 OUTLIER -54.15 -39.09 66.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.868 -1.06 . . . . 10.0 111.846 -179.209 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -59.44 -48.19 82.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.833 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 675' ' ' THR . . . . . 0.404 ' O ' HG12 ' A' ' 679' ' ' ILE . 1.8 m -64.68 -44.27 90.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.664 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 676' ' ' ILE . . . . . . . . . . . . . 44.4 mm -57.72 -48.34 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 115.689 -0.687 . . . . 10.0 111.438 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -66.53 -39.83 88.8 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.605 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 46.3 m -64.42 -46.01 85.09 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.867 0.321 . . . . 10.0 111.867 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 679' ' ' ILE . . . . . 0.54 ' O ' HG23 ' A' ' 683' ' ' VAL . 37.9 pt -71.67 -25.29 24.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 C-N-CA 120.472 -0.491 . . . . 10.0 110.642 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 3.4 ttm-85 -58.55 -39.41 80.16 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.848 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -63.23 -43.76 97.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.667 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -70.56 -36.9 73.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.129 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 683' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 679' ' ' ILE . 69.1 t -59.5 -52.21 63.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 120.928 0.394 . . . . 10.0 110.429 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -63.41 -38.75 92.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.919 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 10.2 tttm -58.02 -52.53 65.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.24 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -61.46 -37.69 84.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.033 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 35.8 m -64.14 -41.58 97.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.543 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 94.2 mt -70.53 -42.44 78.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.241 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -56.3 -30.35 62.4 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.042 0.449 . . . . 10.0 111.725 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -66.33 -25.26 66.74 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.77 0.656 . . . . 10.0 112.77 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -120.86 -24.14 5.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.917 0.389 . . . . 10.0 111.445 -179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 692' ' ' ILE . . . . . 0.574 HG23 ' CD1' ' A' ' 701' ' ' TRP . 71.3 mt -127.65 103.76 21.77 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.4 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -68.58 128.79 17.69 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.027 1.818 . . . . 10.0 111.338 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -54.79 123.03 12.73 Favored 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 122.695 2.263 . . . . 10.0 112.784 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 61.55 78.76 0.28 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.251 -0.886 . . . . 10.0 111.406 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 17.5 p -145.93 -167.72 2.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.134 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 79.4 mt -85.65 152.54 23.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.64 0.257 . . . . 10.0 110.51 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -58.73 -31.49 68.35 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.741 -179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -76.63 -3.42 37.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.591 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.45 3.63 35.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.055 0.455 . . . . 10.0 110.238 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 701' ' ' TRP . . . . . 0.574 ' CD1' HG23 ' A' ' 692' ' ' ILE . 34.2 m0 -100.9 107.78 19.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.939 -179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -82.34 82.48 7.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.207 0.527 . . . . 10.0 109.582 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 703' ' ' ILE . . . . . 0.557 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 46.8 mm -58.6 -50.82 85.95 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.443 -0.799 . . . . 10.0 111.65 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 704' ' ' PRO . . . . . 0.557 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.2 Cg_exo -57.23 -42.94 57.47 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 121.91 1.74 . . . . 10.0 112.078 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -60.45 -42.96 99.21 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.128 -0.558 . . . . 10.0 111.993 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 47.5 tp -67.73 -39.95 84.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.97 0.414 . . . . 10.0 110.135 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -64.37 -49.29 72.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.482 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -58.29 -35.92 72.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.005 0.431 . . . . 10.0 110.26 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -66.35 -52.36 47.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.673 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 93.8 mt -65.69 -38.66 89.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.218 -0.446 . . . . 10.0 111.751 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 8.8 mtpp -78.33 0.02 27.13 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.847 0.684 . . . . 10.0 112.847 -178.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -127.33 -53.58 1.37 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.846 0.355 . . . . 10.0 111.69 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 713' ' ' ASP . . . . . 0.561 ' O ' ' HE2' ' A' ' 828' ' ' LYS . 0.9 OUTLIER -76.15 -39.08 55.82 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.591 -178.461 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -100.6 -14.67 18.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.607 0.225 . . . . 10.0 111.607 -179.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 61.48 33.06 18.72 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.337 0.589 . . . . 10.0 110.678 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 49.3 tp -115.45 114.09 24.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.593 -0.73 . . . . 10.0 110.171 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -83.53 115.43 22.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.881 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 50.2 mt -133.14 129.52 20.96 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.121 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -86.04 61.6 5.01 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 123.116 2.544 . . . . 10.0 112.035 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 31.3 mt -60.62 -36.95 73.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.274 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -62.69 -30.86 71.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.455 . . . . 10.0 110.972 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.12 -39.31 29.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.157 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 34.0 m0 -61.06 -48.36 82.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.155 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 55.2 tp -69.0 -20.02 64.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.682 -179.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -87.61 -46.01 9.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.762 0.315 . . . . 10.0 111.384 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -81.86 -31.69 31.44 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.464 -0.334 . . . . 10.0 111.698 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -123.16 76.59 51.68 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 116.622 -0.263 . . . . 10.0 110.959 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.5 -18.87 60.54 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.38 2.053 . . . . 10.0 111.784 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.09 -15.95 63.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.629 -0.714 . . . . 10.0 111.301 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 67.3 mt -66.43 -23.35 66.28 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.766 0.317 . . . . 10.0 110.456 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 57.19 -101.98 0.14 Allowed 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 115.528 -0.76 . . . . 10.0 111.303 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -144.8 -47.02 0.24 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.022 0.439 . . . . 10.0 109.907 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -59.5 -51.07 71.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.118 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 3.1 m -62.69 -31.69 72.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.126 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 8.3 mt -60.74 -42.01 96.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.898 0.38 . . . . 10.0 110.198 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -62.69 -43.44 98.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.707 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -62.07 -39.28 91.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.35 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 27.4 mmm-85 -64.48 -46.41 83.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.317 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 90.2 mt -61.94 -43.47 97.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.278 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 54.1 tp -61.5 -52.67 63.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.912 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -58.8 -41.03 85.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.124 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -62.7 -40.75 98.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.967 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 24.3 p -64.46 -30.13 71.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.903 0.382 . . . . 10.0 110.453 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 744' ' ' ILE . . . . . 0.446 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 78.1 mt -73.28 -47.95 44.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 10.0 109.898 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.21 -49.24 78.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.105 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 76.1 t -60.89 -38.12 78.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.064 0.459 . . . . 10.0 110.401 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -65.5 -42.94 91.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.041 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 748' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 27.0 mt-30 -63.02 -37.36 86.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.367 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 -59.59 -34.97 73.41 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.355 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -76.75 -36.83 56.84 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -61.4 -35.64 78.06 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.016 -0.993 . . . . 10.0 110.921 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -68.88 -14.6 63.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.759 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.47 -37.57 5.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.754 0.312 . . . . 10.0 111.639 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.7 t -84.15 -42.75 17.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.864 0.364 . . . . 10.0 111.364 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 126.07 130.69 3.46 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.905 -0.878 . . . . 10.0 110.905 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 756' ' ' ALA . . . . . 0.601 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -56.35 -54.22 48.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.749 0.309 . . . . 10.0 111.603 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -64.1 -38.1 89.82 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.089 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 14.3 tpt -64.86 -43.85 91.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.318 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 70.0 mmm -60.26 -43.97 95.7 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 116.06 -0.518 . . . . 10.0 111.151 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.601 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 15.6 mmp_? -55.23 -41.78 72.52 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.244 0.545 . . . . 10.0 111.06 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -72.97 -35.2 66.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.265 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -66.84 -45.24 78.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.273 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 760' ' ' ARG . 61.8 mt-10 -58.15 -47.07 84.47 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.641 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 764' ' ' LYS . . . . . 0.485 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 83.0 tttt -61.52 -45.72 92.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.785 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -59.88 -48.31 86.72 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.01 -0.614 . . . . 10.0 111.992 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 55.8 t -63.05 -44.63 99.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.617 0.246 . . . . 10.0 110.879 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 21.4 ttt -60.11 -47.91 83.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.813 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 48.0 mt -63.04 -43.01 99.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.644 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -60.39 -48.27 82.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.926 0.393 . . . . 10.0 110.538 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 11.9 m -62.43 -44.17 97.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.735 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 4.4 tt -61.35 -47.33 86.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.833 -0.621 . . . . 10.0 110.622 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 772' ' ' ASP . . . . . 0.578 ' O ' ' HG3' ' A' ' 776' ' ' LYS . 1.9 t70 -62.03 -47.39 84.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.091 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 29.6 m -59.15 -48.06 82.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.424 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 74.5 mt -65.91 -30.35 70.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.979 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -65.48 -40.88 93.64 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.578 ' HG3' ' O ' ' A' ' 772' ' ' ASP . 51.5 mttm -63.01 -39.14 93.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.913 -0.585 . . . . 10.0 109.767 178.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 777' ' ' GLU . . . . . 0.582 ' HB2' ' HB2' ' B' ' 19' ' ' ALA . 1.3 tp10 -64.73 -42.96 94.84 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.416 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 778' ' ' HIS . . . . . 0.492 ' O ' ' HG2' ' A' ' 782' ' ' MET . 47.1 t60 -63.49 -41.02 98.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.371 -0.831 . . . . 10.0 110.575 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 39.5 mt -56.26 -50.59 70.9 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 123.335 0.397 . . . . 10.0 110.421 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -65.62 -44.04 87.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.78 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.33 -35.2 73.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.671 -179.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 782' ' ' MET . . . . . 0.492 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 91.6 mmm -61.0 -41.98 97.56 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.909 0.385 . . . . 10.0 110.929 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -75.49 -33.35 60.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.583 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 20.9 m-30 -60.86 -39.26 88.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.932 0.396 . . . . 10.0 110.257 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.1 tp -76.23 -32.16 58.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.576 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -65.63 -38.96 90.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.304 -0.862 . . . . 10.0 110.617 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -65.7 -48.5 71.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.529 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -82.93 25.34 4.74 Favored Glycine 0 CA--C 1.518 0.258 0 CA-C-N 115.849 -0.614 . . . . 10.0 113.539 -178.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 10.2 tp -64.0 -18.13 21.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.996 0.427 . . . . 10.0 110.779 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -61.98 -29.86 70.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.855 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 99.3 mt -94.94 -12.39 26.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.413 -179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -94.57 -35.85 12.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.856 0.36 . . . . 10.0 110.859 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -91.87 75.62 1.42 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.579 -0.82 . . . . 10.0 112.781 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -84.54 -172.39 4.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.718 0.294 . . . . 10.0 110.614 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -70.22 150.03 46.87 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.691 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 65.12 22.58 12.31 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.612 -0.722 . . . . 10.0 111.665 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -148.14 133.09 18.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.432 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 798' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 799' ' ' PRO . 19.5 t70 -76.46 120.95 83.9 Favored Pre-proline 0 C--N 1.327 -0.402 0 N-CA-C 109.964 -0.384 . . . . 10.0 109.964 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 799' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 798' ' ' ASP . 35.9 Cg_exo -58.44 -30.12 90.52 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.049 2.499 . . . . 10.0 113.533 -179.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 800' ' ' LYS . . . . . 0.547 ' HB2' ' HZ2' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -78.64 -47.06 17.8 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.859 -0.336 . . . . 10.0 110.354 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 -61.92 -40.89 97.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.545 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -64.09 -43.73 94.49 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 92.0 t80 -60.6 -43.34 97.52 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.219 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -58.3 -50.85 72.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.847 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -59.29 -45.9 90.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.864 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.2 -41.8 93.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.531 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 26.7 m -65.51 -34.76 79.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.904 -0.589 . . . . 10.0 111.146 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 21.6 m-30 -65.81 -43.2 89.35 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.975 0.417 . . . . 10.0 110.042 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 32.2 m -65.93 -36.34 83.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.428 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 29.2 ttm -65.49 -37.59 87.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.25 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -67.98 -43.04 79.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.21 179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 812' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 816' ' ' GLU . . . -59.47 -49.14 78.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.965 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.89 -32.33 73.57 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.941 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 29.5 ttp -65.82 -44.55 85.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.008 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 98.4 mt -65.53 -36.48 83.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.511 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 816' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 812' ' ' ALA . 18.0 mm-40 -63.37 -42.03 98.85 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.299 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 12.8 m -74.09 -29.82 62.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.523 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 50.6 tp -60.46 -58.47 8.36 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.757 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 40.4 pttt -60.73 -32.63 71.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.541 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -64.57 -59.01 4.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.645 -0.707 . . . . 10.0 111.322 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -60.87 -39.74 90.36 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.339 0.496 . . . . 10.0 112.339 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 54.7 t -57.66 -50.24 78.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.841 0.353 . . . . 10.0 110.66 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.1 -38.72 72.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.904 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 38.6 m -61.93 -40.1 94.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.626 0.25 . . . . 10.0 110.615 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 74.7 m -63.94 -41.26 97.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.709 0.29 . . . . 10.0 110.769 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 87.7 mt -69.76 -19.63 63.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.235 0.54 . . . . 10.0 110.871 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 16.9 m -92.42 -36.82 12.91 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.753 179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 828' ' ' LYS . . . . . 0.561 ' HE2' ' O ' ' A' ' 713' ' ' ASP . 44.1 mttm -69.66 -28.99 66.34 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.266 -0.425 . . . . 10.0 111.966 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 5.7 p -66.82 108.15 1.04 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.688 0.756 . . . . 10.0 109.908 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -98.73 99.88 11.03 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.75 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 21.7 t -79.72 133.95 28.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.581 -0.736 . . . . 10.0 109.991 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 832' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 832' ' ' ARG . 7.0 ptt-85 -71.82 98.35 1.97 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.371 0.605 . . . . 10.0 110.356 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 15.2 ptp -91.63 140.12 25.13 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.64 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -64.87 158.68 49.85 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.334 2.023 . . . . 10.0 111.426 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 -51.96 113.7 1.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.778 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.601 -0.714 . . . . 10.0 110.224 -179.587 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 22.0 ttt . . . . . 0 N--CA 1.479 0.976 0 N-CA-C 110.108 -0.33 . . . . 10.0 110.108 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 26.0 ttp -62.34 140.9 58.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.478 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.0 mt -82.23 86.56 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 120.906 0.384 . . . . 10.0 110.281 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -64.41 135.02 55.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.893 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 35.0 tp -76.17 131.95 39.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.704 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.414 ' H ' ' HG2' ' B' ' 6' ' ' ARG . 18.3 ptt-85 -79.35 62.91 3.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.319 0.58 . . . . 10.0 111.291 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 40.7 tttp -80.68 78.26 7.45 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.843 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' B' ' 8' ' ' ARG . 3.0 mmp_? -122.03 5.45 9.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.31 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -120.45 125.53 48.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.204 179.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -147.11 106.67 3.93 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.032 0.444 . . . . 10.0 110.347 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.0 tp -130.21 86.01 55.29 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.497 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -75.16 -2.67 12.85 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.961 2.441 . . . . 10.0 112.17 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 77.4 mt -83.2 6.34 19.73 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.501 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.26 -41.26 96.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.028 0.442 . . . . 10.0 110.269 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.469 ' HB ' ' OE1' ' A' ' 777' ' ' GLU . 4.0 m -82.71 -26.74 8.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.622 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.05 -32.29 69.62 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.326 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 48.2 t -75.61 -27.2 18.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.067 0.46 . . . . 10.0 110.297 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.08 -41.4 25.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.332 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.582 ' HB2' ' HB2' ' A' ' 777' ' ' GLU . . . -76.46 -41.15 48.35 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.928 179.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -82.33 40.58 2.72 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.783 -0.644 . . . . 10.0 113.349 -178.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.528 HG13 ' OD1' ' A' ' 367' ' ' ASN . 3.1 t -76.04 -20.47 15.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.357 0.599 . . . . 10.0 109.823 179.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.487 ' HB2' HD13 ' A' ' 372' ' ' LEU . 9.2 ttt -106.76 23.49 14.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.855 -0.612 . . . . 10.0 111.105 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -71.83 137.24 47.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.844 0.354 . . . . 10.0 110.685 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -73.44 85.63 1.51 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.194 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -158.99 138.48 11.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.687 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -137.14 155.26 49.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.841 0.353 . . . . 10.0 111.357 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -139.27 -10.55 1.26 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.388 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.533 -0.746 . . . . 10.0 110.547 179.856 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.478 0.957 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -99.39 139.45 35.02 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.96 0.409 . . . . 10.0 110.635 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 130.38 178.84 15.64 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.903 -0.665 . . . . 10.0 111.972 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.2 m -68.64 116.58 9.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.801 0.334 . . . . 10.0 110.181 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.53 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 17.3 mmt180 -67.54 155.16 39.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.042 -0.527 . . . . 10.0 111.345 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.3 m120 73.65 -49.56 0.69 Allowed 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.264 -0.88 . . . . 10.0 112.318 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -90.53 -71.26 0.63 Allowed 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.824 0.675 . . . . 10.0 112.824 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -65.2 -18.25 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 -177.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.51 -52.74 64.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.684 0.278 . . . . 10.0 111.159 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.7 mt -67.06 -33.4 75.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.147 -0.478 . . . . 10.0 110.946 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 19' ' ' ARG . 12.4 ttp-105 -66.78 -45.05 79.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.384 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.54 -28.41 64.9 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.129 0.49 . . . . 10.0 109.996 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.554 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 45.3 mtt -76.22 -36.23 58.66 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.842 179.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -60.97 -35.64 77.31 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -60.37 -38.0 82.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.432 -0.803 . . . . 10.0 109.532 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.8 t -77.1 -35.36 22.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.848 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.9 t -58.13 -36.16 55.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.95 178.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.5 -37.44 87.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.635 -0.711 . . . . 10.0 109.729 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.3 mt -68.3 -44.0 84.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.716 -0.674 . . . . 10.0 109.704 179.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 77.6 mt -59.78 -40.57 82.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.774 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -63.64 -38.42 91.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.377 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.56 -28.32 65.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.006 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 53.4 mtt -84.11 -17.53 39.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.138 -0.483 . . . . 10.0 111.61 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.509 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 17.9 tt0 -57.46 -54.62 53.11 Favored Pre-proline 0 CA--C 1.539 0.536 0 CA-C-O 119.271 -0.395 . . . . 10.0 111.646 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.509 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 38.2 Cg_exo -61.05 -28.25 85.74 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.755 1.637 . . . . 10.0 111.516 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -69.51 -43.99 71.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.613 -0.722 . . . . 10.0 109.924 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 25.9 mmt -69.37 -29.03 66.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.355 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -62.68 -27.24 69.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.768 179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -79.97 -16.45 55.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.709 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp -84.01 147.8 27.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.301 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 p -76.6 165.56 24.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.103 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.54 -43.17 84.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.865 0.364 . . . . 10.0 111.449 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -68.59 -28.08 66.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.922 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -69.79 -33.09 71.9 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.669 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.5 mt -61.94 -40.38 95.32 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -67.23 -32.4 73.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.14 -0.936 . . . . 10.0 109.552 178.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.97 -35.99 92.84 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.474 -0.785 . . . . 10.0 111.687 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -65.6 -37.3 86.23 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 28.1 m -61.38 -47.35 86.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.282 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.82 -30.02 70.1 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.236 0.541 . . . . 10.0 110.144 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -66.26 -45.66 79.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.441 -0.799 . . . . 10.0 110.564 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -59.64 -37.95 80.07 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 121.048 0.452 . . . . 10.0 110.252 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -57.95 -41.74 83.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.521 -0.763 . . . . 10.0 110.729 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.16 -41.47 61.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.994 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -60.48 -36.37 78.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.35 -179.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.39 -38.13 89.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.771 0.319 . . . . 10.0 111.035 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -70.37 -28.12 64.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.421 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -69.16 -33.57 73.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.368 179.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 132.19 16.77 1.34 Allowed Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.532 -0.842 . . . . 10.0 113.069 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -77.3 149.55 35.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.926 0.393 . . . . 10.0 110.145 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 20.1 t -86.86 131.82 33.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.19 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.541 HD11 ' O ' ' A' ' 118' ' ' LEU . 18.8 tp -58.8 -39.87 82.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.135 0.493 . . . . 10.0 110.864 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.408 ' HG3' ' ND2' ' A' ' 95' ' ' ASN . 14.6 mp0 -68.0 -10.49 54.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.39 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -97.91 -13.52 21.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.301 0.572 . . . . 10.0 110.112 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.5 mt -91.6 -7.06 51.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.887 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.509 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 75.2 mt -49.99 -51.52 60.84 Favored Pre-proline 0 CA--C 1.541 0.622 0 N-CA-C 113.192 0.812 . . . . 10.0 113.192 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.509 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 62.2 Cg_exo -52.08 -51.17 11.73 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 122.085 1.856 . . . . 10.0 113.209 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -71.25 -42.75 68.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.65 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.427 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -61.05 -49.72 76.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.806 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -63.84 -35.2 79.86 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.321 -0.399 . . . . 10.0 111.025 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.28 -45.58 90.79 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 120.872 0.367 . . . . 10.0 110.494 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 70.1 t -61.74 -47.14 94.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.469 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 67' ' ' ALA . 63.4 t -61.73 -41.97 92.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.955 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.458 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 7.0 ttm180 -59.43 -49.36 78.09 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.927 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.45 ' HA ' ' OE1' ' A' ' 73' ' ' GLU . 35.1 tp10 -65.83 -40.21 91.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.917 0.389 . . . . 10.0 110.39 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.71 -32.46 71.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.136 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 17.2 m -68.27 -33.5 74.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.416 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.1 mtmm -72.35 -24.07 61.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.25 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 67.7 mtt180 -97.16 -50.35 4.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.049 0.388 . . . . 10.0 112.049 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 96.8 t -67.5 -61.52 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.713 0.292 . . . . 10.0 111.24 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -82.75 -59.62 2.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.849 0.357 . . . . 10.0 110.937 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 131.08 -27.95 3.74 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 111.535 -0.626 . . . . 10.0 111.535 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -90.69 138.4 31.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.897 0.379 . . . . 10.0 110.594 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 82' ' ' ARG . 12.4 ttp180 -80.86 139.69 35.8 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.596 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.27 109.0 2.93 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -53.35 147.03 11.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.799 -0.637 . . . . 10.0 111.967 -178.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -61.07 -35.54 77.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.318 -0.855 . . . . 10.0 111.165 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.2 m -65.62 -28.94 45.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.83 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -75.02 -30.56 61.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.22 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.5 mt -63.31 -36.26 83.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.235 -0.439 . . . . 10.0 109.866 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.433 ' O ' HG23 ' A' ' 93' ' ' VAL . 48.9 mt -64.98 -47.94 75.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.83 179.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -64.75 -39.36 96.59 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.908 -0.663 . . . . 10.0 111.961 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.9 -35.2 91.7 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.021 -0.609 . . . . 10.0 112.301 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.554 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 18.5 ttm -71.03 -34.47 71.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.04 0.447 . . . . 10.0 110.008 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 89' ' ' LEU . 68.7 t -67.56 -37.04 78.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.505 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.35 6.28 2.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.533 -0.758 . . . . 10.0 112.915 -178.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.408 ' ND2' ' HG3' ' A' ' 61' ' ' GLU . 50.0 t30 -88.82 -20.75 24.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.301 0.572 . . . . 10.0 109.882 178.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -117.31 -176.95 3.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.405 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.579 ' HA ' ' O ' ' A' ' 387' ' ' LEU . 6.7 ttt85 -76.36 74.95 3.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.121 0.486 . . . . 10.0 111.037 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -142.81 154.66 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.268 -0.423 . . . . 10.0 111.235 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.535 HD12 HG11 ' A' ' 211' ' ' VAL . 36.3 mm -108.61 124.2 64.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.013 -0.736 . . . . 10.0 109.013 178.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -100.75 111.54 23.79 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.744 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.43 125.39 29.88 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.914 -0.772 . . . . 10.0 108.914 178.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 47.9 ttm -130.56 147.6 52.26 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.006 0.431 . . . . 10.0 110.793 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.527 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 13.0 mmm180 -76.59 153.93 34.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.964 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.32 99.25 1.91 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.022 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 139.42 -23.78 2.82 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.471 -0.871 . . . . 10.0 112.839 179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -68.78 -20.48 64.35 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.932 0.396 . . . . 10.0 111.073 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.16 70.48 1.32 Allowed Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 121.039 -0.6 . . . . 10.0 113.065 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.3 ptmm? -68.34 -32.79 73.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.79 0.329 . . . . 10.0 110.974 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.3 -36.02 80.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 10.0 111.192 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 24.2 tp -78.07 -18.32 55.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.212 0.529 . . . . 10.0 110.474 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 60.2 m -82.11 -29.43 31.71 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.365 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -63.44 -23.89 67.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.563 -0.744 . . . . 10.0 112.205 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.18 -23.92 66.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.234 0.457 . . . . 10.0 112.234 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 58.3 mt -70.65 -59.26 3.89 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.156 0.428 . . . . 10.0 112.156 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.36 -28.25 63.15 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.929 1.752 . . . . 10.0 111.883 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -65.72 -50.19 65.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.459 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.442 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 63.0 t80 -60.87 -45.89 92.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.026 0.441 . . . . 10.0 110.504 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.541 ' O ' HD11 ' A' ' 60' ' ' LEU . 23.9 tp -59.47 -54.61 44.61 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.596 -0.729 . . . . 10.0 111.865 -179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -70.5 -20.54 62.83 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.413 0.523 . . . . 10.0 112.413 -178.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.549 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -71.9 -29.79 64.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.729 0.3 . . . . 10.0 110.763 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 65.4 mt -56.8 -25.53 55.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.791 -179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 73.1 p -69.22 -25.15 64.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.887 0.375 . . . . 10.0 111.35 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 82.15 -1.13 87.81 Favored Glycine 0 CA--C 1.519 0.318 0 C-N-CA 121.019 -0.61 . . . . 10.0 112.624 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -74.13 -33.95 63.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.92 0.39 . . . . 10.0 110.813 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 115.8 131.57 4.91 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.493 -0.86 . . . . 10.0 113.341 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 73.9 t -106.22 112.96 41.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.418 -0.586 . . . . 10.0 109.418 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -94.13 105.41 17.41 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.887 0.375 . . . . 10.0 110.481 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 55.4 t -91.73 116.91 33.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.165 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 82.8 t -98.11 112.54 30.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.323 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.27 158.47 15.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.528 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 16.0 m -66.74 -24.11 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -154.81 170.69 21.04 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.965 -0.383 . . . . 10.0 109.965 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -78.54 -24.24 45.77 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.177 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -62.49 -55.04 31.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.956 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.9 mt -71.11 -29.25 65.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.558 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.67 -53.53 56.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.782 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.21 -30.09 64.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.459 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -63.55 -54.74 31.41 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.296 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . 0.464 ' HA ' ' HB3' ' A' ' 142' ' ' ASN . 0.5 OUTLIER -75.87 -20.02 58.41 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.711 -0.396 . . . . 10.0 112.034 -178.402 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.65 -35.74 81.54 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -84.47 -27.94 27.13 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.189 -0.914 . . . . 10.0 110.05 178.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . 0.464 ' HB3' ' HA ' ' A' ' 139' ' ' ASP . 38.8 t30 -67.82 -47.57 68.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.093 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -86.48 -4.92 59.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.541 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.503 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 56.1 ttm-85 -58.82 -49.86 91.14 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.549 0.574 . . . . 10.0 112.549 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' PRO . . . . . 0.503 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 27.6 Cg_exo -63.6 -7.3 12.35 Favored 'Trans proline' 0 C--N 1.36 1.171 0 C-N-CA 122.32 2.013 . . . . 10.0 113.031 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 19.8 tp -100.35 -50.14 4.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.948 0.404 . . . . 10.0 110.346 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -65.83 -50.6 64.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.667 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -67.12 -21.15 65.86 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.885 0.374 . . . . 10.0 111.119 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -69.4 -34.63 74.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.312 0.577 . . . . 10.0 109.613 178.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.415 HD13 ' CE1' ' A' ' 117' ' ' TYR . 39.5 mt -89.26 -22.65 22.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.262 -0.881 . . . . 10.0 110.72 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 119.7 4.44 11.74 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.21 -0.995 . . . . 10.0 113.831 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 36.6 mt -88.86 134.15 34.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.949 0.375 . . . . 10.0 110.135 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 7.0 p -83.4 128.1 34.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.388 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.464 HG21 ' HA ' ' A' ' 144' ' ' ARG . 4.8 t -104.52 111.87 35.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.858 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -107.91 145.03 16.18 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 111.647 -0.581 . . . . 10.0 111.647 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.4 tp -122.08 127.36 75.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 120.798 0.332 . . . . 10.0 110.153 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -112.21 115.08 28.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.122 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 92.2 mt -107.97 148.29 37.14 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.31 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' PRO . . . . . 0.501 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 19.2 Cg_endo -58.91 112.46 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 122.71 2.273 . . . . 10.0 112.691 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.75 -1.53 48.74 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.689 -0.767 . . . . 10.0 112.927 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . 0.516 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 49.9 ttm -59.2 138.31 88.31 Favored Pre-proline 0 C--N 1.326 -0.424 0 C-N-CA 122.195 0.198 . . . . 10.0 110.745 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_exo -53.68 144.42 53.49 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.812 2.341 . . . . 10.0 112.654 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . 0.468 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.18 -49.08 86.7 Favored Pre-proline 0 CA--C 1.54 0.584 0 N-CA-C 113.202 0.816 . . . . 10.0 113.202 -179.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 31.9 Cg_exo -60.38 -32.78 94.38 Favored 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 121.771 1.647 . . . . 10.0 112.26 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -74.13 -37.85 63.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.577 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.516 ' HE2' ' O ' ' A' ' 161' ' ' MET . 60.6 mttm -60.49 -40.5 91.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.708 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -64.23 -27.97 69.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.116 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -78.12 -18.92 55.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.971 0.415 . . . . 10.0 110.779 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -96.27 -39.64 9.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.932 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -73.08 -27.02 61.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.327 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . 0.47 ' HA ' ' NE ' ' A' ' 201' ' ' ARG . . . -82.99 -3.23 56.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.959 0.409 . . . . 10.0 110.784 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -80.25 169.64 17.5 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.408 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . 0.549 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 11.9 m-20 -64.9 -47.25 78.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.199 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.8 mp -124.04 130.33 73.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.142 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.7 m -118.49 112.19 19.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.853 0.359 . . . . 10.0 111.16 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -88.73 137.54 32.23 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.492 -0.558 . . . . 10.0 109.492 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -174.63 174.88 46.8 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.219 -0.991 . . . . 10.0 112.898 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.59 149.06 21.86 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.608 0.242 . . . . 10.0 110.777 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -58.4 -38.02 76.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.729 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -59.19 -52.26 66.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.364 -179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.501 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.5 tp10 -68.18 -38.02 81.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.836 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -57.99 -37.59 74.54 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.99 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -73.54 -43.35 37.23 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.929 -0.653 . . . . 10.0 111.848 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -65.51 -38.84 90.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.695 0.283 . . . . 10.0 110.628 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . 0.449 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 20.2 m-20 -60.54 -44.13 96.44 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.008 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -61.94 -39.97 93.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.568 -0.742 . . . . 10.0 110.449 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 75.8 mt -66.98 -44.1 81.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.509 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 56.9 mtm-85 -63.81 -41.69 97.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.781 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' ASP . . . . . 0.427 ' OD1' HG22 ' A' ' 199' ' ' VAL . 0.4 OUTLIER -64.44 -31.22 72.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.267 0.556 . . . . 10.0 110.88 179.732 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -80.1 -14.87 58.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.163 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 35.6 mtp -103.66 17.08 24.87 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.963 0.411 . . . . 10.0 111.099 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -80.35 162.24 24.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.333 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -104.13 -25.12 13.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.342 0.592 . . . . 10.0 109.927 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -128.6 139.3 35.18 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.56 -0.746 . . . . 10.0 109.357 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.58 -22.7 73.35 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.528 2.152 . . . . 10.0 111.983 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 48.0 mp0 -71.83 -15.88 62.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.14 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -84.61 -17.78 37.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.272 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 24.6 mtt85 -55.36 137.85 47.0 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 123.481 0.488 . . . . 10.0 111.53 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 199' ' ' VAL . . . . . 0.427 HG22 ' OD1' ' A' ' 189' ' ' ASP . 22.6 m -110.15 -20.38 6.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.998 -0.547 . . . . 10.0 111.287 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -90.74 -175.09 4.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.339 0.59 . . . . 10.0 111.552 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' ARG . . . . . 0.47 ' NE ' ' HA ' ' A' ' 171' ' ' ALA . 11.2 mtm180 -140.29 -174.41 3.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.611 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 26.5 mttm -55.61 137.83 48.24 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.239 0.542 . . . . 10.0 111.804 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 18.5 mt -86.37 66.65 9.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.619 -0.719 . . . . 10.0 109.692 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -74.68 -72.7 0.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.661 -0.7 . . . . 10.0 112.235 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' A' ' 386' ' ' LYS . 29.1 t80 -122.33 135.91 54.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.008 0.432 . . . . 10.0 111.778 -177.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.49 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -128.07 123.74 35.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.369 -0.832 . . . . 10.0 109.499 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 64.4 tp -119.83 110.52 16.86 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.334 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -100.54 130.62 49.52 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.355 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -58.47 -65.38 0.66 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.798 -0.637 . . . . 10.0 111.984 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' GLU . . . . . 0.469 ' OE2' ' HA ' ' A' ' 391' ' ' THR . 17.6 tp10 -112.75 110.39 20.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.006 0.432 . . . . 10.0 110.482 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.535 HG11 HD12 ' A' ' 99' ' ' ILE . 28.4 m -82.91 -18.83 10.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.237 -0.438 . . . . 10.0 112.083 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . 0.483 ' OD1' ' HD2' ' A' ' 566' ' ' ARG . 7.2 t70 -51.87 -72.22 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -85.23 19.24 2.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.749 0.648 . . . . 10.0 112.749 -177.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' ILE . . . . . 0.4 ' O ' ' HB2' ' A' ' 218' ' ' GLU . 36.3 mt -125.04 -50.52 2.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.624 -0.431 . . . . 10.0 112.002 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 18.8 mt -82.7 -30.31 29.25 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 35.0 mm -98.43 -50.99 10.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.785 -0.366 . . . . 10.0 111.466 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.56 -46.54 72.42 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.02 0.378 . . . . 10.0 112.02 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 218' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 214' ' ' ILE . 5.8 mm-40 -95.89 31.97 1.99 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.687 0.28 . . . . 10.0 111.602 -178.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 378' ' ' GLN . . . -72.91 -51.94 16.61 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.826 0.346 . . . . 10.0 111.789 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 220' ' ' ARG . . . . . 0.474 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -93.8 22.06 5.95 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -178.085 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 4.1 m -88.74 108.99 26.46 Favored Pre-proline 0 C--N 1.323 -0.547 0 N-CA-C 109.94 -0.392 . . . . 10.0 109.94 178.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 222' ' ' PRO . . . . . 0.474 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 87.0 Cg_endo -93.47 134.16 0.98 Allowed 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.054 2.503 . . . . 10.0 113.789 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 223' ' ' LEU . . . . . 0.582 ' O ' ' HA ' ' A' ' 374' ' ' SER . 86.5 mt -94.04 110.46 22.15 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.875 -0.787 . . . . 10.0 108.875 178.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.414 HG12 ' OG ' ' A' ' 374' ' ' SER . 22.1 mt -105.72 125.59 61.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 120.809 0.338 . . . . 10.0 111.32 -179.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 54.0 mt -82.17 110.6 17.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.88 101.79 0.88 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.286 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -120.67 93.41 0.53 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.017 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -73.97 81.13 1.99 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.764 2.31 . . . . 10.0 112.218 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -145.02 109.34 4.87 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.397 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . 0.401 ' HG2' ' H ' ' A' ' 231' ' ' ASP . 15.5 tt0 -167.72 165.43 14.22 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 231' ' ' ASP . . . . . 0.481 ' HB3' HG13 ' B' ' 17' ' ' VAL . 2.7 t0 -123.44 56.81 1.18 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.538 0.685 . . . . 10.0 109.909 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -18.65 57.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.297 -0.865 . . . . 10.0 110.758 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -31.24 64.18 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.255 -0.884 . . . . 10.0 111.881 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -107.83 -41.14 5.07 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 121.119 -0.232 . . . . 10.0 111.017 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 235' ' ' MET . . . . . 0.669 ' HB2' HG11 ' B' ' 17' ' ' VAL . 22.9 tpp -54.73 -56.49 18.68 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -73.36 -31.1 63.74 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.956 0.354 . . . . 10.0 111.956 -178.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -70.1 -39.57 75.43 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.567 -0.288 . . . . 10.0 111.19 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 11.6 tpp180 -69.95 -45.51 67.3 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.856 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 11.1 p -66.84 -33.49 63.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.752 0.31 . . . . 10.0 111.742 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 240' ' ' ASN . . . . . 0.411 ' ND2' ' HA ' ' A' ' 360' ' ' LYS . 66.7 t30 -90.06 15.96 9.22 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.151 0.5 . . . . 10.0 110.893 -179.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.68 -7.87 23.42 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.018 0.437 . . . . 10.0 110.537 179.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 10.5 tp -101.76 -27.33 3.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.938 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 243' ' ' ILE . . . . . 0.423 ' HB ' ' HD3' ' A' ' 244' ' ' PRO . 42.6 mt -62.56 -47.65 88.0 Favored Pre-proline 0 CA--C 1.539 0.524 0 N-CA-C 112.254 0.464 . . . . 10.0 112.254 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 244' ' ' PRO . . . . . 0.423 ' HD3' ' HB ' ' A' ' 243' ' ' ILE . 9.4 Cg_exo -73.6 32.54 0.32 Allowed 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 122.284 1.99 . . . . 10.0 112.655 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 245' ' ' HIS . . . . . 0.407 ' H ' ' C ' ' A' ' 243' ' ' ILE . 7.4 t-80 -141.27 8.24 2.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.035 0.445 . . . . 10.0 109.922 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 40.7 mt -94.13 -166.0 1.42 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.763 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 247' ' ' ILE . . . . . 0.446 ' O ' ' HB3' ' A' ' 253' ' ' ASP . 73.4 mt -107.1 114.51 46.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 109.017 -0.735 . . . . 10.0 109.017 179.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 248' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 248' ' ' ARG . 0.2 OUTLIER -66.03 73.2 0.07 Allowed 'General case' 0 N--CA 1.466 0.337 0 O-C-N 123.732 0.645 . . . . 10.0 112.223 -178.447 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -179.21 -44.55 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.346 -0.843 . . . . 10.0 109.576 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -126.43 -167.88 1.78 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.982 -179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt 42.31 46.77 4.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.875 0.87 . . . . 10.0 112.375 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 252' ' ' GLU . . . . . 0.403 ' HB2' HD11 ' A' ' 285' ' ' LEU . 6.8 mm-40 64.88 -1.73 0.79 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.867 1.432 . . . . 10.0 114.867 177.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 253' ' ' ASP . . . . . 0.446 ' HB3' ' O ' ' A' ' 247' ' ' ILE . 46.4 t0 -80.12 70.35 6.71 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.659 0.663 . . . . 10.0 110.466 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 4.8 p 179.48 -105.69 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.117 -0.947 . . . . 10.0 109.641 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -149.0 12.47 0.86 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 179.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 256' ' ' THR . . . . . 0.403 HG21 ' HA ' ' A' ' 276' ' ' GLU . 4.6 m 53.11 69.77 0.66 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 114.664 -1.153 . . . . 10.0 111.878 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 257' ' ' PHE . . . . . 0.554 ' CD1' ' HA2' ' A' ' 261' ' ' GLY . 56.7 m-85 -87.15 0.63 55.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.058 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 258' ' ' GLN . . . . . 0.401 ' HB2' ' HG3' ' A' ' 277' ' ' ARG . 42.6 tt0 67.3 -75.51 0.06 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.339 -0.846 . . . . 10.0 111.075 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -165.1 41.03 0.29 Allowed Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.87 -0.681 . . . . 10.0 111.983 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -157.37 -82.39 0.06 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.892 0.377 . . . . 10.0 110.939 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 261' ' ' GLY . . . . . 0.554 ' HA2' ' CD1' ' A' ' 257' ' ' PHE . . . 103.03 -112.25 4.2 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.849 -0.691 . . . . 10.0 111.793 -179.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -145.71 -83.33 0.13 Allowed 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 110.29 -0.263 . . . . 10.0 110.29 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -169.61 172.45 6.91 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.238 -0.653 . . . . 10.0 109.238 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 15.7 m -65.52 99.32 0.42 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.078 0.466 . . . . 10.0 111.23 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 7.1 p -159.76 -42.97 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.103 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 266' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -161.19 176.62 11.07 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.321 -0.622 . . . . 10.0 109.321 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.53 3.5 27.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.002 0.43 . . . . 10.0 110.378 -179.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 268' ' ' LYS . . . . . 0.444 ' HD3' ' O ' ' A' ' 318' ' ' ALA . 2.2 ptpp? -143.9 171.91 13.58 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.628 -179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 3.1 m -116.48 -142.76 0.37 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.245 179.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -156.2 -22.86 0.1 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.698 -0.401 . . . . 10.0 111.934 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 13.7 pm0 -78.18 -16.03 58.27 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.491 0.182 . . . . 10.0 111.491 -179.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 272' ' ' VAL . . . . . 0.89 HG22 ' HG ' ' A' ' 319' ' ' LEU . 23.7 t 70.34 -73.14 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 122.886 0.474 . . . . 10.0 110.486 -179.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.02 44.09 26.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.978 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 2.8 mm? 61.04 -158.79 0.33 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.672 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 5.5 t -154.5 -179.68 8.2 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.23 -0.285 . . . . 10.0 110.23 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 276' ' ' GLU . . . . . 0.403 ' HA ' HG21 ' A' ' 256' ' ' THR . 0.4 OUTLIER 70.34 135.54 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 O-C-N 124.23 0.956 . . . . 10.0 111.655 -179.397 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 277' ' ' ARG . . . . . 0.401 ' HG3' ' HB2' ' A' ' 258' ' ' GLN . 1.0 OUTLIER 176.47 22.69 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.655 -1.157 . . . . 10.0 109.074 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.419 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . -122.01 -35.52 0.77 Allowed Glycine 0 N--CA 1.442 -0.9 0 C-N-CA 120.453 -0.88 . . . . 10.0 112.621 -178.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 278' ' ' GLY . 3.5 mm? 70.87 -50.14 0.68 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.275 0.63 . . . . 10.0 111.561 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 10.5 p -75.43 -21.96 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.197 0.522 . . . . 10.0 110.649 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 281' ' ' LEU . . . . . 0.415 HD13 ' HA3' ' A' ' 278' ' ' GLY . 4.6 mp -72.86 -37.5 67.36 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.038 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 43.3 pt -79.21 -10.02 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 N-CA-C 111.721 0.267 . . . . 10.0 111.721 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -63.79 -39.23 93.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.07 0.462 . . . . 10.0 109.88 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.12 22.58 1.41 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.635 -0.712 . . . . 10.0 111.148 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 285' ' ' LEU . . . . . 0.403 HD11 ' HB2' ' A' ' 252' ' ' GLU . 15.1 mt -113.23 -20.13 11.53 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.334 0.588 . . . . 10.0 109.516 178.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 5.5 mt -111.85 -179.75 3.78 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.527 -0.76 . . . . 10.0 110.171 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 287' ' ' VAL . . . . . 0.444 ' HA ' ' HA ' ' A' ' 293' ' ' ASP . 12.0 t 55.35 67.16 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 O-C-N 123.606 0.566 . . . . 10.0 111.673 179.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 288' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.71 150.1 0.64 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.528 178.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 67.78 -76.99 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 O-C-N 124.052 0.845 . . . . 10.0 111.445 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 290' ' ' GLY . . . . . 0.437 ' O ' ' HB ' ' A' ' 291' ' ' ILE . . . 171.14 154.19 9.52 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.366 -0.921 . . . . 10.0 112.429 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 291' ' ' ILE . . . . . 0.446 HD11 ' O ' ' B' ' 11' ' ' LEU . 88.4 mt 77.57 110.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.258 0.623 . . . . 10.0 110.317 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 292' ' ' MET . . . . . 0.458 ' O ' ' HG2' ' A' ' 292' ' ' MET . 25.0 ttp 70.64 5.26 5.34 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.705 0.764 . . . . 10.0 110.206 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 293' ' ' ASP . . . . . 0.444 ' HA ' ' HA ' ' A' ' 287' ' ' VAL . 10.3 p-10 -77.03 -13.63 59.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.777 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -64.26 -34.13 77.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.431 179.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 133.67 106.89 0.97 Allowed Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.779 -0.646 . . . . 10.0 111.908 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -153.57 -172.6 4.28 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 297' ' ' SER . . . . . 0.521 ' HB2' ' OG ' ' A' ' 300' ' ' SER . 4.6 m -115.15 141.26 48.26 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.962 0.411 . . . . 10.0 110.408 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.9 tp -83.28 11.11 7.1 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.995 0.426 . . . . 10.0 111.131 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -131.49 9.73 4.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.086 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 300' ' ' SER . . . . . 0.521 ' OG ' ' HB2' ' A' ' 297' ' ' SER . 11.7 m -64.49 145.47 98.47 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.86 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -51.48 -42.81 53.65 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 123.244 2.629 . . . . 10.0 113.269 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -78.92 -8.25 58.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.836 0.351 . . . . 10.0 111.445 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -106.65 15.08 26.15 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.134 0.492 . . . . 10.0 110.492 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 8.7 tp -63.75 -29.15 46.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.657 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 15.5 tmm? -61.63 -50.86 70.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.986 -0.552 . . . . 10.0 109.775 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 29.7 tp -69.42 -39.23 78.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.136 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 19.3 ttt -57.71 -41.61 82.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.864 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -80.53 -15.37 56.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.747 0.308 . . . . 10.0 111.009 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 28.3 m170 -87.15 -42.43 13.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.662 -0.245 . . . . 10.0 110.583 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 27.0 m -68.02 -33.58 61.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.817 0.341 . . . . 10.0 110.834 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 1.3 p -68.61 -23.45 64.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.912 0.387 . . . . 10.0 111.058 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 312' ' ' ALA . . . . . 0.467 ' HA ' ' NE ' ' A' ' 315' ' ' ARG . . . -69.67 -51.86 30.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.089 0.471 . . . . 10.0 109.936 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 313' ' ' ALA . . . . . 0.411 ' HA ' ' HB1' ' A' ' 356' ' ' ALA . . . -71.14 -24.02 62.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.632 -0.713 . . . . 10.0 111.131 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 314' ' ' LEU . . . . . 0.402 HD11 ' O ' ' A' ' 252' ' ' GLU . 12.4 tp -78.13 -46.15 21.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.673 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 315' ' ' ARG . . . . . 0.467 ' NE ' ' HA ' ' A' ' 312' ' ' ALA . 3.7 ptp180 -67.3 -27.85 67.52 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.005 0.431 . . . . 10.0 110.171 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 316' ' ' ALA . . . . . 0.445 ' O ' ' HE2' ' A' ' 360' ' ' LYS . . . -82.39 3.31 28.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.061 0.457 . . . . 10.0 110.319 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -99.53 -10.24 22.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.053 -0.522 . . . . 10.0 111.078 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.444 ' O ' ' HD3' ' A' ' 268' ' ' LYS . . . -144.73 -51.8 0.29 Allowed 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.066 0.395 . . . . 10.0 112.066 -179.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 319' ' ' LEU . . . . . 0.89 ' HG ' HG22 ' A' ' 272' ' ' VAL . 2.4 mm? -67.5 -34.66 77.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.552 -0.295 . . . . 10.0 111.622 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -107.14 112.46 25.37 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.027 0.442 . . . . 10.0 110.117 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.62 123.14 47.66 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.701 -179.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 322' ' ' ARG . . . . . 0.562 ' HB3' ' CZ ' ' A' ' 326' ' ' TYR . 7.9 ptm180 -70.71 160.77 32.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.574 -0.284 . . . . 10.0 110.672 179.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 323' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 78.54 -12.27 1.1 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.007 0.923 . . . . 10.0 111.585 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 15.0 p -134.26 -42.36 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 111.758 0.281 . . . . 10.0 111.758 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -90.88 -24.0 20.35 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.456 0.646 . . . . 10.0 109.713 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 326' ' ' TYR . . . . . 0.562 ' CZ ' ' HB3' ' A' ' 322' ' ' ARG . 31.9 p90 -163.11 150.67 13.22 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.149 -0.932 . . . . 10.0 109.09 179.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 8.9 tp -127.58 133.68 67.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.89 0.376 . . . . 10.0 110.067 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 328' ' ' VAL . . . . . 0.405 HG21 ' HG3' ' A' ' 361' ' ' GLU . 42.2 t -104.61 126.38 59.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.817 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 329' ' ' LYS . . . . . 0.509 ' O ' ' HG3' ' A' ' 329' ' ' LYS . 3.8 pttp -146.2 132.46 19.49 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.75 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 61.11 21.28 11.69 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.907 0.384 . . . . 10.0 111.436 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 87.0 2.04 84.21 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.924 -0.655 . . . . 10.0 112.311 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -101.76 136.72 41.12 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 39.4 t -99.35 107.24 20.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.557 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 64.8 mt -92.58 126.4 45.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.072 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 20.5 mt -79.95 120.37 31.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.683 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 46.7 t -103.58 125.25 58.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.905 0.383 . . . . 10.0 110.162 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 337' ' ' ASP . . . . . 0.448 ' HB3' ' H ' ' A' ' 342' ' ' ARG . 9.9 t70 -73.0 119.03 16.67 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.03 15.38 2.34 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.832 0.679 . . . . 10.0 112.832 -177.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 -104.78 -60.95 1.53 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.043 0.449 . . . . 10.0 110.309 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 24.9 p -104.29 -13.0 16.31 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.25 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 83.18 47.49 5.75 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.791 -0.719 . . . . 10.0 111.626 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.448 ' H ' ' HB3' ' A' ' 337' ' ' ASP . 2.8 tpp180 -98.18 138.19 35.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.631 0.253 . . . . 10.0 110.911 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.42 110.2 22.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.905 0.383 . . . . 10.0 110.886 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 66.1 mtt -113.39 102.49 10.38 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.865 0.364 . . . . 10.0 110.645 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -93.09 -24.3 18.34 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.437 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -92.29 53.87 2.81 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.18 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -144.53 160.96 40.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.797 0.332 . . . . 10.0 110.22 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -133.21 108.45 8.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.369 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -61.87 139.54 58.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.403 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.1 m -71.45 166.77 21.02 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.311 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 351' ' ' ASP . . . . . 0.403 ' HB3' HD12 ' A' ' 353' ' ' LEU . 5.4 t70 60.18 -157.32 0.33 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.657 -0.702 . . . . 10.0 110.859 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . -99.51 26.32 24.82 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.533 -0.842 . . . . 10.0 113.177 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.403 HD12 ' HB3' ' A' ' 351' ' ' ASP . 1.6 mp -59.33 -58.05 10.33 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.963 0.411 . . . . 10.0 110.968 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 354' ' ' HIS . . . . . 0.457 ' HE1' ' OE1' ' A' ' 368' ' ' GLU . 21.7 p80 -68.96 -32.45 72.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.381 -179.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 355' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.09 -38.76 87.4 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.087 0.47 . . . . 10.0 110.633 -179.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 356' ' ' ALA . . . . . 0.411 ' HB1' ' HA ' ' A' ' 313' ' ' ALA . . . -74.58 -28.92 61.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.418 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 23.0 t -66.45 -43.61 90.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.033 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.46 ' HB3' ' HA ' ' A' ' 365' ' ' ILE . 15.7 mt-10 -64.53 -26.27 68.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.569 179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -94.11 -1.74 53.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.748 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 360' ' ' LYS . . . . . 0.445 ' HE2' ' O ' ' A' ' 316' ' ' ALA . 27.3 ttpp -99.18 -44.61 6.2 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.676 -179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 361' ' ' GLU . . . . . 0.462 ' OE1' ' HD2' ' A' ' 322' ' ' ARG . 23.5 mm-40 -84.46 173.24 11.02 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.147 -0.479 . . . . 10.0 109.811 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -78.59 57.55 4.17 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 121.151 -0.547 . . . . 10.0 112.128 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 16.4 m -134.75 -166.01 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -122.94 136.15 54.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.836 0.35 . . . . 10.0 110.845 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 365' ' ' ILE . . . . . 0.492 ' H ' HD12 ' A' ' 365' ' ' ILE . 4.0 mp -60.94 143.87 14.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.626 -0.716 . . . . 10.0 110.223 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 40.0 mm-40 -69.52 -101.82 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.694 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -178.0 -65.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.137 -0.32 . . . . 10.0 110.137 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 368' ' ' GLU . . . . . 0.457 ' OE1' ' HE1' ' A' ' 354' ' ' HIS . 1.9 mp0 55.65 -105.24 0.26 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.456 -0.793 . . . . 10.0 110.692 -179.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 65.9 -67.04 0.15 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.532 0.733 . . . . 10.0 111.332 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 37.48 45.89 0.61 Allowed 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.643 1.177 . . . . 10.0 113.59 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 14.5 t -140.25 152.12 45.69 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.898 0.38 . . . . 10.0 110.789 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 10.8 mt -158.63 -70.89 0.09 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.68 -0.691 . . . . 10.0 109.484 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -136.76 153.3 50.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.683 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 374' ' ' SER . . . . . 0.582 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 7.5 t -155.55 147.82 23.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.809 0.338 . . . . 10.0 111.031 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.3 tt -157.06 147.08 11.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.021 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 4.0 p -97.31 148.77 22.8 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -57.68 -41.75 82.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.712 0.291 . . . . 10.0 110.889 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 378' ' ' GLN . . . . . 0.4 ' HB3' ' O ' ' A' ' 219' ' ' ALA . 0.0 OUTLIER -61.17 -33.06 72.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.375 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 -90.01 -8.44 51.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.775 0.321 . . . . 10.0 111.119 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -87.61 -43.52 11.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.113 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -72.96 -11.25 60.5 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.267 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 44.5 mtp180 -77.86 -9.72 59.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.023 0.439 . . . . 10.0 110.304 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 30.3 mt -94.77 -8.25 38.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.502 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.49 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 18.5 m-85 -84.96 132.89 34.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.684 0.278 . . . . 10.0 111.208 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -64.15 -56.09 17.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.197 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 386' ' ' LYS . . . . . 0.457 ' O ' ' HA ' ' A' ' 205' ' ' TYR . 69.1 mttt -110.56 113.14 25.53 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.579 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 41.5 tp -122.25 124.68 44.34 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.257 -0.428 . . . . 10.0 110.082 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -140.64 160.04 40.88 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.595 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -166.53 164.21 37.51 Favored Glycine 0 N--CA 1.442 -0.947 0 C-N-CA 120.381 -0.914 . . . . 10.0 112.368 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 62.4 mtm -119.03 171.65 8.11 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.877 -0.416 . . . . 10.0 109.877 179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 391' ' ' THR . . . . . 0.469 ' HA ' ' OE2' ' A' ' 210' ' ' GLU . 1.9 t -162.55 158.31 23.32 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.881 0.372 . . . . 10.0 110.782 179.093 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -81.76 -171.32 45.62 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.916 -0.659 . . . . 10.0 111.843 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 393' ' ' THR . . . . . 0.527 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 1.9 m -73.56 79.59 1.47 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.228 0.537 . . . . 10.0 111.136 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -119.89 -60.86 1.67 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.56 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 395' ' ' ASP . . . . . 0.449 ' CG ' ' H ' ' A' ' 396' ' ' THR . 9.9 t70 58.8 -145.84 0.54 Allowed 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.262 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 396' ' ' THR . . . . . 0.686 HG21 ' HB3' ' A' ' 565' ' ' ARG . 5.3 m 69.56 -79.53 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.101 0.56 . . . . 10.0 112.169 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -86.26 26.49 1.04 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.129 0.49 . . . . 10.0 110.444 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -69.86 -29.72 67.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 10.0 111.238 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -64.13 -23.87 67.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.063 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 400' ' ' GLU . . . . . 0.471 ' HA ' ' OE1' ' A' ' 400' ' ' GLU . 5.0 mm-40 -68.93 -24.06 64.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.875 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 401' ' ' PHE . . . . . 0.464 ' HB3' ' HB2' ' A' ' 407' ' ' LEU . 39.2 m-85 -64.09 -31.81 73.14 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 178.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.23 -27.41 26.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.262 -0.881 . . . . 10.0 110.539 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 2.6 m -73.01 -39.54 65.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.806 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 17.4 mt -98.96 -53.66 7.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 113.451 0.908 . . . . 10.0 113.451 -177.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -99.64 -2.0 36.62 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.802 0.667 . . . . 10.0 112.802 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt 63.16 29.8 16.05 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.45 0.469 . . . . 10.0 111.659 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 407' ' ' LEU . . . . . 0.496 HD13 HD11 ' A' ' 99' ' ' ILE . 5.3 mt -84.94 138.58 32.41 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.617 -0.265 . . . . 10.0 111.065 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . 0.53 ' OD2' ' HD2' ' A' ' 13' ' ' ARG . 22.0 t70 -81.41 160.09 24.14 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.221 -0.659 . . . . 10.0 109.221 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 6.8 m -114.4 115.5 27.41 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.986 0.422 . . . . 10.0 111.733 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.61 138.28 54.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.016 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 44.7 t -104.32 125.55 59.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.73 0.3 . . . . 10.0 110.752 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 94.4 t -84.0 127.66 66.03 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.497 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.32 136.6 47.88 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.665 2.244 . . . . 10.0 112.41 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.43 HG23 ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.8 149.87 45.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.651 -0.704 . . . . 10.0 111.016 179.257 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -58.4 -50.23 74.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.146 0.498 . . . . 10.0 110.066 179.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 64.6 mtm180 -114.34 158.71 39.12 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.94 114.12 2.16 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.239 1.959 . . . . 10.0 111.333 178.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 54.0 ttp -68.55 113.44 6.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.092 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 34.3 mt -98.67 73.12 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.335 0.588 . . . . 10.0 109.827 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -102.04 116.48 32.77 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.024 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -84.96 99.23 10.85 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.71 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.23 110.52 16.78 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.734 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 424' ' ' PRO . 51.4 mt -100.55 132.28 22.58 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.101 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 424' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 423' ' ' LEU . 50.6 Cg_exo -53.86 144.7 54.28 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.936 2.424 . . . . 10.0 113.544 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.83 138.83 48.57 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.506 -0.77 . . . . 10.0 109.825 178.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 15.4 mt -113.56 118.54 34.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.991 0.424 . . . . 10.0 110.549 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 91.3 t -99.7 122.23 51.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.598 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 428' ' ' TYR . . . . . 0.471 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 5.0 m-85 -109.76 176.36 5.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.252 179.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -80.25 -79.28 0.15 Allowed 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.972 -0.291 . . . . 10.0 110.99 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 70.1 p -82.24 160.23 23.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.737 0.303 . . . . 10.0 110.993 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -62.5 -33.52 75.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.371 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.79 80.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.595 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.51 -42.77 99.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.247 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 434' ' ' LYS . . . . . 0.435 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 38.3 ttpt -62.09 -50.08 73.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.566 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 435' ' ' ILE . . . . . 0.496 ' O ' HG12 ' A' ' 439' ' ' ILE . 51.4 mm -62.88 -44.3 99.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.598 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.6 -41.88 86.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.615 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.23 -36.97 85.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.339 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 438' ' ' ILE . . . . . 0.428 HG23 HG21 ' A' ' 557' ' ' ILE . 90.6 mt -64.24 -47.92 87.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.769 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 439' ' ' ILE . . . . . 0.496 HG12 ' O ' ' A' ' 435' ' ' ILE . 46.6 mm -59.78 -40.24 82.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.081 179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -62.05 -44.57 96.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.443 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -63.58 -36.62 84.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.609 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.488 HG12 HG11 ' A' ' 452' ' ' VAL . 96.4 mt -72.24 -42.75 66.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.445 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -48.52 -53.93 16.28 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.971 0.73 . . . . 10.0 112.971 -179.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -62.49 -41.84 99.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.967 0.413 . . . . 10.0 111.866 -178.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.419 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 76.2 mtt-85 -71.26 -35.79 71.51 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.18 0.437 . . . . 10.0 112.18 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 24.8 m -66.43 -33.89 76.72 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.258 0.551 . . . . 10.0 110.146 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -70.69 -46.14 63.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.37 179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.63 -44.89 76.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.357 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 120.9 32.45 1.08 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.43 -0.891 . . . . 10.0 112.97 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' GLN . . . . . 0.419 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 61.9 tt0 -104.04 125.82 33.41 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.871 0.335 . . . . 10.0 110.16 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.38 136.51 47.31 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.553 2.168 . . . . 10.0 111.697 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.488 HG11 HG12 ' A' ' 442' ' ' ILE . 59.5 t -124.57 122.61 64.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.04 0.448 . . . . 10.0 111.62 -178.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 52.2 tp -108.33 110.0 21.46 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.231 -0.655 . . . . 10.0 109.231 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 19.9 t -89.61 113.83 26.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.464 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -93.66 123.78 7.56 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.79 -0.719 . . . . 10.0 111.664 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 34.2 p -122.9 130.47 52.89 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.591 0.234 . . . . 10.0 110.695 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 30.0 pt -95.73 -8.76 9.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.103 0.478 . . . . 10.0 110.296 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' SER . . . . . 0.415 ' HB2' ' HD3' ' A' ' 461' ' ' LYS . 0.9 OUTLIER -124.79 126.13 45.13 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.769 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 47.0 mt -57.73 -37.09 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-O 121.051 0.453 . . . . 10.0 111.517 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -56.19 -42.95 77.94 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.142 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.415 ' HD3' ' HB2' ' A' ' 458' ' ' SER . 0.8 OUTLIER -72.91 -28.93 62.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.314 -178.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.5 m -62.44 -47.65 83.11 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.247 0.546 . . . . 10.0 109.685 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -68.45 -35.4 77.54 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.718 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 50.7 tp -63.79 -52.45 60.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.799 -0.637 . . . . 10.0 111.356 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 8.8 p -67.16 -31.62 54.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.847 0.356 . . . . 10.0 110.812 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 5.6 t -65.59 -38.96 90.98 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.72 -0.474 . . . . 10.0 109.72 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -62.35 -51.05 69.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.41 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -60.58 -41.19 94.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.757 -0.656 . . . . 10.0 111.39 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 36.7 mt -61.64 -38.42 87.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.761 0.315 . . . . 10.0 110.755 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 9.0 m -68.51 -36.88 79.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.326 0.584 . . . . 10.0 110.058 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -67.64 -23.31 65.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.387 -0.824 . . . . 10.0 110.854 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -95.5 -3.09 47.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.009 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 72.65 14.15 77.91 Favored Glycine 0 C--N 1.329 0.169 0 C-N-CA 121.013 -0.613 . . . . 10.0 112.481 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 94.5 mt -78.4 120.86 30.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.837 0.351 . . . . 10.0 110.23 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -65.93 117.34 8.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.622 -0.717 . . . . 10.0 110.019 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -145.56 158.21 43.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.171 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . 0.506 ' ND2' HD13 ' A' ' 490' ' ' ILE . 8.1 t30 -132.1 144.76 50.95 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.255 179.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 17.2 t -104.63 132.12 52.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.967 -0.382 . . . . 10.0 109.967 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.4 HD12 ' HB2' ' A' ' 503' ' ' ALA . 88.4 mt -86.31 93.84 9.19 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.122 0.486 . . . . 10.0 110.425 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -85.37 119.81 26.15 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.413 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -64.62 -25.06 67.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.901 -0.59 . . . . 10.0 112.179 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -69.68 -23.1 63.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.042 0.449 . . . . 10.0 110.701 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -120.06 64.84 0.82 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.644 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' HIS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 487' ' ' GLU . 0.0 OUTLIER -64.58 -24.36 67.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.593 -178.756 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.38 -33.22 75.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.085 0.469 . . . . 10.0 110.05 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -89.88 -40.49 12.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.955 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 484' ' ' HIS . 0.1 OUTLIER -54.01 -51.92 62.43 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.659 -0.7 . . . . 10.0 111.515 -179.81 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -56.46 -32.47 64.97 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 112.4 0.518 . . . . 10.0 112.4 -178.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -73.49 -37.52 65.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.033 0.444 . . . . 10.0 110.754 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' ILE . . . . . 0.506 HD13 ' ND2' ' A' ' 477' ' ' ASN . 28.8 mt -76.55 -41.43 34.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.329 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 66.6 t -57.22 -34.75 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-O 121.073 0.463 . . . . 10.0 110.744 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -63.43 -22.34 66.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.847 -0.615 . . . . 10.0 111.57 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 72.2 mm-40 -120.03 22.44 11.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.64 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -71.6 -16.66 62.3 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.997 0.427 . . . . 10.0 111.144 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -95.39 16.44 61.26 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.854 -0.688 . . . . 10.0 111.862 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -74.39 141.09 76.44 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 110.134 -0.321 . . . . 10.0 110.134 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.38 125.6 19.7 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.452 2.101 . . . . 10.0 112.51 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.24 29.8 4.48 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.697 -0.683 . . . . 10.0 112.35 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -105.66 114.61 28.88 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.832 0.348 . . . . 10.0 110.341 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 23.4 t -98.7 118.4 45.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.198 -0.455 . . . . 10.0 109.892 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.62 138.18 54.67 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.061 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 41.2 mt -109.98 129.36 65.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.727 -0.471 . . . . 10.0 109.727 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . 0.4 ' HB2' HD12 ' A' ' 479' ' ' LEU . . . -121.42 129.45 53.01 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.818 0.342 . . . . 10.0 111.066 -179.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 7.4 m -104.89 119.55 39.28 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.464 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 66.8 t30 59.21 77.3 0.32 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.953 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -78.03 123.61 27.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.482 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -70.51 172.74 7.96 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.172 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -65.64 152.95 51.49 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.044 -0.598 . . . . 10.0 112.578 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 67.78 -81.91 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.162 0.585 . . . . 10.0 111.502 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 87.33 149.15 15.23 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.967 -0.635 . . . . 10.0 112.37 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.96 151.07 31.39 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 122.666 0.387 . . . . 10.0 111.527 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -76.27 103.65 6.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.447 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 66.8 mt -84.97 111.29 20.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.209 -0.45 . . . . 10.0 109.98 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 18.4 t -80.5 132.49 31.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.736 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 65.4 mt -67.42 130.39 42.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.703 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 94.32 -11.42 70.41 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.986 -0.626 . . . . 10.0 111.786 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 117.13 -170.78 13.56 Favored Glycine 0 N--CA 1.445 -0.748 0 N-CA-C 110.914 -0.874 . . . . 10.0 110.914 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 5.1 p -129.19 99.49 5.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 117.206 0.503 . . . . 10.0 110.993 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 20.0 p-90 -58.28 -28.48 65.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.88 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -62.88 -31.38 72.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.871 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -86.48 -34.26 20.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.057 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -64.76 -40.76 95.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.716 -0.675 . . . . 10.0 111.169 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.9 m -73.42 -19.9 18.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.979 0.419 . . . . 10.0 110.708 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -87.31 -6.81 58.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.728 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -91.47 3.57 54.65 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.486 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 16.5 mt -97.83 150.33 21.39 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.26 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -74.83 -49.08 21.89 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -126.63 90.59 49.41 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.535 -0.542 . . . . 10.0 109.535 179.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.3 113.46 2.26 Favored 'Trans proline' 0 N--CA 1.465 -0.203 0 C-N-CA 122.765 2.31 . . . . 10.0 112.504 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -104.18 149.0 25.66 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.525 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.38 -37.17 64.68 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.689 0.281 . . . . 10.0 111.465 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -58.19 -36.28 72.85 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.87 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -81.95 -40.49 22.18 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.793 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 76.7 mt -58.81 -48.04 87.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.353 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -72.41 -29.07 63.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.81 0.338 . . . . 10.0 110.859 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -69.59 -50.74 41.66 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 94.2 mt -62.81 -36.23 74.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.141 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 25.6 ttmt -59.78 -42.16 92.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.023 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -70.06 -45.29 67.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.566 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.19 -47.08 84.54 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.331 0.586 . . . . 10.0 110.065 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -62.46 -40.66 97.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.334 -0.848 . . . . 10.0 110.427 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -55.21 -42.51 73.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.854 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 61.9 t -65.79 -47.81 84.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.437 179.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 10.0 mtp180 -62.67 -37.84 88.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.572 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -60.71 -49.05 79.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.326 -0.852 . . . . 10.0 111.058 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -70.15 -27.34 64.47 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.537 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -65.27 -35.55 81.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.106 0.479 . . . . 10.0 109.991 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 95.6 t -73.46 -33.97 41.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.576 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 88.6 mt -58.88 -50.4 74.16 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.322 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -69.07 -24.78 64.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.916 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 551' ' ' ALA . . . . . . . . . . . . . . . -72.12 -23.42 61.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.24 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 122.46 5.15 8.69 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.362 -0.923 . . . . 10.0 113.477 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 79.24 -169.03 53.61 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.732 -0.747 . . . . 10.0 112.678 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 52.9 tp -69.2 123.06 20.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.865 0.364 . . . . 10.0 110.693 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -101.59 123.23 45.27 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.965 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 21.8 mm -106.89 131.49 56.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.335 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 557' ' ' ILE . . . . . 0.428 HG21 HG23 ' A' ' 438' ' ' ILE . 25.5 mt -119.24 124.41 73.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.054 178.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . 0.537 ' HA3' ' CD2' ' A' ' 586' ' ' PHE . . . -101.68 125.6 8.61 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.675 -0.774 . . . . 10.0 111.991 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 2.0 p -83.02 -30.41 28.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.24 0.543 . . . . 10.0 110.428 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -153.6 152.75 31.24 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.043 -0.98 . . . . 10.0 109.134 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 561' ' ' ARG . . . . . . . . . . . . . 37.4 mtt-85 -101.16 158.76 15.79 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.195 -0.298 . . . . 10.0 110.195 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -87.41 152.58 22.13 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.012 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.25 -45.25 95.31 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 3.9 p -89.22 128.61 35.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.487 -0.779 . . . . 10.0 109.874 178.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 565' ' ' ARG . . . . . 0.686 ' HB3' HG21 ' A' ' 396' ' ' THR . 16.2 tpt180 -70.91 -21.59 62.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.535 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 566' ' ' ARG . . . . . 0.483 ' HD2' ' OD1' ' A' ' 212' ' ' ASP . 3.2 mtm180 -54.65 -52.6 61.79 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.954 0.407 . . . . 10.0 110.796 179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 46.5 mt -80.03 -30.75 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.54 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -62.42 -40.34 96.23 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.77 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -69.13 -31.81 70.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.791 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -65.12 -28.22 69.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.998 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 35.7 tp -74.4 -26.96 60.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.109 0.48 . . . . 10.0 110.375 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 20.9 ttp180 -84.82 -27.47 26.76 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.518 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -84.03 29.64 3.79 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.991 -0.623 . . . . 10.0 113.499 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -82.17 -44.33 16.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 117.001 0.401 . . . . 10.0 110.211 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 1.2 m -87.97 172.45 9.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.938 -0.573 . . . . 10.0 110.201 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 69.38 42.3 74.66 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.568 -0.825 . . . . 10.0 112.337 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 54.6 mtt180 -82.36 135.88 35.09 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.463 -0.569 . . . . 10.0 109.463 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 64.61 18.02 11.18 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.131 0.491 . . . . 10.0 110.018 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 80.84 43.92 8.66 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.696 -0.684 . . . . 10.0 111.825 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -99.29 -163.84 1.07 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.513 -0.18 . . . . 10.0 110.513 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -93.73 173.1 7.85 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.232 0.539 . . . . 10.0 111.791 -179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 159.29 166.69 18.75 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.761 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 3.3 p -147.6 138.37 23.37 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.761 0.281 . . . . 10.0 110.326 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 12.6 m -123.06 132.08 53.97 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.605 -0.271 . . . . 10.0 110.681 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 2.2 ttm180 -146.21 128.31 15.62 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.091 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 586' ' ' PHE . . . . . 0.537 ' CD2' ' HA3' ' A' ' 558' ' ' GLY . 18.1 m-85 -114.84 146.96 40.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.039 0.447 . . . . 10.0 110.646 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 587' ' ' TYR . . . . . 0.435 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 65.3 m-85 -126.5 135.38 51.25 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.702 -0.851 . . . . 10.0 108.702 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 63.9 mt -133.91 160.0 39.0 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.697 0.284 . . . . 10.0 110.699 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 25.5 p -130.88 164.75 24.56 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.003 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 78.5 mmm -76.22 -2.52 31.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.92 0.391 . . . . 10.0 111.117 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -98.01 1.93 48.33 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.366 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -88.41 142.69 27.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.78 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -65.26 -13.73 59.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.547 -0.751 . . . . 10.0 112.34 -178.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.562 ' O ' HG12 ' A' ' 597' ' ' ILE . 15.7 tp -65.38 -23.95 67.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.918 0.39 . . . . 10.0 110.858 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 19.5 mmt -77.52 -3.79 42.35 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.916 0.389 . . . . 10.0 111.159 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -92.4 -15.33 27.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.771 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 594' ' ' LEU . 29.1 pt -67.3 -14.29 17.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-O 120.999 0.428 . . . . 10.0 111.241 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -76.53 -10.65 59.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.046 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.83 -55.93 0.65 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.458 0.703 . . . . 10.0 110.781 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 7.3 m -93.91 103.64 15.73 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -16.52 39.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.871 -0.604 . . . . 10.0 112.113 -178.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 4.4 mmt180 -63.0 -32.78 74.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.696 0.284 . . . . 10.0 110.552 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 50.7 t -68.0 -48.89 72.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.281 -0.418 . . . . 10.0 109.938 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.1 -38.47 85.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.32 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -64.6 -26.57 71.0 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.946 -0.57 . . . . 10.0 112.489 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 58.2 tpp -68.93 -18.04 64.04 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.113 0.482 . . . . 10.0 110.572 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 59.7 mtt -76.58 -14.98 59.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.257 -0.428 . . . . 10.0 110.522 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 608' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 608' ' ' ARG . 36.5 mtt-85 -72.07 -12.97 61.46 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.23 0.538 . . . . 10.0 110.358 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 10.6 mmmt -82.93 1.99 36.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.889 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 5.2 mp -75.91 -14.87 60.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.572 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 92.35 -31.73 5.89 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.973 -0.632 . . . . 10.0 111.774 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 612' ' ' MET . . . . . 0.438 ' HG3' ' HA ' ' A' ' 428' ' ' TYR . 0.0 OUTLIER 69.78 -66.8 0.25 Allowed 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 123.539 0.736 . . . . 10.0 111.69 179.763 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp 57.42 78.32 0.37 Allowed Pre-proline 0 CA--C 1.53 0.198 0 O-C-N 123.524 0.515 . . . . 10.0 111.131 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 614' ' ' PRO . . . . . 0.471 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 52.3 Cg_exo -56.56 119.12 6.13 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.142 2.561 . . . . 10.0 112.506 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 101.74 -9.32 56.88 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.893 -0.67 . . . . 10.0 111.891 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -111.05 120.11 41.26 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.992 0.425 . . . . 10.0 110.347 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -79.28 96.93 6.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.618 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.2 tp -72.24 -23.22 21.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.841 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 46.98 83.65 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.797 0.685 . . . . 10.0 112.524 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -116.79 94.03 42.87 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.273 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -61.44 -29.22 84.87 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.102 2.535 . . . . 10.0 113.447 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 70.1 p-90 -65.36 -25.75 67.71 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.886 -0.326 . . . . 10.0 110.996 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 73.1 t -67.85 -42.36 85.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 1.8 m -62.74 -38.85 92.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.445 -0.798 . . . . 10.0 110.081 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -68.97 -39.18 79.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.177 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -61.68 -38.4 87.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.231 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.76 -43.64 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.022 -0.535 . . . . 10.0 109.935 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 628' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' A' ' 632' ' ' ARG . . . -60.33 -42.21 95.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.411 179.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 629' ' ' ASN . . . . . 0.411 ' O ' ' HG3' ' A' ' 633' ' ' LYS . 61.3 t30 -67.65 -35.86 79.69 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.144 179.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -64.75 -41.87 95.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.975 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 631' ' ' GLN . . . . . 0.402 ' OE1' ' HD3' ' A' ' 565' ' ' ARG . 49.5 mt-30 -62.76 -37.45 86.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.083 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 632' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 628' ' ' ALA . 12.7 mtp180 -61.77 -34.62 76.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.277 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 633' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 629' ' ' ASN . 57.5 mttm -64.91 -38.93 92.61 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 92.1 t -62.22 -49.56 83.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.053 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -62.41 -30.95 71.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.292 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.4 m -69.43 -23.78 63.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.282 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -73.28 -35.68 66.21 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -65.0 -42.29 94.61 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.63 -0.713 . . . . 10.0 109.521 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -55.7 -44.84 77.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.308 -0.86 . . . . 10.0 110.4 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -59.6 -43.37 93.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.821 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 52.3 mt -64.57 -47.6 88.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.224 179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 642' ' ' ARG . . . . . 0.507 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 75.4 mtm-85 -60.28 -43.34 96.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.945 -0.57 . . . . 10.0 110.314 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 18.5 ttpt -55.21 -45.99 75.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.914 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -64.93 -41.5 95.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.944 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 88.9 mt -65.99 -41.39 91.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.926 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 646' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 97.5 mt -59.07 -42.47 90.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.879 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -66.43 -13.59 60.96 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.002 0.371 . . . . 10.0 112.002 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -102.27 -38.72 7.53 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.946 0.403 . . . . 10.0 111.162 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -83.41 -25.5 31.25 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 -178.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -65.27 -31.34 72.44 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.021 0.439 . . . . 10.0 110.319 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 651' ' ' VAL . . . . . 0.427 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 13.2 t -62.98 -47.28 93.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.8 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.12 -26.54 64.95 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.539 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 17.3 t30 -63.18 -48.23 79.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.598 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -62.79 -44.61 95.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.555 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 655' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 42.3 mt-30 -61.56 -44.05 97.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.364 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 24.9 ttp-105 -63.02 -42.44 99.8 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.857 -0.61 . . . . 10.0 109.952 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -63.23 -44.91 93.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.956 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.83 -49.64 69.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.769 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.3 tp -65.93 -36.9 78.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 C-N-CA 121.103 -0.239 . . . . 10.0 111.271 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 6.1 m-30 -68.32 -40.08 81.75 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.937 -0.394 . . . . 10.0 109.937 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 5.1 t -60.47 -49.46 77.48 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.066 -0.516 . . . . 10.0 109.698 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -58.88 -47.77 83.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.781 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 667' ' ' LEU . 43.8 ttt-85 -60.91 -39.23 88.57 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.042 -0.527 . . . . 10.0 111.571 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -73.45 -43.35 60.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.562 0.22 . . . . 10.0 111.487 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -58.45 -37.62 75.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.095 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 61.2 mt -88.7 -4.43 58.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.834 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.498 ' HB2' ' O ' ' A' ' 663' ' ' ARG . 20.3 tp -87.15 -46.96 9.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.075 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -68.41 -41.71 80.05 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.066 -0.516 . . . . 10.0 111.623 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 21.7 m -72.67 164.2 3.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.072 0.463 . . . . 10.0 111.423 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 53.9 m -115.96 -38.72 3.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.331 -179.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -80.12 84.63 5.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.136 0.493 . . . . 10.0 110.579 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 672' ' ' VAL . . . . . 0.4 ' O ' HG12 ' A' ' 676' ' ' ILE . 9.5 p -95.01 -5.46 10.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.567 0.699 . . . . 10.0 109.716 179.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -39.16 69.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.074 -0.966 . . . . 10.0 111.93 -179.308 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -58.54 -50.47 73.67 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.097 0.475 . . . . 10.0 110.551 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 675' ' ' THR . . . . . 0.443 ' O ' HG12 ' A' ' 679' ' ' ILE . 0.6 OUTLIER -64.9 -44.49 89.41 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.811 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 676' ' ' ILE . . . . . 0.4 HG12 ' O ' ' A' ' 672' ' ' VAL . 36.0 mm -56.7 -51.63 64.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.755 -0.657 . . . . 10.0 111.954 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -67.52 -35.75 79.7 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 -178.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 52.8 m -65.43 -46.6 79.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.618 0.247 . . . . 10.0 111.483 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 679' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 675' ' ' THR . 48.1 pt -74.76 -20.73 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.92 -0.312 . . . . 10.0 110.732 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 48.5 ttm-85 -60.48 -40.84 92.73 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.957 0.408 . . . . 10.0 110.179 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -62.96 -38.26 90.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.662 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -72.78 -46.79 51.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.223 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 683' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 679' ' ' ILE . 94.2 t -58.62 -46.11 90.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-O 120.831 0.348 . . . . 10.0 111.05 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -62.53 -42.24 99.4 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.465 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -64.07 -43.2 96.17 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.651 -0.249 . . . . 10.0 110.438 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.7 87.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.976 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 8.8 m -68.37 -37.32 80.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.563 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.04 -44.32 50.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.797 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -31.11 62.26 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.037 0.535 . . . . 10.0 111.931 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -66.62 -28.17 68.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.293 -0.412 . . . . 10.0 111.852 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -110.17 -22.09 11.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.739 0.304 . . . . 10.0 111.599 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 692' ' ' ILE . . . . . 0.403 HG12 ' HB3' ' A' ' 701' ' ' TRP . 28.1 mt -125.85 100.26 31.08 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.515 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.48 130.28 26.22 Favored 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.507 2.138 . . . . 10.0 110.766 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -48.11 109.04 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 123.056 2.504 . . . . 10.0 113.529 -178.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 60.06 88.91 0.07 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.661 -0.699 . . . . 10.0 111.551 179.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 11.9 p -154.67 -168.71 2.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.215 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 697' ' ' LEU . 32.3 mt -72.56 136.64 45.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.206 -0.294 . . . . 10.0 110.206 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -59.86 -31.71 70.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.873 -178.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -76.33 -4.56 42.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.974 0.416 . . . . 10.0 111.48 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 13.1 mmt -100.95 8.79 42.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.334 0.588 . . . . 10.0 109.784 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 701' ' ' TRP . . . . . 0.403 ' HB3' HG12 ' A' ' 692' ' ' ILE . 48.4 m0 -102.5 125.09 49.1 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.298 -0.865 . . . . 10.0 110.194 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -82.14 77.49 8.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.431 0.634 . . . . 10.0 109.334 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 703' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 32.8 mm -63.36 -49.45 79.0 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.175 -0.92 . . . . 10.0 111.16 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 704' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 51.7 Cg_exo -56.44 -45.88 34.26 Favored 'Trans proline' 0 C--N 1.359 1.13 0 C-N-CA 121.866 1.711 . . . . 10.0 112.008 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -64.22 -41.76 98.19 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.962 -0.637 . . . . 10.0 111.965 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.468 ' O ' ' HG ' ' A' ' 710' ' ' LEU . 60.0 tp -64.7 -43.44 93.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.487 0.184 . . . . 10.0 110.702 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -61.15 -47.41 86.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.525 179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -66.09 -35.04 79.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.393 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.5 -46.85 88.24 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.254 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 710' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 706' ' ' LEU . 63.1 mt -60.58 -36.74 79.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.776 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -73.22 -21.08 60.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.989 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -99.15 -42.28 7.13 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.523 0.564 . . . . 10.0 112.523 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -96.02 -23.36 16.85 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.699 1.0 . . . . 10.0 113.699 -177.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -120.34 1.23 10.72 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.504 0.927 . . . . 10.0 113.504 -177.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 715' ' ' ASP . . . . . 0.415 ' HB2' ' HA ' ' A' ' 828' ' ' LYS . 22.8 t70 57.76 31.31 20.27 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 121.554 0.692 . . . . 10.0 110.22 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 14.8 tp -125.96 128.17 47.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.155 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -104.02 105.19 15.28 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.898 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 82.3 mt -121.04 104.05 41.87 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.938 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.56 73.84 3.94 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 122.536 2.157 . . . . 10.0 111.655 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 57.3 mt -55.73 -43.14 72.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.42 -0.809 . . . . 10.0 111.932 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -64.91 -21.99 66.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.679 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -80.51 -17.21 52.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.977 0.418 . . . . 10.0 110.453 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 20.0 m0 -101.75 -43.87 5.71 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.533 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 16.1 tp -57.17 -27.6 62.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.415 -178.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -86.73 -10.5 53.52 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.841 0.311 . . . . 10.0 111.841 -179.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 42.8 mttp -111.02 -45.9 3.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.663 0.268 . . . . 10.0 111.285 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -116.3 95.15 44.52 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 121.178 0.513 . . . . 10.0 110.336 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -72.97 8.91 1.51 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.456 2.104 . . . . 10.0 112.346 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -79.45 -8.47 59.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.132 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 63.7 mt -65.43 -40.24 93.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.242 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 77.5 m-70 53.93 -97.57 0.07 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.597 -0.728 . . . . 10.0 110.833 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 732' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 736' ' ' ARG . 0.2 OUTLIER -144.55 -57.63 0.36 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -63.21 -48.75 76.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.981 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 2.3 m -60.14 -33.1 71.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.154 0.502 . . . . 10.0 110.376 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.99 -43.57 98.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.733 -0.667 . . . . 10.0 109.483 178.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 736' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 732' ' ' GLU . 71.0 mtt-85 -65.07 -47.77 76.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.199 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -57.94 -39.91 79.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.474 -0.784 . . . . 10.0 111.335 -179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 27.9 mmm-85 -62.11 -40.27 95.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.854 0.359 . . . . 10.0 110.45 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 92.2 mt -67.61 -44.35 86.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.526 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 29.1 tp -66.35 -43.14 86.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.016 -179.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.96 -42.7 94.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.803 0.335 . . . . 10.0 110.928 179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -64.88 -40.61 95.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.317 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 2.3 p -66.38 -44.6 82.67 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.865 -0.334 . . . . 10.0 110.632 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.6 -38.87 83.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 109.938 -0.393 . . . . 10.0 109.938 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.05 -54.76 42.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.392 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.421 ' HA ' ' HD3' ' A' ' 749' ' ' ARG . 97.0 t -63.65 -34.12 65.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.987 0.423 . . . . 10.0 110.576 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -60.39 -49.95 75.54 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.36 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -65.16 -31.75 73.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.556 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 749' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 746' ' ' VAL . 65.9 mtp180 -67.2 -41.34 85.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.87 -0.605 . . . . 10.0 109.695 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -66.08 -39.97 90.48 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -59.09 -39.12 81.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.053 -0.976 . . . . 10.0 111.725 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -62.43 -21.25 65.26 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.457 0.54 . . . . 10.0 112.457 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.0 t -87.63 -27.93 5.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.883 0.373 . . . . 10.0 111.463 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 6.6 t -96.77 -42.12 11.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.033 0.444 . . . . 10.0 111.259 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 125.46 130.81 3.52 Favored Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 111.158 -0.777 . . . . 10.0 111.158 -179.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 756' ' ' ALA . . . . . 0.505 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -55.12 -47.12 75.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.858 0.361 . . . . 10.0 111.707 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.13 -38.57 91.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.163 0.506 . . . . 10.0 110.663 -179.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.5 tpt -69.4 -42.31 75.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.839 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 76.8 mmm -61.12 -39.54 90.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.948 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.505 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.8 mmp_? -60.81 -39.95 90.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.266 0.555 . . . . 10.0 110.011 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 10.9 m-70 -71.11 -33.4 70.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.927 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -67.04 -46.85 73.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.687 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 79.5 mt-10 -59.6 -44.88 93.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.335 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -61.46 -41.08 96.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.173 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -66.81 -43.66 91.1 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 115.668 -0.696 . . . . 10.0 112.15 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 48.7 t -60.69 -41.45 88.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 120.678 0.275 . . . . 10.0 110.906 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 8.9 mtp -57.64 -49.12 77.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.254 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 60.4 mt -66.65 -40.41 88.67 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.235 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 769' ' ' GLN . . . . . 0.401 ' HA ' ' HE1' ' B' ' 22' ' ' MET . 2.7 tt0 -53.21 -57.12 11.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.751 -0.659 . . . . 10.0 111.312 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 3.7 m -68.72 -35.78 77.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.346 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.26 -54.27 43.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.977 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -62.19 -37.58 85.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.277 -0.419 . . . . 10.0 111.298 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 773' ' ' SER . . . . . . . . . . . . . 49.6 m -65.75 -42.45 90.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.507 -0.315 . . . . 10.0 110.816 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 62.9 mt -77.41 -23.83 50.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.611 -0.268 . . . . 10.0 110.908 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -66.14 -51.06 61.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.645 -0.252 . . . . 10.0 110.658 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.441 ' HG3' ' N ' ' A' ' 777' ' ' GLU . 13.5 ptpt -62.45 -34.24 76.41 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.805 0.336 . . . . 10.0 110.324 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 777' ' ' GLU . . . . . 0.441 ' N ' ' HG3' ' A' ' 776' ' ' LYS . 0.9 OUTLIER -70.34 -39.92 74.4 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.332 -0.618 . . . . 10.0 109.332 178.845 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -60.65 -32.42 71.6 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.929 -0.578 . . . . 10.0 109.986 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 85.0 mt -65.69 -45.81 81.4 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 178.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -67.96 -42.4 80.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.125 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -59.77 -42.93 94.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.936 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 85.1 mmm -64.39 -38.27 90.45 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.024 0.44 . . . . 10.0 109.979 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.58 -40.77 93.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.066 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -64.84 -41.92 95.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.216 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.7 tp -71.59 -35.52 70.56 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.706 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -57.25 -39.36 75.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.145 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -89.77 -32.66 16.87 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.754 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 788' ' ' GLY . . . . . 0.514 ' O ' ' HG ' ' A' ' 791' ' ' LEU . . . -74.04 -25.38 71.47 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 121.096 -0.574 . . . . 10.0 113.687 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 7.7 tp -69.29 -14.55 18.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 122.426 -0.455 . . . . 10.0 111.329 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 26.0 m170 -67.89 -30.52 69.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.833 0.349 . . . . 10.0 110.909 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 788' ' ' GLY . 0.7 OUTLIER -96.4 -2.34 45.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.022 0.439 . . . . 10.0 110.438 179.371 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 74.2 mtt180 -99.14 -9.34 23.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.155 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -81.08 79.79 1.77 Allowed Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.804 -0.635 . . . . 10.0 112.523 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -71.29 158.6 36.09 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.821 0.343 . . . . 10.0 110.637 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 795' ' ' ALA . . . . . 0.504 ' O ' ' HB2' ' A' ' 796' ' ' GLN . . . -54.87 151.26 8.82 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.771 -0.65 . . . . 10.0 112.169 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 796' ' ' GLN . . . . . 0.504 ' HB2' ' O ' ' A' ' 795' ' ' ALA . 16.9 mm100 79.82 -31.68 0.13 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.271 -0.877 . . . . 10.0 111.73 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -94.46 143.41 26.43 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.255 -0.276 . . . . 10.0 110.255 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -83.4 120.63 75.9 Favored Pre-proline 0 C--N 1.325 -0.475 0 N-CA-C 109.738 -0.468 . . . . 10.0 109.738 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.17 -26.44 64.95 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.881 2.387 . . . . 10.0 113.479 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 800' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 804' ' ' LYS . 27.4 mtpt -74.28 -46.82 38.79 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.638 -0.504 . . . . 10.0 109.638 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -65.38 -37.94 88.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.538 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -66.33 -41.28 89.85 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -57.54 -44.16 84.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.491 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 804' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 800' ' ' LYS . 95.6 mttt -62.51 -47.24 84.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.857 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 39.3 ttp85 -61.03 -47.6 85.63 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.427 -0.351 . . . . 10.0 111.238 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.26 -47.25 86.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.467 -179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 8.3 p -65.77 -39.21 90.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.495 -0.321 . . . . 10.0 111.501 -179.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -65.05 -35.65 81.85 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.873 0.368 . . . . 10.0 110.272 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 19.4 m -68.56 -40.79 80.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.206 0.527 . . . . 10.0 109.754 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 13.4 ttm -62.69 -38.42 90.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.609 -0.723 . . . . 10.0 110.241 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -65.28 -44.11 89.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.666 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.78 -49.05 77.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.612 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -61.65 -34.91 76.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.693 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 32.9 ttp -64.59 -43.61 93.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.216 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 97.3 mt -65.97 -40.59 91.38 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.409 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 816' ' ' GLU . . . . . 0.42 ' HA ' ' HE2' ' A' ' 819' ' ' LYS . 37.9 mm-40 -62.94 -39.43 94.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.591 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 19.9 m -76.58 -27.2 55.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.508 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 36.7 tp -62.76 -57.11 12.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.729 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 819' ' ' LYS . . . . . 0.42 ' HE2' ' HA ' ' A' ' 816' ' ' GLU . 53.9 pttt -61.32 -30.06 70.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 10.0 110.478 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 74.6 t80 -61.73 -56.53 18.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.817 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.55 -31.3 71.29 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.587 -0.278 . . . . 10.0 111.498 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 822' ' ' VAL . . . . . 0.64 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 36.6 t -60.63 -56.95 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 39.5 mm -63.44 -37.28 79.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 121.073 0.463 . . . . 10.0 110.03 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 824' ' ' SER . . . . . 0.505 ' O ' ' HB2' ' A' ' 828' ' ' LYS . 29.4 t -59.78 -53.83 53.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.37 179.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 98.0 m -59.99 -38.69 83.33 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.557 -0.292 . . . . 10.0 111.727 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 826' ' ' LEU . . . . . 0.64 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 94.4 mt -62.03 -29.06 70.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.92 0.39 . . . . 10.0 111.423 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 1.7 m -97.0 -27.92 14.4 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.237 0.541 . . . . 10.0 110.095 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 828' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 824' ' ' SER . 2.0 ttpt -69.8 -19.63 63.48 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.127 -0.942 . . . . 10.0 111.415 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.416 HG23 ' HB3' ' B' ' 28' ' ' ALA . 14.8 p -53.2 130.09 14.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 CA-C-O 121.213 0.53 . . . . 10.0 111.183 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 36.3 mm-40 -86.0 113.66 22.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.891 -0.595 . . . . 10.0 109.728 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 60.6 t -120.39 136.76 56.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.816 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 832' ' ' ARG . . . . . 0.511 ' O ' ' HD3' ' A' ' 834' ' ' PRO . 17.5 ptt180 -74.08 92.08 2.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.575 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 73.0 mtp -84.92 107.48 11.75 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.733 -0.469 . . . . 10.0 109.733 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.511 ' HD3' ' O ' ' A' ' 832' ' ' ARG . 86.8 Cg_endo -80.5 -154.86 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.989 2.459 . . . . 10.0 113.067 -178.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -65.04 112.46 3.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.463 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.798 -0.62 . . . . 10.0 110.314 -179.878 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.95 0.405 . . . . 10.0 110.485 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 11.7 tpt -92.62 124.07 36.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.015 0.435 . . . . 10.0 110.566 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 33.0 mt -90.22 118.28 35.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.445 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.02 91.2 1.55 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.956 0.408 . . . . 10.0 110.875 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 72.6 mt -83.55 73.98 10.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.302 0.572 . . . . 10.0 110.894 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.03 158.06 44.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.605 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -140.11 -179.48 6.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 10.0 110.54 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.521 ' NE ' ' HA ' ' B' ' 8' ' ' ARG . 1.8 mmp_? -117.7 14.83 14.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.535 -0.302 . . . . 10.0 111.254 -179.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -124.74 105.52 9.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.738 0.304 . . . . 10.0 110.566 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -88.55 149.4 23.62 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.631 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.446 ' O ' HD11 ' A' ' 291' ' ' ILE . 50.5 mt -85.0 121.42 74.2 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.704 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -82.92 34.9 0.56 Allowed 'Trans proline' 0 N--CA 1.463 -0.292 0 C-N-CA 122.716 2.277 . . . . 10.0 112.182 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 45.0 mt -92.98 -64.03 1.15 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.6 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.27 -37.37 82.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.683 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.2 m -71.24 -24.73 24.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.561 -0.29 . . . . 10.0 111.378 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.24 -33.78 73.79 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.174 0.511 . . . . 10.0 109.787 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.669 HG11 ' HB2' ' A' ' 235' ' ' MET . 57.7 t -68.47 -28.95 42.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.539 -0.755 . . . . 10.0 109.99 179.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.7 -13.59 61.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.652 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.27 -34.33 8.83 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.123 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -93.49 58.49 2.27 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.926 -0.654 . . . . 10.0 112.316 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.415 HG22 ' O ' ' B' ' 17' ' ' VAL . 0.2 OUTLIER -107.11 6.7 9.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.051 0.453 . . . . 10.0 110.576 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.401 ' HE1' ' HA ' ' A' ' 769' ' ' GLN . 1.3 ptp -112.96 -168.77 1.37 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.311 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 6.3 m -62.18 127.2 30.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.659 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.94 110.47 0.82 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.43 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -124.05 156.68 36.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.881 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.87 139.42 50.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.917 0.389 . . . . 10.0 111.199 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 22.1 ptp -124.42 177.68 5.78 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.13 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.416 ' HB3' HG23 ' A' ' 829' ' ' VAL . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.741 -0.647 . . . . 10.0 110.832 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 93.2 t . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 120.772 0.32 . . . . 10.0 110.373 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -84.02 146.8 27.77 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.7 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.66 163.65 10.68 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 111.569 -0.612 . . . . 10.0 111.569 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.72 117.64 5.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.789 0.328 . . . . 10.0 110.207 179.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -58.21 142.93 46.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.037 -0.528 . . . . 10.0 111.214 -179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 77.12 -63.16 0.38 Allowed 'General case' 0 N--CA 1.465 0.277 0 O-C-N 124.158 0.911 . . . . 10.0 111.595 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -69.29 -66.51 0.57 Allowed 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.215 0.82 . . . . 10.0 113.215 -177.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -72.57 -26.27 61.66 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -178.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 m -56.81 -45.09 82.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 10.0 111.366 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.3 mt -69.47 -28.81 66.41 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.398 -0.365 . . . . 10.0 111.731 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -71.71 -49.07 42.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.765 0.317 . . . . 10.0 110.549 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 20' ' ' ARG . 3.0 ttp85 -66.63 -37.04 84.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.406 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.594 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -64.12 -32.99 74.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.251 179.38 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 15.0 tpp180 -62.1 -36.17 80.92 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.645 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -61.9 -41.03 97.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.104 -0.498 . . . . 10.0 109.868 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 22.7 t -67.57 -36.79 77.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.999 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 21' ' ' MET . 70.2 t -59.49 -37.3 69.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.784 -0.644 . . . . 10.0 110.08 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -62.95 -43.1 99.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.894 -0.594 . . . . 10.0 109.944 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 62.4 mt -62.07 -47.12 94.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.268 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 60.5 mt -60.39 -35.9 65.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.804 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -69.38 -34.43 74.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.056 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.482 ' O ' ' HD2' ' A' ' 33' ' ' PRO . . . -77.61 -26.56 50.74 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.062 0.458 . . . . 10.0 110.744 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 45.8 mtt -79.06 -10.5 59.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.136 -0.483 . . . . 10.0 111.263 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.47 ' CD ' ' HD3' ' A' ' 72' ' ' ARG . 5.8 mt-10 -57.79 -56.89 29.88 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 119.147 -0.454 . . . . 10.0 111.632 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.482 ' HD2' ' O ' ' A' ' 30' ' ' ALA . 50.7 Cg_exo -56.0 -32.31 85.56 Favored 'Trans proline' 0 C--N 1.36 1.141 0 C-N-CA 121.803 1.669 . . . . 10.0 112.022 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -67.05 -46.62 73.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.704 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 24.6 mmt -68.51 -35.6 77.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.823 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -63.13 -29.3 70.68 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.207 0.527 . . . . 10.0 110.253 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -74.34 -31.73 62.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.609 -0.723 . . . . 10.0 109.89 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.4 mp -74.83 136.95 41.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.962 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.6 p -78.55 175.93 9.89 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.894 -0.322 . . . . 10.0 110.497 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -55.64 -51.9 65.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.213 0.449 . . . . 10.0 112.213 -178.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -63.87 -29.6 70.77 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.069 -179.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -67.93 -39.41 83.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.677 0.275 . . . . 10.0 110.308 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 72.8 mt -66.04 -40.14 90.75 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -60.75 -38.85 86.59 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.17 -0.923 . . . . 10.0 109.815 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.01 -26.14 74.11 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.466 -0.788 . . . . 10.0 112.038 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -65.48 -38.78 90.78 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.049 -0.352 . . . . 10.0 110.049 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 17.1 m -62.76 -40.23 96.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.198 0.523 . . . . 10.0 109.75 178.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.77 -35.76 77.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.64 -0.709 . . . . 10.0 110.06 178.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -62.59 -41.91 99.24 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.077 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -62.96 -39.63 95.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.231 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -59.99 -46.62 88.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.052 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.68 -38.94 80.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.782 -0.644 . . . . 10.0 111.077 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -61.39 -47.61 85.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.97 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 59.2 mt -62.97 -35.0 78.71 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.146 0.498 . . . . 10.0 110.704 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.61 -42.63 95.41 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.485 -0.78 . . . . 10.0 111.138 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.483 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -83.98 -51.08 7.42 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.005 0.372 . . . . 10.0 112.005 -179.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 171.28 88.13 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.254 -0.975 . . . . 10.0 113.006 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -149.07 148.72 30.02 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.8 t -95.79 131.44 42.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.6 tp -58.77 -41.82 87.52 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.098 0.475 . . . . 10.0 110.636 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -69.46 -11.42 60.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.878 -0.601 . . . . 10.0 111.377 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -93.45 -20.04 20.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.282 0.563 . . . . 10.0 110.371 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 67.3 mt -82.2 -10.78 59.02 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.756 -0.657 . . . . 10.0 111.557 -179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.545 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 67.4 mt -46.9 -53.33 27.17 Favored Pre-proline 0 CA--C 1.542 0.658 0 N-CA-C 113.422 0.897 . . . . 10.0 113.422 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.545 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.5 Cg_exo -54.11 -54.06 5.33 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.736 1.624 . . . . 10.0 113.067 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.431 ' O ' HG23 ' A' ' 70' ' ' VAL . 42.5 mt-10 -68.08 -43.67 78.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.032 -0.531 . . . . 10.0 112.108 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.524 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -62.18 -50.28 72.43 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.805 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -63.08 -33.0 74.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.772 -179.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.78 -45.4 86.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.484 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 66' ' ' GLU . 96.5 t -61.93 -46.68 95.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.134 -0.485 . . . . 10.0 110.211 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 67' ' ' ALA . 45.3 t -60.82 -45.77 97.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.035 -0.53 . . . . 10.0 110.208 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.47 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 5.3 ttm180 -59.45 -43.74 93.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.593 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 -62.88 -47.43 83.35 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.877 -0.601 . . . . 10.0 110.116 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.5 -30.33 71.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.849 -0.614 . . . . 10.0 111.124 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 19.9 m -61.78 -35.62 78.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.756 0.313 . . . . 10.0 111.185 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.494 ' O ' ' HA2' ' A' ' 80' ' ' GLY . 51.2 mtmt -76.41 -28.85 56.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.532 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.7 mtt180 -88.28 -43.81 11.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.352 -0.386 . . . . 10.0 111.931 -178.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 90.4 t -77.11 -62.81 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.828 0.347 . . . . 10.0 111.694 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -83.05 -41.6 18.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.498 -0.319 . . . . 10.0 111.384 -178.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.494 ' HA2' ' O ' ' A' ' 76' ' ' LYS . . . 100.33 29.58 6.65 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.888 -0.672 . . . . 10.0 111.868 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 47.1 ttm -144.27 127.95 17.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.701 0.286 . . . . 10.0 110.39 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 29.4 ttp85 -71.48 126.23 29.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.202 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.38 117.46 3.84 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.803 -0.443 . . . . 10.0 109.803 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -57.06 147.16 25.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.315 0.578 . . . . 10.0 111.636 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -63.89 -32.52 74.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.198 -0.91 . . . . 10.0 111.79 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.67 -26.64 31.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.033 0.444 . . . . 10.0 110.728 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.52 HE22 HD23 ' A' ' 110' ' ' LEU . 92.9 mt-30 -74.14 -31.05 62.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.265 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.405 HD11 ' CZ ' ' A' ' 72' ' ' ARG . 92.8 mt -63.45 -37.65 88.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.153 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.0 mt -65.04 -49.53 69.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.426 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -64.51 -44.68 94.82 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.733 -0.667 . . . . 10.0 112.554 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -64.33 -31.23 80.17 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 121.082 -0.58 . . . . 10.0 112.566 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.594 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 16.3 ttm -70.14 -37.74 75.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.763 0.316 . . . . 10.0 110.69 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 91.8 t -72.87 -29.14 28.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.149 0.5 . . . . 10.0 110.198 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 mt -70.63 -5.57 30.46 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.715 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -80.41 -25.74 38.86 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.03 -0.729 . . . . 10.0 109.03 178.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -93.96 177.49 5.97 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.319 -0.855 . . . . 10.0 110.179 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.587 ' HG2' ' CD2' ' A' ' 407' ' ' LEU . 13.7 ttt85 -86.57 75.36 9.73 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.097 -0.501 . . . . 10.0 109.708 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 85.6 m -147.94 174.94 11.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.114 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.445 HD12 HG11 ' A' ' 211' ' ' VAL . 40.9 mm -112.72 134.39 55.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.619 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -112.36 119.73 39.28 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.869 0.366 . . . . 10.0 111.375 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -89.89 106.05 18.21 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.269 -0.641 . . . . 10.0 109.269 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.422 ' O ' ' HA2' ' A' ' 392' ' ' GLY . 35.4 ttm -103.3 151.47 22.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.095 0.474 . . . . 10.0 110.665 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.505 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 0.2 OUTLIER -85.52 149.68 25.21 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.758 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.78 107.28 5.13 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.982 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 133.66 -25.66 3.56 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.775 -0.726 . . . . 10.0 112.705 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.609 ' OE2' ' HA ' ' A' ' 578' ' ' GLN . 1.2 mm-40 -74.31 -21.17 59.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.818 0.342 . . . . 10.0 110.983 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.33 85.39 1.87 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.638 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.498 ' HD2' ' SD ' ' A' ' 390' ' ' MET . 8.4 mtmt -62.97 -65.88 0.62 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.925 0.393 . . . . 10.0 111.852 -179.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -60.09 -30.03 68.98 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.162 0.43 . . . . 10.0 112.162 -178.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.52 HD23 HE22 ' A' ' 87' ' ' GLN . 35.0 tp -68.01 -25.82 65.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.787 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 60.6 m -89.69 -28.95 19.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.008 0.432 . . . . 10.0 111.07 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.12 -11.46 49.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.976 -0.556 . . . . 10.0 112.492 -179.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 14.9 p -74.98 -23.73 58.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.797 0.332 . . . . 10.0 111.622 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 38.1 mt -68.24 -57.87 8.34 Favored Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -65.46 -26.64 54.93 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.888 1.725 . . . . 10.0 112.098 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -67.67 -48.44 66.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.822 -0.627 . . . . 10.0 110.784 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.426 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 55.2 t80 -60.85 -45.4 94.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.644 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 32.0 tp -59.87 -52.34 65.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.691 -0.686 . . . . 10.0 112.02 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -70.49 -20.62 62.84 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 111.971 0.36 . . . . 10.0 111.971 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.546 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -73.52 -27.59 61.45 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.497 -0.32 . . . . 10.0 110.743 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 69.3 mt -57.49 -35.5 70.29 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.985 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -20.84 66.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.71 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 70.41 25.76 75.19 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.926 -0.654 . . . . 10.0 112.677 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -96.41 -10.88 26.58 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.736 0.303 . . . . 10.0 110.932 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 94.3 112.66 2.41 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.728 -0.749 . . . . 10.0 113.343 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 57.5 t -88.21 113.57 25.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.428 -0.582 . . . . 10.0 109.428 178.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -89.52 100.4 13.2 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.971 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 29.8 t -91.59 114.44 28.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.975 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 54.8 t -97.69 118.49 44.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.508 -179.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.43 148.54 34.15 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.629 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 6.8 m -59.66 -31.55 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 112.191 0.441 . . . . 10.0 112.191 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -149.92 166.09 30.65 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.667 0.27 . . . . 10.0 110.801 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -72.64 -23.47 60.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.696 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -55.8 -54.56 43.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.691 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.3 mt -73.72 -35.87 65.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.564 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.64 -52.3 64.29 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.077 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -69.28 -39.47 78.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.398 -0.364 . . . . 10.0 110.601 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 138' ' ' ARG . 4.1 ttp85 -53.83 -55.64 24.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.134 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.93 -28.94 61.76 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.741 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.81 85.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.967 0.413 . . . . 10.0 110.783 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -90.54 -32.17 16.43 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.051 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -68.42 -42.62 78.68 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.933 0.397 . . . . 10.0 111.291 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -89.51 2.91 53.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.222 -0.444 . . . . 10.0 111.105 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.457 ' HB3' ' HD3' ' A' ' 145' ' ' PRO . 56.3 ttm-85 -63.62 -48.18 81.08 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.79 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' PRO . . . . . 0.457 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 16.3 Cg_exo -68.73 8.73 0.52 Allowed 'Trans proline' 0 C--N 1.361 1.216 0 C-N-CA 122.21 1.94 . . . . 10.0 112.618 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.7 tp -111.59 -57.84 2.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.138 -0.483 . . . . 10.0 109.863 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -71.11 -49.43 44.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.65 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.13 -13.51 62.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.23 0.538 . . . . 10.0 110.601 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -78.62 -39.81 36.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.901 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 92.4 mt -81.86 -37.75 26.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.405 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 139.26 29.15 0.22 Allowed Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.075 -1.06 . . . . 10.0 113.277 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 88.8 mt -119.94 123.2 42.97 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.62 127.43 32.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.19 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.407 ' HB ' ' NH1' ' A' ' 144' ' ' ARG . 14.7 t -104.68 107.02 21.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.474 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -105.31 143.23 15.64 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.841 -0.695 . . . . 10.0 111.999 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.4 tp -117.02 123.71 72.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.051 0.453 . . . . 10.0 110.544 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -101.69 115.19 29.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.134 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 85.2 mt -103.99 144.86 29.54 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.035 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' PRO . . . . . 0.514 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 23.5 Cg_endo -62.06 112.52 1.55 Allowed 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.623 2.215 . . . . 10.0 111.937 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 96.99 8.7 56.7 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.874 -0.679 . . . . 10.0 112.434 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 43.3 ttm -68.31 135.93 91.18 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.428 -0.212 . . . . 10.0 110.428 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -50.45 144.29 24.97 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.799 2.333 . . . . 10.0 112.573 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . 0.441 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -52.46 -48.24 90.58 Favored Pre-proline 0 CA--C 1.54 0.573 0 N-CA-C 113.359 0.874 . . . . 10.0 113.359 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.441 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.4 Cg_exo -57.1 -33.36 95.65 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 121.789 1.659 . . . . 10.0 112.584 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -77.44 -38.99 48.29 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -59.61 -42.99 93.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.797 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 78.6 mtt180 -58.81 -32.9 69.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.437 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -75.72 -38.33 58.62 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.893 0.378 . . . . 10.0 110.417 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.27 -38.69 88.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.628 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -79.58 -24.28 42.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.194 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -75.24 -11.82 60.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.139 0.495 . . . . 10.0 110.285 179.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -72.69 173.33 9.18 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.471 -0.786 . . . . 10.0 110.28 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . 0.546 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 5.1 m-20 -77.36 -36.01 54.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.088 0.47 . . . . 10.0 109.826 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 76.1 mt -130.02 128.3 64.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.911 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 9.4 m -119.4 117.54 28.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.915 0.388 . . . . 10.0 111.527 -179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -94.29 133.06 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.638 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -167.61 164.68 38.12 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.126 -1.035 . . . . 10.0 113.131 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.56 150.11 28.33 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 122.275 0.23 . . . . 10.0 110.972 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -57.98 -41.07 82.2 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.092 0.404 . . . . 10.0 112.092 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.83 -51.81 66.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.506 -0.315 . . . . 10.0 111.261 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.514 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 4.4 tp10 -64.33 -36.96 85.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.954 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.28 -34.84 72.75 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.019 0.438 . . . . 10.0 110.543 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -77.66 -41.16 20.48 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 111.298 -0.721 . . . . 10.0 111.298 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -62.44 -39.47 93.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.339 . . . . 10.0 110.485 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -61.26 -41.78 97.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.119 -0.492 . . . . 10.0 110.579 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -64.16 -35.96 82.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.178 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' LEU . . . . . . . . . . . . . 62.5 mt -68.95 -42.88 76.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.666 -0.697 . . . . 10.0 110.29 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 62.3 mtm-85 -67.04 -41.36 86.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.559 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.82 -39.92 90.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.758 -0.656 . . . . 10.0 110.731 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -83.86 7.97 16.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.623 -0.717 . . . . 10.0 111.694 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.98 5.27 13.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.909 0.385 . . . . 10.0 110.736 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -78.34 168.32 20.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.242 -0.436 . . . . 10.0 110.629 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -110.45 -24.29 10.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.208 0.528 . . . . 10.0 110.271 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.89 138.36 30.41 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.46 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 667' ' ' LEU . 16.1 Cg_endo -59.05 -23.31 68.2 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.628 2.218 . . . . 10.0 112.377 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -77.49 -7.07 55.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 10.0 111.246 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 60.2 mt-10 -94.36 0.2 55.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.8 0.333 . . . . 10.0 110.476 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 198' ' ' ARG . 43.6 mtt85 -62.88 158.84 18.04 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.681 -0.691 . . . . 10.0 112.151 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 16.7 m -134.8 -19.21 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.908 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -84.93 175.77 8.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.218 0.532 . . . . 10.0 111.654 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.43 -179.19 5.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.6 -0.727 . . . . 10.0 109.67 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 12.4 tppt? -61.73 129.75 42.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.026 0.441 . . . . 10.0 111.05 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . 0.4 ' HB3' ' CD2' ' A' ' 384' ' ' TYR . 22.3 mt -84.11 63.51 7.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.387 0.613 . . . . 10.0 110.154 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -80.3 -53.42 6.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.738 -0.665 . . . . 10.0 112.03 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -130.97 137.58 49.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.981 0.42 . . . . 10.0 111.416 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.588 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -133.13 121.3 22.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.416 -0.811 . . . . 10.0 109.703 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 57.7 tp -122.91 113.48 19.16 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.703 -0.48 . . . . 10.0 109.703 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' VAL . . . . . 0.468 HG22 ' H ' ' A' ' 210' ' ' GLU . 9.0 p -97.0 139.34 19.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.594 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.73 -27.61 62.15 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.591 -179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' GLU . . . . . 0.541 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 4.4 tp10 -145.76 134.09 21.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.113 0.482 . . . . 10.0 110.954 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.652 HG22 ' HB ' ' A' ' 391' ' ' THR . 3.4 m -102.37 -17.95 6.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.335 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . 0.401 ' OD1' ' HD2' ' A' ' 566' ' ' ARG . 3.8 t70 -60.04 -68.41 0.29 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.52 -0.764 . . . . 10.0 111.574 -179.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.433 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 0.8 OUTLIER -84.58 22.57 1.28 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.561 0.578 . . . . 10.0 112.561 -178.22 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 45.4 mt -138.05 -66.22 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 112.545 0.572 . . . . 10.0 112.545 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 215' ' ' LEU . . . . . . . . . . . . . 27.0 mt -70.28 -46.05 65.12 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.495 0.554 . . . . 10.0 112.495 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 50.8 mm -85.51 -47.36 16.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.882 -0.327 . . . . 10.0 111.759 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 217' ' ' ASP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 0.3 OUTLIER -69.98 -59.63 2.79 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -178.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -85.38 46.59 1.31 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.005 0.431 . . . . 10.0 111.78 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -76.51 -53.19 8.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.246 -0.434 . . . . 10.0 111.389 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 220' ' ' ARG . . . . . 0.458 ' O ' ' HD3' ' A' ' 220' ' ' ARG . 0.2 OUTLIER -105.85 46.68 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.227 0.537 . . . . 10.0 110.837 -179.08 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 2.9 m -107.55 102.44 44.52 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.583 178.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -88.83 132.44 2.41 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.802 2.335 . . . . 10.0 113.578 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 223' ' ' LEU . . . . . . . . . . . . . 96.7 mt -82.62 93.12 7.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.147 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 29.2 mt -92.74 125.8 45.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.051 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 225' ' ' ILE . . . . . 0.476 ' HB ' HD23 ' A' ' 372' ' ' LEU . 2.6 mt -127.88 144.19 38.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.416 -0.587 . . . . 10.0 109.416 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 226' ' ' SER . . . . . 0.456 ' HA ' ' O ' ' A' ' 370' ' ' GLN . 1.2 m -87.63 155.07 20.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.522 0.201 . . . . 10.0 110.699 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -86.41 164.08 36.13 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.018 -0.61 . . . . 10.0 113.201 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -84.95 -19.27 4.0 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.784 2.323 . . . . 10.0 113.3 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 229' ' ' ALA . . . . . 0.547 ' O ' ' HA ' ' B' ' 21' ' ' VAL . . . -118.27 47.23 1.64 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.896 0.379 . . . . 10.0 111.559 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . 0.657 ' HA ' HG22 ' B' ' 21' ' ' VAL . 49.4 mm-40 -70.33 171.47 9.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.901 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 21.8 t0 -71.43 138.55 49.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 110.021 -0.362 . . . . 10.0 110.021 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . . . . . . . . . 7.0 m -128.1 -34.21 2.13 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.974 179.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 233' ' ' SER . . . . . 0.409 ' HA ' HD12 ' A' ' 365' ' ' ILE . 49.2 m -166.12 58.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.024 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -155.68 -58.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.305 -0.558 . . . . 10.0 112.39 179.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -60.23 3.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.543 0.211 . . . . 10.0 111.127 -178.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -64.57 -27.66 69.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.917 0.389 . . . . 10.0 110.57 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 12.4 ttmt -66.2 -41.87 89.57 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.481 -0.563 . . . . 10.0 109.481 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 7.8 tpp180 -68.04 -33.05 73.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.541 -0.754 . . . . 10.0 110.746 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 77.2 t -67.83 -46.4 82.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.813 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -77.71 -5.29 50.06 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.339 -0.391 . . . . 10.0 111.228 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 5.4 tptt -70.46 -21.02 62.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.366 -0.379 . . . . 10.0 111.316 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 15.2 tt -89.06 -14.07 9.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.89 0.376 . . . . 10.0 111.203 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 243' ' ' ILE . . . . . 0.518 ' N ' ' HD2' ' A' ' 244' ' ' PRO . 48.2 mm -61.39 -49.59 86.92 Favored Pre-proline 0 CA--C 1.54 0.582 0 N-CA-C 113.247 0.832 . . . . 10.0 113.247 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 244' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 243' ' ' ILE . 19.0 Cg_endo -59.58 -10.91 12.53 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 122.332 2.021 . . . . 10.0 113.337 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -88.16 -24.39 23.35 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.863 0.363 . . . . 10.0 110.218 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 246' ' ' LEU . . . . . 0.484 HD22 ' OD1' ' A' ' 253' ' ' ASP . 13.7 mt -73.18 139.32 46.23 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.673 -0.694 . . . . 10.0 112.567 -177.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 3.8 mt -127.69 105.18 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 108.368 -0.975 . . . . 10.0 108.368 178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 248' ' ' ARG . . . . . 0.615 ' HA ' ' O ' ' A' ' 253' ' ' ASP . 7.1 ttt180 -42.36 106.8 0.07 Allowed 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 112.827 0.677 . . . . 10.0 112.827 -178.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 29.7 tp60 -179.55 -61.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.222 -0.899 . . . . 10.0 110.152 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 250' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -162.71 -166.48 1.34 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.234 -0.654 . . . . 10.0 109.234 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.471 ' H ' ' HG ' ' A' ' 281' ' ' LEU . 62.4 mttm 60.55 40.25 17.07 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 123.306 0.378 . . . . 10.0 111.283 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 252' ' ' GLU . . . . . 0.499 ' OE2' ' HB3' ' A' ' 281' ' ' LEU . 6.0 mm-40 78.4 -11.15 1.24 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.034 0.934 . . . . 10.0 111.009 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 253' ' ' ASP . . . . . 0.615 ' O ' ' HA ' ' A' ' 248' ' ' ARG . 15.8 m-20 -78.12 53.54 1.22 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.991 0.424 . . . . 10.0 110.045 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.11 143.95 26.34 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.377 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.68 -22.07 22.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.213 0.53 . . . . 10.0 109.659 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.77 -92.97 0.12 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.04 178.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 46.35 -113.22 0.43 Allowed 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.918 0.761 . . . . 10.0 111.517 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 258' ' ' GLN . . . . . 0.406 ' OE1' ' HB ' ' A' ' 275' ' ' THR . 32.4 mt-30 57.67 31.29 20.17 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 122.817 0.447 . . . . 10.0 111.98 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 111.56 -59.83 0.35 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.824 -0.703 . . . . 10.0 112.551 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.25 -71.63 0.46 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.874 0.369 . . . . 10.0 111.191 -179.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 75.82 -127.17 8.82 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.651 -0.785 . . . . 10.0 112.267 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -175.66 143.63 0.62 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.935 -0.765 . . . . 10.0 108.935 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -64.0 145.64 55.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.601 -0.518 . . . . 10.0 109.601 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 1.7 p -53.34 108.93 0.38 Allowed 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.515 0.51 . . . . 10.0 112.208 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 265' ' ' VAL . . . . . 0.403 ' O ' ' HB3' ' A' ' 266' ' ' ASP . 9.8 p -160.76 29.5 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.669 -0.696 . . . . 10.0 109.893 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 266' ' ' ASP . . . . . 0.403 ' HB3' ' O ' ' A' ' 265' ' ' VAL . 37.8 t70 69.58 43.03 1.04 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 122.471 1.129 . . . . 10.0 108.17 -178.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 267' ' ' GLU . 10.9 pm0 -71.36 125.73 27.77 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.337 -1.302 . . . . 10.0 110.768 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 268' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -133.48 146.03 50.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.461 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 3.6 m -76.89 67.6 2.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.007 0.432 . . . . 10.0 110.745 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 270' ' ' ARG . . . . . 0.516 HH21 ' CD ' ' A' ' 338' ' ' GLU . 16.0 tpt180 -67.81 -26.66 66.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.672 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -93.2 3.4 55.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.027 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 58.5 t 67.64 -77.99 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.801 -179.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 4.9 m120 68.22 -64.51 0.29 Allowed 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.605 0.762 . . . . 10.0 112.402 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 28.3 tp 72.26 -65.87 0.33 Allowed 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.448 0.699 . . . . 10.0 110.325 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 275' ' ' THR . . . . . 0.504 HG22 ' NE ' ' A' ' 277' ' ' ARG . 2.2 m 73.51 -57.24 0.63 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.372 0.669 . . . . 10.0 112.07 179.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 63.33 108.69 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.095 0.776 . . . . 10.0 113.095 178.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 277' ' ' ARG . . . . . 0.504 ' NE ' HG22 ' A' ' 275' ' ' THR . 6.1 ptp180 178.06 167.83 0.75 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.066 177.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.401 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . 124.11 -48.99 0.92 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.791 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.497 ' O ' HG22 ' A' ' 282' ' ' ILE . 15.0 mt 69.97 -63.18 0.4 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.446 0.698 . . . . 10.0 112.226 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.67 -26.69 32.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.165 0.507 . . . . 10.0 111.066 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 281' ' ' LEU . . . . . 0.499 ' HB3' ' OE2' ' A' ' 252' ' ' GLU . 5.5 mp -67.72 -52.32 39.09 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.923 -0.581 . . . . 10.0 110.798 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 282' ' ' ILE . . . . . 0.497 HG22 ' O ' ' A' ' 279' ' ' LEU . 13.1 tt -65.94 -18.35 23.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.691 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -63.87 -25.92 68.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.987 0.423 . . . . 10.0 110.68 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -90.19 -24.98 20.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.534 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 19.1 tp -77.35 -36.74 53.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.068 0.461 . . . . 10.0 110.341 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 286' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 298' ' ' LEU . 48.3 mt -71.95 -179.45 2.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.551 -0.749 . . . . 10.0 111.634 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 287' ' ' VAL . . . . . 0.517 HG12 ' H ' ' A' ' 288' ' ' LYS . 2.9 t 64.36 169.32 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-N 115.503 -0.771 . . . . 10.0 111.304 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 288' ' ' LYS . . . . . 0.517 ' H ' HG12 ' A' ' 287' ' ' VAL . 0.0 OUTLIER 77.03 152.16 0.13 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.984 0.914 . . . . 10.0 112.738 178.572 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 69.14 -70.63 0.13 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 114.814 -1.085 . . . . 10.0 113.012 179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . 170.34 161.75 21.43 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.696 -0.764 . . . . 10.0 111.767 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 291' ' ' ILE . . . . . . . . . . . . . 32.1 mt 72.45 -66.19 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 123.04 0.536 . . . . 10.0 110.19 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -73.77 -13.47 60.96 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.489 -0.559 . . . . 10.0 109.489 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 293' ' ' ASP . . . . . 0.512 ' HA ' ' HA ' ' A' ' 287' ' ' VAL . 0.6 OUTLIER -79.19 -9.32 59.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.173 -179.622 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.55 -20.51 62.79 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.131 0.491 . . . . 10.0 110.677 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . 91.14 50.77 2.74 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.782 -0.723 . . . . 10.0 111.391 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -127.57 173.39 9.92 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.28 171.38 15.26 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.283 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.627 ' O ' ' HB2' ' A' ' 307' ' ' MET . 18.2 tp -101.93 -35.23 9.06 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.014 0.435 . . . . 10.0 110.198 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -98.46 24.57 7.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.802 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 1.8 p -76.91 160.4 76.57 Favored Pre-proline 0 C--N 1.326 -0.422 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -56.44 -20.2 32.12 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.903 2.402 . . . . 10.0 113.605 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -96.84 -47.53 5.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.759 0.314 . . . . 10.0 111.585 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -86.43 9.11 19.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.022 0.439 . . . . 10.0 111.581 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 8.9 tp -59.42 -26.13 33.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.092 -0.504 . . . . 10.0 111.621 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 13.3 tmm? -63.62 -46.03 87.6 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.08 -41.41 81.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.09 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 307' ' ' MET . . . . . 0.627 ' HB2' ' O ' ' A' ' 298' ' ' LEU . 17.6 tpt -54.3 -49.36 69.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.17 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -69.42 -24.2 63.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.26 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 2.9 m170 -80.69 -38.54 28.74 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.083 -0.247 . . . . 10.0 111.173 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 28.9 m -70.01 -25.1 27.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 109.899 -0.408 . . . . 10.0 109.899 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 32.7 m -62.86 -34.21 76.88 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.273 0.558 . . . . 10.0 109.571 178.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 312' ' ' ALA . . . . . 0.472 ' HA ' ' HG2' ' A' ' 315' ' ' ARG . . . -65.2 -36.77 85.24 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.395 -0.821 . . . . 10.0 110.546 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -70.98 -36.84 72.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.725 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 5.3 mp -67.82 -48.39 66.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.641 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 315' ' ' ARG . . . . . 0.472 ' HG2' ' HA ' ' A' ' 312' ' ' ALA . 4.8 ptp85 -63.43 -28.93 70.31 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.766 0.317 . . . . 10.0 110.547 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -73.82 -3.8 30.89 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.771 0.285 . . . . 10.0 111.771 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 317' ' ' HIS . . . . . 0.51 ' CE1' HG21 ' A' ' 243' ' ' ILE . 51.8 m80 -119.71 -2.19 10.45 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.016 0.376 . . . . 10.0 112.016 -179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -135.97 -37.7 0.72 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.927 -0.309 . . . . 10.0 111.812 -179.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -88.29 -37.92 15.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.308 -0.405 . . . . 10.0 110.18 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -105.57 106.08 16.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.046 0.45 . . . . 10.0 111.502 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.41 130.01 46.45 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.148 179.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 322' ' ' ARG . . . . . 0.44 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 33.2 ttp180 -71.96 153.23 41.95 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 121.023 -0.271 . . . . 10.0 110.892 -179.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 323' ' ' ASP . . . . . 0.44 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 6.3 m-20 75.13 8.37 4.03 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.864 0.727 . . . . 10.0 111.538 178.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 4.8 p -148.85 -47.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.628 -0.26 . . . . 10.0 110.606 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -91.08 -30.12 16.93 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.392 0.615 . . . . 10.0 110.018 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -154.43 150.53 27.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.598 -0.728 . . . . 10.0 109.706 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 18.4 tt -125.2 125.24 68.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-O 121.214 0.53 . . . . 10.0 110.372 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 38.3 t -94.08 101.79 12.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.026 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 329' ' ' LYS . . . . . 0.448 ' O ' ' HG3' ' A' ' 329' ' ' LYS . 3.1 ptmm? -110.04 106.53 16.07 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.843 0.354 . . . . 10.0 110.598 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 39.35 61.96 1.24 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.191 -0.913 . . . . 10.0 113.246 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 331' ' ' GLY . . . . . 0.435 ' HA2' HG12 ' A' ' 363' ' ' VAL . . . 93.28 -39.51 2.95 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.889 -0.672 . . . . 10.0 113.991 178.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -81.72 118.63 23.0 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.137 0.494 . . . . 10.0 111.828 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 42.9 t -96.98 99.12 8.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.716 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 68.5 mt -91.45 135.04 28.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.899 -0.592 . . . . 10.0 110.711 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 5.2 mp -84.85 132.86 30.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.595 -0.52 . . . . 10.0 109.595 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 13.8 t -111.71 126.84 69.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 121.031 0.443 . . . . 10.0 110.96 -179.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 337' ' ' ASP . . . . . 0.4 ' HB3' ' H ' ' A' ' 342' ' ' ARG . 3.3 t70 -72.78 119.49 17.08 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.749 -0.66 . . . . 10.0 109.965 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 338' ' ' GLU . . . . . 0.516 ' CD ' HH21 ' A' ' 270' ' ' ARG . 4.8 tt0 -72.98 -9.66 58.96 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.922 -0.581 . . . . 10.0 112.507 -178.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -81.6 -49.72 10.19 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.863 -0.523 . . . . 10.0 111.967 -178.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.38 14.5 6.09 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.775 0.657 . . . . 10.0 112.775 -178.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 61.93 53.49 42.58 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.498 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . 0.4 ' H ' ' HB3' ' A' ' 337' ' ' ASP . 2.9 tpp180 -100.89 117.46 35.0 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.667 0.27 . . . . 10.0 111.128 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.24 105.19 14.0 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.376 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 62.6 mtm -112.23 104.94 13.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.875 0.369 . . . . 10.0 111.038 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -78.45 -36.92 44.78 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.604 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -87.85 63.75 3.76 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.854 -0.688 . . . . 10.0 112.134 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -137.97 106.28 5.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.802 0.334 . . . . 10.0 110.414 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -100.14 116.49 32.27 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.984 0.421 . . . . 10.0 111.029 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -98.92 131.57 44.9 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.074 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 1.4 m -79.42 -173.79 3.89 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.608 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 12.5 t70 58.72 23.06 10.69 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.361 0.664 . . . . 10.0 111.561 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 352' ' ' GLY . . . . . 0.415 ' HA2' ' HB2' ' A' ' 355' ' ' GLN . . . 60.03 31.24 72.05 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.823 -0.626 . . . . 10.0 112.703 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.59 -47.62 66.79 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.127 0.417 . . . . 10.0 112.127 -179.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 354' ' ' HIS . . . . . 0.455 ' O ' ' HB ' ' A' ' 357' ' ' VAL . 20.2 p80 -112.12 5.13 18.39 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.436 -0.506 . . . . 10.0 111.572 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 355' ' ' GLN . . . . . 0.415 ' HB2' ' HA2' ' A' ' 352' ' ' GLY . 0.5 OUTLIER -68.05 -38.93 83.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.02 0.438 . . . . 10.0 110.716 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -74.16 -17.75 60.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.22 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 357' ' ' VAL . . . . . 0.455 ' HB ' ' O ' ' A' ' 354' ' ' HIS . 54.2 t -67.49 -39.05 81.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.685 179.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.429 ' CB ' ' HA ' ' A' ' 365' ' ' ILE . 1.8 mt-10 -62.59 -32.99 74.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.61 179.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -83.13 -26.44 30.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.305 0.574 . . . . 10.0 110.653 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 70.0 tttt -71.17 -41.9 69.78 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.261 -0.882 . . . . 10.0 110.474 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -91.87 -170.2 2.49 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.058 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -101.19 64.43 0.52 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.827 -0.701 . . . . 10.0 111.797 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 363' ' ' VAL . . . . . 0.435 HG12 ' HA2' ' A' ' 331' ' ' GLY . 5.9 m -137.73 -166.19 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.698 0.285 . . . . 10.0 110.653 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -108.82 134.03 52.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.689 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 365' ' ' ILE . . . . . 0.429 ' HA ' ' CB ' ' A' ' 358' ' ' GLU . 2.9 mt -69.61 140.38 18.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.56 -0.533 . . . . 10.0 109.56 179.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -65.6 158.77 26.3 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.745 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -76.24 57.78 1.18 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.947 -179.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 368' ' ' GLU . . . . . 0.468 ' HB2' ' HB3' ' A' ' 230' ' ' GLU . 1.4 tm-20 45.64 -152.54 0.05 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.494 0.717 . . . . 10.0 111.472 -179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -157.64 -32.16 0.08 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.633 0.254 . . . . 10.0 111.337 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 370' ' ' GLN . . . . . 0.456 ' O ' ' HA ' ' A' ' 226' ' ' SER . 0.0 OUTLIER -117.92 -110.72 0.35 Allowed 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.678 -0.409 . . . . 10.0 111.738 -179.241 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 371' ' ' THR . . . . . 0.546 HG21 HG21 ' B' ' 21' ' ' VAL . 0.2 OUTLIER 57.04 -147.68 0.52 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 122.981 0.512 . . . . 10.0 112.042 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 372' ' ' LEU . . . . . 0.476 HD23 ' HB ' ' A' ' 225' ' ' ILE . 23.4 tp 55.57 -97.2 0.07 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.983 0.913 . . . . 10.0 112.471 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -164.1 172.32 13.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.705 0.288 . . . . 10.0 110.735 -178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 374' ' ' SER . . . . . . . . . . . . . 8.8 t -164.22 161.84 22.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.239 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . . . . . . . . . 15.6 tt -157.73 148.46 9.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.38 . . . . 10.0 110.489 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.14 143.06 29.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.619 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -56.06 -50.64 70.4 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 123.126 0.266 . . . . 10.0 111.356 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -53.45 -47.64 69.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.101 -0.499 . . . . 10.0 111.402 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -67.18 -31.11 71.28 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.202 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -70.27 -41.42 73.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.509 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -72.78 -19.26 61.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.047 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 72.1 mtp180 -77.12 -5.85 50.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.735 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.417 HD21 HH22 ' A' ' 656' ' ' ARG . 47.1 mt -96.79 7.58 46.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.798 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.588 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 21.2 m-85 -99.51 151.36 21.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.733 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -78.95 -76.36 0.2 Allowed 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.804 -0.443 . . . . 10.0 109.804 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 76.1 mttt -90.41 90.3 7.97 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.412 ' H ' ' HG3' ' A' ' 97' ' ' ARG . 57.7 tp -95.73 109.55 21.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.768 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -125.66 154.08 42.88 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.692 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -155.24 143.97 10.5 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.539 -0.839 . . . . 10.0 112.192 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 390' ' ' MET . . . . . 0.498 ' SD ' ' HD2' ' A' ' 108' ' ' LYS . 33.4 ttm -114.0 128.93 56.61 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 391' ' ' THR . . . . . 0.652 ' HB ' HG22 ' A' ' 211' ' ' VAL . 5.7 t -122.75 -175.35 3.14 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 121.147 -0.221 . . . . 10.0 110.574 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 392' ' ' GLY . . . . . 0.422 ' HA2' ' O ' ' A' ' 102' ' ' MET . . . -103.4 165.54 15.8 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 110.979 -0.848 . . . . 10.0 110.979 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 393' ' ' THR . . . . . 0.454 ' OG1' ' HA ' ' A' ' 103' ' ' ARG . 1.0 OUTLIER -62.17 103.46 0.38 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.845 0.355 . . . . 10.0 111.074 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -151.61 -27.97 0.18 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.471 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 18.2 t70 54.39 -118.93 1.38 Allowed 'General case' 0 CA--C 1.535 0.377 0 O-C-N 123.374 0.421 . . . . 10.0 110.318 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 4.7 m 64.74 -96.66 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.844 0.683 . . . . 10.0 112.844 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -81.62 36.87 0.45 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.912 0.387 . . . . 10.0 111.452 -178.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -64.5 -20.14 66.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.081 0.467 . . . . 10.0 110.961 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -81.74 -24.73 35.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.128 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -65.44 -38.3 89.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.733 0.302 . . . . 10.0 110.983 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -57.97 -47.26 83.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.171 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 4.9 m -75.83 -9.19 58.4 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.503 0.557 . . . . 10.0 112.503 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.2 m -102.77 -53.24 2.9 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.01 0.374 . . . . 10.0 112.01 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 60.3 mt -82.58 -50.41 15.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 112.809 0.67 . . . . 10.0 112.809 -177.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -94.97 -8.82 35.82 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm 62.09 43.34 8.91 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.834 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 407' ' ' LEU . . . . . 0.587 ' CD2' ' HG2' ' A' ' 97' ' ' ARG . 14.6 mt -117.66 140.92 49.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.36 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -88.98 128.85 35.71 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 110.067 -0.345 . . . . 10.0 110.067 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 2.1 m -87.13 101.2 13.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.984 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 38.2 t -96.57 133.86 36.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.607 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 15.3 t -88.68 122.23 39.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.934 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 48.6 t -87.22 130.15 48.95 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.219 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.83 150.21 86.06 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.719 2.279 . . . . 10.0 112.336 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 17.4 p -79.83 157.73 26.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.881 -0.599 . . . . 10.0 111.426 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -66.75 -40.46 88.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.334 0.588 . . . . 10.0 109.708 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 69.5 mtm180 -125.49 153.47 72.51 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.764 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -63.46 117.93 4.87 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.368 2.045 . . . . 10.0 111.413 178.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 30.9 mtm -66.33 114.14 5.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.273 -0.421 . . . . 10.0 111.557 -179.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 419' ' ' ILE . . . . . 0.476 ' HB ' ' HA ' ' A' ' 581' ' ' ALA . 0.7 OUTLIER -96.37 41.89 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.385 -0.598 . . . . 10.0 109.385 179.317 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -81.37 101.11 9.61 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.441 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -76.98 100.16 5.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.482 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -80.03 131.51 35.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.797 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 40.2 mt -116.04 149.14 42.87 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.514 -0.55 . . . . 10.0 109.514 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -62.47 169.21 8.54 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 122.85 2.367 . . . . 10.0 113.712 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -86.54 116.12 24.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.374 -0.83 . . . . 10.0 109.857 179.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 426' ' ' LEU . 25.2 mt -92.28 88.22 6.37 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.181 0.515 . . . . 10.0 110.273 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 15.8 t -83.38 125.18 40.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.474 -0.785 . . . . 10.0 110.11 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 428' ' ' TYR . . . . . 0.53 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 10.2 m-85 -111.99 179.5 3.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.511 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 4.3 mmt -70.53 -75.86 0.11 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.909 0.385 . . . . 10.0 111.923 -178.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 41.1 p -90.58 165.62 13.65 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.71 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 431' ' ' GLU . . . . . 0.431 ' HG3' ' HE2' ' A' ' 434' ' ' LYS . 8.0 tt0 -67.32 -26.88 66.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.547 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -61.1 -44.5 97.26 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 115.647 -0.706 . . . . 10.0 110.031 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -63.21 -40.83 98.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.572 -0.74 . . . . 10.0 110.21 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 434' ' ' LYS . . . . . 0.484 ' HG3' ' HB3' ' A' ' 587' ' ' TYR . 39.7 ttpt -59.72 -50.54 73.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.468 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 435' ' ' ILE . . . . . 0.537 ' O ' HG12 ' A' ' 439' ' ' ILE . 48.5 mm -65.44 -43.7 94.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.859 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -39.69 89.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.746 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.87 -33.92 76.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.026 0.441 . . . . 10.0 110.441 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 438' ' ' ILE . . . . . 0.406 HG23 HG21 ' A' ' 557' ' ' ILE . 89.1 mt -66.23 -45.49 89.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.688 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 439' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 435' ' ' ILE . 33.5 mm -62.38 -36.38 74.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.348 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -64.04 -45.54 88.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.378 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -61.76 -40.77 96.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.469 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.434 HG12 HG11 ' A' ' 452' ' ' VAL . 78.7 mt -72.13 -38.03 61.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.901 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 14.2 tttm -53.01 -38.68 62.55 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.918 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . 0.503 ' O ' ' HE2' ' A' ' 448' ' ' LYS . 61.8 mm-40 -78.0 -45.05 24.83 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.918 0.39 . . . . 10.0 111.959 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 43.1 mtt-85 -68.14 -29.89 68.89 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 -177.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 1.6 p -68.69 -35.05 76.69 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.134 0.492 . . . . 10.0 110.268 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.97 -15.01 49.37 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.49 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' LYS . . . . . 0.503 ' HE2' ' O ' ' A' ' 444' ' ' GLU . 0.2 OUTLIER -90.46 -31.44 16.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.627 179.804 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 105.57 23.55 7.49 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.766 -0.731 . . . . 10.0 112.964 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' GLN . . . . . 0.44 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 64.3 tt0 -104.64 127.76 28.27 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.896 0.348 . . . . 10.0 110.887 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' PRO . . . . . 0.409 ' HB3' ' O ' ' A' ' 496' ' ' TYR . 38.2 Cg_endo -68.25 140.01 47.64 Favored 'Trans proline' 0 C--O 1.237 0.466 0 C-N-CA 122.625 2.217 . . . . 10.0 111.372 178.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.434 HG11 HG12 ' A' ' 442' ' ' ILE . 77.4 t -125.28 130.78 72.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.086 0.47 . . . . 10.0 111.695 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 55.8 tp -114.66 106.61 14.44 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 40.9 t -92.73 117.82 36.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.508 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -96.89 127.75 9.31 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.597 -0.811 . . . . 10.0 111.738 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 10.1 p -120.61 137.0 54.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.589 0.233 . . . . 10.0 110.556 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 34.5 pt -93.6 -25.61 4.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.053 0.454 . . . . 10.0 110.486 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 4.0 p -115.62 133.54 55.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.102 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 20.5 mt -62.79 -32.84 57.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.256 0.55 . . . . 10.0 110.22 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.456 ' CD ' ' H ' ' A' ' 460' ' ' GLU . 1.9 mp0 -59.57 -35.03 73.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.606 -0.724 . . . . 10.0 110.577 179.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.91 -32.33 51.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.773 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 1.4 m -61.25 -42.55 98.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.049 0.452 . . . . 10.0 110.089 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -70.68 -35.45 72.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.179 179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.64 -51.6 54.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.79 -179.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 14.2 p -62.51 -35.44 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.71 0.29 . . . . 10.0 110.743 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 60.3 m -65.71 -39.74 91.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.574 -0.284 . . . . 10.0 110.407 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -58.46 -43.26 88.79 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.957 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -71.44 -35.42 70.92 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.64 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 47.5 mt -65.6 -44.22 87.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.553 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 3.1 m -67.8 -30.31 69.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.202 0.525 . . . . 10.0 109.886 178.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -66.1 -38.78 89.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.395 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -84.96 -3.09 58.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.986 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 72.83 36.24 57.91 Favored Glycine 0 N--CA 1.449 -0.461 0 CA-C-N 115.88 -0.6 . . . . 10.0 112.483 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 88.5 mt -104.42 123.61 58.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 120.622 0.249 . . . . 10.0 110.67 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -64.21 139.37 58.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.403 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -159.8 145.04 15.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.918 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -117.17 125.47 51.25 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . 0.448 HG22 HD12 ' A' ' 502' ' ' ILE . 4.5 t -100.08 140.23 19.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.158 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 90.3 mt -94.02 151.61 19.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.101 -0.5 . . . . 10.0 109.752 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -161.71 130.12 4.29 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -58.18 -19.6 34.52 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -179.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -80.46 -6.83 58.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.938 0.399 . . . . 10.0 110.723 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' PHE . . . . . 0.435 ' O ' ' HG3' ' A' ' 487' ' ' GLU . 54.6 m-85 -131.07 45.96 2.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.45 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 9.2 m80 -51.32 -41.1 60.31 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.896 -179.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -63.64 -30.91 71.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.846 -179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -81.81 -38.12 26.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.918 0.39 . . . . 10.0 110.395 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 483' ' ' PHE . 53.8 mt-10 -55.6 -37.41 68.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.27 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -54.66 -41.48 70.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.23 -0.441 . . . . 10.0 111.592 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -79.26 -29.14 42.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.986 0.422 . . . . 10.0 111.092 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.1 mt -73.22 -53.3 18.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.308 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 68.6 t -60.48 -35.49 63.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.949 0.404 . . . . 10.0 111.239 -179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -64.08 -26.33 68.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.363 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -115.8 19.07 15.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.822 0.344 . . . . 10.0 110.888 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.74 -17.32 62.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.056 0.455 . . . . 10.0 111.045 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -93.89 8.65 73.5 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.851 -0.69 . . . . 10.0 112.086 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' TYR . . . . . 0.409 ' O ' ' HB3' ' A' ' 451' ' ' PRO . 61.7 t80 -68.72 138.55 90.76 Favored Pre-proline 0 C--N 1.325 -0.465 0 N-CA-C 110.271 -0.27 . . . . 10.0 110.271 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.84 128.13 29.16 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.642 2.228 . . . . 10.0 112.682 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.61 14.18 8.23 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.561 -0.745 . . . . 10.0 112.808 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.92 133.76 34.59 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.879 0.371 . . . . 10.0 110.351 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 25.9 t -111.62 113.45 44.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.375 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.9 m -111.79 134.17 53.53 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.502 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' ILE . . . . . 0.448 HD12 HG22 ' A' ' 478' ' ' VAL . 80.1 mt -111.63 117.62 55.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.787 0.327 . . . . 10.0 110.133 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -97.9 121.3 39.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.087 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 2.7 m -98.94 109.72 22.43 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.868 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 55.81 67.33 1.02 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.391 0.615 . . . . 10.0 111.002 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 38.6 tpp -76.3 128.57 35.15 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.699 -0.682 . . . . 10.0 111.136 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -76.68 179.75 5.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.789 -0.642 . . . . 10.0 111.448 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -68.59 160.82 51.44 Favored Glycine 0 CA--C 1.52 0.402 0 CA-C-N 116.029 -0.532 . . . . 10.0 113.357 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.541 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 99.1 mtt180 65.15 -82.72 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.54 0.736 . . . . 10.0 111.895 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 81.07 155.75 13.26 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.961 -0.638 . . . . 10.0 112.717 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.05 154.28 41.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.77 0.319 . . . . 10.0 111.009 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -75.66 109.9 9.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.383 -0.371 . . . . 10.0 110.367 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 45.9 mt -78.47 118.42 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.157 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 2.7 t -86.65 128.65 39.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.805 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 60.7 mt -74.05 133.31 42.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.33 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 83.78 15.72 69.76 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.939 -0.648 . . . . 10.0 112.274 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 95.43 -170.54 28.53 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.629 -0.796 . . . . 10.0 111.475 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 2.8 p -134.1 94.58 3.27 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.944 0.372 . . . . 10.0 110.896 -179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' TRP . . . . . 0.408 ' O ' HG22 ' A' ' 523' ' ' VAL . 21.9 p-90 -56.57 -30.07 62.75 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.826 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -61.25 -40.66 94.9 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.986 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.37 -24.55 39.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.972 0.415 . . . . 10.0 110.873 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -77.43 -46.87 21.27 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.98 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 519' ' ' TRP . 33.8 m -69.62 -26.41 30.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.861 0.362 . . . . 10.0 110.94 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -84.79 -5.61 59.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.432 . . . . 10.0 110.78 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -89.65 -9.73 48.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.481 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 11.2 mt -82.16 158.33 23.67 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.311 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.99 -28.87 32.39 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 178.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -146.75 92.35 5.07 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.461 -0.791 . . . . 10.0 109.759 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.5 92.48 1.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.47 0 C-N-CA 122.449 2.1 . . . . 10.0 112.688 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -75.09 153.96 38.09 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.205 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -57.11 -35.68 69.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.979 0.419 . . . . 10.0 110.915 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -66.81 -43.95 82.46 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.15 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -69.12 -40.63 78.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.925 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.19 -44.08 94.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.32 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.55 -39.78 94.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.355 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 18.4 tptp -59.95 -53.37 58.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.736 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 94.0 mt -63.66 -39.1 84.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.74 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 22.5 ttmt -61.97 -41.19 97.73 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.263 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.48 86.01 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.372 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . 0.593 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 40.7 m-20 -60.69 -46.21 91.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.777 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' TRP . . . . . 0.416 ' CZ2' ' HD2' ' A' ' 545' ' ' HIS . 70.6 t90 -58.58 -41.03 84.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.318 -0.856 . . . . 10.0 110.558 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -58.37 -43.54 88.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.622 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.84 -45.03 96.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.149 0.499 . . . . 10.0 110.019 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 544' ' ' ARG . . . . . 0.593 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 14.6 mtm180 -63.68 -38.96 93.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.547 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 545' ' ' HIS . . . . . 0.416 ' HD2' ' CZ2' ' A' ' 541' ' ' TRP . 6.3 t-80 -66.25 -39.41 89.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.44 -0.345 . . . . 10.0 110.094 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -66.24 -40.03 89.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.157 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -58.85 -43.44 90.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.876 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 548' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 544' ' ' ARG . 65.1 t -62.57 -35.89 72.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.79 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 545' ' ' HIS . 99.7 mt -64.33 -43.66 93.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.005 0.431 . . . . 10.0 110.225 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -71.14 -29.49 65.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.673 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 551' ' ' ALA . . . . . 0.44 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -70.02 -35.74 74.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.951 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 129.49 18.08 1.67 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.484 -0.865 . . . . 10.0 113.04 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 75.31 -169.94 54.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.828 -0.701 . . . . 10.0 112.55 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.433 ' HB3' ' OG ' ' A' ' 575' ' ' SER . 54.3 tp -75.5 126.08 30.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.928 0.394 . . . . 10.0 110.115 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -95.36 120.53 35.75 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.936 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 35.1 mm -98.04 128.3 49.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.596 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 557' ' ' ILE . . . . . 0.406 HG21 HG23 ' A' ' 438' ' ' ILE . 17.1 mt -119.34 125.75 74.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.384 . . . . 10.0 110.186 178.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -107.41 117.23 5.17 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.625 -0.798 . . . . 10.0 112.094 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 3.4 p -70.71 -48.12 56.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.539 0.685 . . . . 10.0 109.757 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.55 140.07 35.13 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.608 -1.178 . . . . 10.0 108.676 178.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 561' ' ' ARG . . . . . 0.512 ' HB2' HD22 ' A' ' 594' ' ' LEU . 77.8 mtt-85 -78.65 164.05 24.95 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.824 0.345 . . . . 10.0 110.18 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -86.98 153.26 21.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.198 -0.455 . . . . 10.0 109.839 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.89 -44.1 81.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.122 0.487 . . . . 10.0 110.026 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 58.7 m -99.53 142.23 31.28 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.488 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 565' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 565' ' ' ARG . 0.0 OUTLIER -68.84 -27.88 66.23 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.538 -179.555 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 566' ' ' ARG . . . . . 0.401 ' HD2' ' OD1' ' A' ' 212' ' ' ASP . 8.9 ttm180 -59.98 -51.22 70.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.107 0.479 . . . . 10.0 110.391 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 13.2 mt -72.59 -25.36 22.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.269 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -69.51 -50.62 43.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.069 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 17.1 m-20 -62.7 -37.67 87.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.03 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -58.86 -33.02 69.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.918 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.409 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 39.5 tp -78.49 -35.21 46.78 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.876 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -74.11 -30.43 62.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.898 0.38 . . . . 10.0 111.114 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.61 17.52 14.61 Favored Glycine 0 CA--C 1.521 0.426 0 C-N-CA 121.082 -0.58 . . . . 10.0 114.015 -178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 574' ' ' ARG . . . . . 0.409 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 1.2 mmt180 -72.17 -41.59 66.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 117.595 0.697 . . . . 10.0 110.557 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . 0.433 ' OG ' ' HB3' ' A' ' 554' ' ' LEU . 19.4 t -87.61 161.27 17.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.002 -0.545 . . . . 10.0 110.475 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 73.43 36.32 55.01 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 121.147 -0.549 . . . . 10.0 112.794 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -61.61 130.44 45.9 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.442 0.163 . . . . 10.0 111.027 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 578' ' ' GLN . . . . . 0.609 ' HA ' ' OE2' ' A' ' 106' ' ' GLU . 17.5 tt0 64.03 19.7 11.87 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.635 0.584 . . . . 10.0 111.23 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 87.41 51.34 3.33 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.634 -0.793 . . . . 10.0 112.821 179.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -105.76 -168.83 1.5 Allowed 'General case' 0 C--N 1.326 -0.449 0 O-C-N 122.847 -0.208 . . . . 10.0 110.484 179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . 0.476 ' HA ' ' HB ' ' A' ' 419' ' ' ILE . . . -88.45 155.23 19.79 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.122 0.487 . . . . 10.0 111.72 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 173.72 177.47 42.95 Favored Glycine 0 N--CA 1.445 -0.738 0 CA-C-N 115.734 -0.667 . . . . 10.0 111.612 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.9 p -153.87 134.43 13.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.823 0.312 . . . . 10.0 110.614 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.88 124.05 49.05 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.596 -0.274 . . . . 10.0 111.078 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 585' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 3.6 tpm_? -131.19 115.92 17.0 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.951 -0.389 . . . . 10.0 109.951 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -114.5 151.14 33.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.015 0.436 . . . . 10.0 111.285 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 587' ' ' TYR . . . . . 0.484 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 86.4 m-85 -132.54 169.25 16.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.633 -0.712 . . . . 10.0 109.378 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 588' ' ' LEU . . . . . . . . . . . . . 10.8 tp -168.22 162.16 12.65 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.169 0.293 . . . . 10.0 110.24 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 589' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.8 OUTLIER -113.59 157.31 22.25 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.019 -0.363 . . . . 10.0 110.019 178.796 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 590' ' ' MET . . . . . 0.438 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 70.6 mmm -71.87 -14.21 61.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.162 0.506 . . . . 10.0 111.276 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -121.26 24.18 10.13 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.673 -0.694 . . . . 10.0 109.314 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 592' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 589' ' ' SER . 0.9 OUTLIER -74.14 169.04 18.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.194 -0.912 . . . . 10.0 111.373 -179.099 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -69.18 -34.46 74.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.615 ' O ' HG12 ' A' ' 597' ' ' ILE . 10.8 tp -69.87 -21.64 63.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.236 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 3.5 mmt -75.59 -5.86 47.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.097 0.475 . . . . 10.0 110.832 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -93.27 -11.08 33.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.045 -0.525 . . . . 10.0 111.461 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 594' ' ' LEU . 19.0 pt -74.53 -8.79 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 121.138 0.495 . . . . 10.0 110.539 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -79.19 -10.15 59.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.522 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 72.88 -53.86 0.7 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.923 0.764 . . . . 10.0 111.512 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 31.1 t -89.58 134.84 33.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.498 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -85.01 -4.3 59.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.151 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.66 -33.93 75.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.327 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 21.4 t -65.39 -50.81 70.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.216 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . 0.497 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 0.2 OUTLIER -63.42 -38.96 93.18 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.848 179.946 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -68.5 -30.37 73.14 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.822 -0.704 . . . . 10.0 112.639 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 41.0 tpp -81.42 -38.35 26.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.712 0.291 . . . . 10.0 111.27 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 46.9 mtt -66.63 -16.85 64.49 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.499 -0.319 . . . . 10.0 111.545 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 608' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 604' ' ' SER . 33.6 mtt180 -68.45 -15.58 63.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.896 0.379 . . . . 10.0 110.936 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -87.04 23.44 1.77 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.277 -0.42 . . . . 10.0 111.2 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 49.0 tp -93.08 -14.58 27.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.076 0.465 . . . . 10.0 110.589 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 611' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' A' ' 612' ' ' MET . . . 92.13 -48.88 2.71 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.992 -0.623 . . . . 10.0 111.919 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 612' ' ' MET . . . . . 0.438 ' HB2' ' O ' ' A' ' 611' ' ' GLY . 0.0 OUTLIER 73.55 -55.01 0.68 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.647 0.779 . . . . 10.0 112.01 179.057 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 15.3 mmtp 59.35 80.74 0.26 Allowed Pre-proline 0 N--CA 1.464 0.273 0 O-C-N 123.475 0.484 . . . . 10.0 111.847 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 614' ' ' PRO . . . . . 0.53 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 21.4 Cg_endo -62.9 95.29 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.629 2.22 . . . . 10.0 112.103 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 140.16 -24.2 2.69 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.21 -0.904 . . . . 10.0 111.03 -179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -114.38 113.56 24.69 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.73 -0.47 . . . . 10.0 109.73 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -66.32 110.4 3.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.827 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 4.5 tp -67.99 -30.4 48.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.734 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 43.55 74.85 0.11 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.615 0.766 . . . . 10.0 112.643 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -120.44 99.53 47.88 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 110.058 -0.349 . . . . 10.0 110.058 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.66 -26.43 72.71 Favored 'Trans proline' 0 N--CA 1.475 0.403 0 C-N-CA 123.494 2.796 . . . . 10.0 114.584 -178.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 43.3 p-90 -63.06 -24.72 68.04 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.837 -0.345 . . . . 10.0 111.523 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 65.9 t -63.2 -45.83 97.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-O 120.996 0.427 . . . . 10.0 110.115 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 51.6 m -62.08 -36.18 80.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.484 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -67.85 -38.27 82.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.289 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -64.68 -45.71 85.49 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.836 178.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 98.6 mt -65.46 -37.57 80.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.136 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -57.92 -41.01 81.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.02 -0.536 . . . . 10.0 111.002 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -70.75 -38.94 73.52 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.895 -0.409 . . . . 10.0 109.895 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.41 89.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.343 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -63.12 -42.24 99.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.949 -0.568 . . . . 10.0 110.076 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -61.9 -32.45 72.83 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.159 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 633' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 637' ' ' ARG . 43.1 mttm -63.75 -37.54 87.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.425 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 40.0 t -61.83 -47.81 91.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.417 ' H ' ' HG2' ' A' ' 635' ' ' GLU . 0.8 OUTLIER -61.99 -40.84 97.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.721 179.254 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 28.3 m -61.56 -35.3 77.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.349 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 637' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 633' ' ' LYS . 72.4 mtt180 -67.22 -48.71 67.03 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.446 -0.576 . . . . 10.0 109.446 178.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -60.46 -42.49 96.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.512 -0.767 . . . . 10.0 110.445 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -56.21 -44.32 79.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.745 -0.662 . . . . 10.0 110.762 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.6 -42.67 99.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.468 -0.333 . . . . 10.0 111.298 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 71.3 mt -58.77 -53.41 47.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.231 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 642' ' ' ARG . . . . . 0.471 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 0.0 OUTLIER -69.02 -27.92 66.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.643 0.259 . . . . 10.0 110.711 -179.792 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -66.78 -38.4 86.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.423 -0.353 . . . . 10.0 110.259 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -68.07 -32.01 72.05 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.033 0.444 . . . . 10.0 110.141 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 95.5 mt -71.53 -26.29 62.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.384 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 646' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 89.2 mt -62.69 -32.85 74.01 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.383 179.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -64.48 -13.53 52.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.855 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -107.3 -46.22 3.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.115 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -73.3 -29.28 62.6 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.031 0.752 . . . . 10.0 113.031 -177.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -64.87 -34.78 79.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.038 0.447 . . . . 10.0 109.835 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 651' ' ' VAL . . . . . 0.402 HG21 ' HG2' ' A' ' 804' ' ' LYS . 16.7 t -65.02 -43.07 96.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.738 -0.665 . . . . 10.0 109.917 179.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -64.06 -39.8 94.88 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.025 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -61.15 -43.57 98.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.174 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -61.32 -51.44 68.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.418 -0.81 . . . . 10.0 110.968 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -61.92 -42.89 99.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.797 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 656' ' ' ARG . . . . . 0.417 HH22 HD21 ' A' ' 383' ' ' LEU . 2.6 ttp-105 -62.5 -36.12 81.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.325 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -63.9 -48.3 77.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.632 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.53 -50.22 68.19 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.851 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 659' ' ' ILE . . . . . 0.418 HG23 ' HD1' ' A' ' 660' ' ' TYR . 9.1 tp -66.48 -35.99 76.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 111.901 0.334 . . . . 10.0 111.901 -178.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 660' ' ' TYR . . . . . 0.418 ' HD1' HG23 ' A' ' 659' ' ' ILE . 2.9 m-30 -70.6 -35.62 73.09 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 9.9 t -62.23 -50.66 70.87 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -57.3 -43.59 83.34 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.431 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 38.7 ttt-85 -63.05 -41.84 99.57 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.613 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -65.82 -43.11 89.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.606 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 665' ' ' GLU . . . . . 0.403 ' O ' HG22 ' A' ' 669' ' ' VAL . 28.1 mt-10 -58.45 -50.1 74.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.245 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 26.8 mt -70.02 -16.12 63.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.171 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.406 ' O ' ' HD3' ' A' ' 195' ' ' PRO . 12.1 tp -83.8 -46.04 12.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.662 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -68.73 -41.98 78.24 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.855 -0.611 . . . . 10.0 112.161 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 665' ' ' GLU . 27.0 m -74.86 150.93 6.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.038 0.447 . . . . 10.0 111.191 -179.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 1.5 m -94.29 -42.21 9.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.451 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -84.32 126.26 33.03 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.564 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 672' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 676' ' ' ILE . 5.6 p -127.49 -0.68 3.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.004 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 673' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 677' ' ' ASN . 0.8 OUTLIER -52.65 -45.51 66.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.348 -0.842 . . . . 10.0 112.364 -178.66 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -62.34 -46.25 89.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.591 0.234 . . . . 10.0 111.586 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 675' ' ' THR . . . . . 0.466 ' O ' HG12 ' A' ' 679' ' ' ILE . 3.9 m -63.57 -46.84 84.05 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.767 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 676' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 672' ' ' VAL . 36.4 mm -65.27 -37.96 81.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.99 0.424 . . . . 10.0 110.856 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 673' ' ' SER . 5.5 t30 -68.53 -40.23 80.83 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.58 -0.282 . . . . 10.0 111.316 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 29.0 m -62.77 -42.27 99.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.748 0.308 . . . . 10.0 111.142 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 679' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 675' ' ' THR . 27.1 pt -77.44 -21.04 14.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.677 -0.409 . . . . 10.0 110.844 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 680' ' ' ARG . . . . . 0.562 ' HG3' HD12 ' A' ' 823' ' ' ILE . 10.7 mtm-85 -59.53 -46.37 89.05 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.04 0.448 . . . . 10.0 110.144 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -65.81 -44.59 85.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.565 -0.743 . . . . 10.0 110.931 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -62.62 -47.4 83.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.245 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 41.2 t -61.18 -44.95 99.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.767 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -62.74 -42.36 99.63 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.655 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 54.8 tttm -63.25 -48.32 78.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.559 -0.292 . . . . 10.0 110.325 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.85 -40.6 84.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.209 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 30.0 m -64.72 -43.33 93.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.195 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.6 mt -66.68 -39.92 84.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.353 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -61.85 -18.17 59.1 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.254 -0.43 . . . . 10.0 112.143 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -79.26 -14.2 59.18 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.852 0.358 . . . . 10.0 111.495 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -127.14 -24.54 3.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.958 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 692' ' ' ILE . . . . . 0.549 HG23 ' CD1' ' A' ' 701' ' ' TRP . 69.4 mt -129.72 101.03 18.81 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.579 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 693' ' ' PRO . . . . . 0.409 ' HA ' ' HD3' ' A' ' 694' ' ' PRO . 23.4 Cg_exo -64.12 140.39 71.45 Favored 'Trans proline' 0 N--CA 1.464 -0.233 0 C-N-CA 122.518 2.145 . . . . 10.0 111.494 179.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 694' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 693' ' ' PRO . 59.3 Cg_exo -52.28 113.8 1.37 Allowed 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.897 2.398 . . . . 10.0 112.823 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 56.71 67.77 0.95 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.448 -0.796 . . . . 10.0 111.391 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 6.0 p -118.9 -172.32 2.27 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.914 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 35.9 mt -83.5 154.89 23.64 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.769 -0.456 . . . . 10.0 109.769 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -57.71 -34.32 69.34 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 120.937 0.399 . . . . 10.0 111.69 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -74.34 -6.3 47.29 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.288 -0.414 . . . . 10.0 111.882 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.22 8.75 40.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.839 0.352 . . . . 10.0 110.234 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 701' ' ' TRP . . . . . 0.549 ' CD1' HG23 ' A' ' 692' ' ' ILE . 48.4 m0 -101.43 108.13 19.64 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.966 -179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -83.72 82.78 8.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.364 0.602 . . . . 10.0 109.414 178.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 703' ' ' ILE . . . . . 0.511 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 43.0 mm -60.86 -50.22 85.95 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.201 -0.909 . . . . 10.0 111.956 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 704' ' ' PRO . . . . . 0.511 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 47.7 Cg_exo -56.27 -47.45 24.28 Favored 'Trans proline' 0 C--N 1.36 1.138 0 C-N-CA 122.052 1.834 . . . . 10.0 112.561 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -60.67 -40.67 98.3 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.966 -0.635 . . . . 10.0 112.448 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 61.1 tp -70.47 -45.89 64.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.389 0.138 . . . . 10.0 111.006 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -59.19 -51.23 70.87 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.357 -179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -59.71 -35.72 75.08 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.826 0.346 . . . . 10.0 110.771 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 709' ' ' ARG . 2.3 tpt180 -65.5 -45.92 81.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.277 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 79.5 mt -64.87 -38.19 90.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.135 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.88 -36.22 72.69 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.695 0.628 . . . . 10.0 112.695 -179.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -92.68 -44.48 8.54 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.436 0.902 . . . . 10.0 113.436 -177.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 713' ' ' ASP . . . . . 0.675 ' O ' ' HE3' ' A' ' 828' ' ' LYS . 0.8 OUTLIER -89.27 -31.51 17.83 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 -177.547 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -106.15 -4.22 20.55 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.057 -0.657 . . . . 10.0 112.079 -178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 25.6 t70 57.67 28.72 16.19 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.326 0.584 . . . . 10.0 110.526 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 43.8 tp -118.96 129.79 55.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.09 -0.505 . . . . 10.0 111.662 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -97.68 128.13 44.14 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.492 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.435 HD21 ' HG2' ' A' ' 742' ' ' GLN . 11.8 mt -140.0 122.11 9.87 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 120.782 0.325 . . . . 10.0 111.695 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -81.81 60.86 7.72 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 122.859 2.373 . . . . 10.0 111.675 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 52.8 mt -63.48 -42.63 96.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.383 -178.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -67.04 -31.67 72.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.207 0.527 . . . . 10.0 110.474 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -88.7 6.86 36.55 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.905 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -106.11 -54.1 2.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.857 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 77.8 mt -63.68 -23.45 67.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.756 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 725' ' ' ASP . . . . . 0.477 ' OD1' ' HG3' ' A' ' 726' ' ' LYS . 0.0 OUTLIER -78.59 -11.79 59.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.942 -179.76 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 726' ' ' LYS . . . . . 0.477 ' HG3' ' OD1' ' A' ' 725' ' ' ASP . 50.6 mttp -111.71 -48.63 3.05 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.01 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -120.64 94.71 48.93 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.26 0.553 . . . . 10.0 110.817 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.27 -3.62 14.11 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.456 2.104 . . . . 10.0 111.851 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.44 -12.31 61.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.657 -0.701 . . . . 10.0 111.012 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 730' ' ' LEU . . . . . 0.508 HD21 ' NH1' ' A' ' 738' ' ' ARG . 32.2 mt -66.48 -34.69 78.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.253 -0.43 . . . . 10.0 110.154 179.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 53.42 -104.09 0.19 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.142 -0.936 . . . . 10.0 111.318 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.16 -56.34 0.86 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.646 -0.252 . . . . 10.0 111.05 -179.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -58.0 -54.41 47.25 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.513 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.28 -31.27 71.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.114 0.483 . . . . 10.0 110.539 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 39.9 tp -65.69 -46.76 77.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.802 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 22.8 mtt180 -63.49 -36.33 83.4 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.966 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -60.37 -45.2 94.34 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.404 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 738' ' ' ARG . . . . . 0.508 ' NH1' HD21 ' A' ' 730' ' ' LEU . 16.7 mmm-85 -63.35 -41.71 98.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.513 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 90.7 mt -62.53 -51.84 67.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.694 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 740' ' ' LEU . . . . . 0.42 ' O ' HG13 ' A' ' 744' ' ' ILE . 36.4 tp -62.08 -44.37 96.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.418 -179.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -61.01 -41.23 96.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.745 0.307 . . . . 10.0 111.407 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 742' ' ' GLN . . . . . 0.435 ' HG2' HD21 ' A' ' 718' ' ' LEU . 23.8 tp60 -60.59 -42.98 97.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.187 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -39.82 95.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.965 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 744' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 740' ' ' LEU . 75.3 mt -62.45 -44.01 98.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.765 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -46.5 87.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.24 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 88.3 t -65.53 -40.2 87.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.126 0.488 . . . . 10.0 110.155 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -59.69 -43.39 94.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.78 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 748' ' ' GLN . . . . . 0.494 ' O ' ' HG3' ' A' ' 752' ' ' GLU . 24.5 mt-30 -59.1 -44.2 91.94 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.02 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.45 -39.94 89.34 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.475 -0.329 . . . . 10.0 110.77 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -68.36 -34.92 76.93 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.975 0.417 . . . . 10.0 109.879 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -72.42 -39.38 67.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.07 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 752' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 748' ' ' GLN . 45.9 mt-10 -53.39 -39.83 64.56 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 13.3 t -75.17 -30.93 23.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.315 -0.402 . . . . 10.0 112.003 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 50.5 t -85.42 -46.52 17.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 121.245 0.545 . . . . 10.0 111.098 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.03 132.11 3.94 Favored Glycine 0 N--CA 1.441 -0.995 0 N-CA-C 110.404 -1.078 . . . . 10.0 110.404 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 756' ' ' ALA . . . . . 0.617 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -56.84 -51.81 67.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 117.001 0.4 . . . . 10.0 111.646 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 757' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' A' ' 757' ' ' GLU . 11.2 mp0 -59.15 -39.27 81.89 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.076 -0.511 . . . . 10.0 111.132 -179.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 16.1 tpt -73.56 -38.68 65.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.725 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 7.8 tpt -60.59 -36.49 78.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.794 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.617 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -61.81 -37.54 84.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.33 0.586 . . . . 10.0 109.491 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -71.07 -34.48 71.22 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.527 -0.761 . . . . 10.0 109.414 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -68.1 -51.61 44.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.272 -0.876 . . . . 10.0 110.304 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -56.84 -44.48 82.14 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.933 0.397 . . . . 10.0 110.145 179.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 43.6 tttp -60.44 -50.41 73.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.343 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.27 -42.23 99.72 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.494 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 766' ' ' VAL . . . . . 0.405 ' HA ' ' HG2' ' A' ' 769' ' ' GLN . 44.7 t -62.49 -49.19 84.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.424 0.154 . . . . 10.0 110.588 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 18.7 ttt -59.56 -43.3 93.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.657 0.265 . . . . 10.0 110.877 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 84.4 mt -64.28 -51.78 61.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.604 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 769' ' ' GLN . . . . . 0.418 ' HG3' ' N ' ' A' ' 770' ' ' THR . 13.9 pt20 -63.43 -37.29 86.71 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.796 0.295 . . . . 10.0 111.796 -178.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 770' ' ' THR . . . . . 0.418 ' N ' ' HG3' ' A' ' 769' ' ' GLN . 12.6 m -68.39 -34.84 76.76 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.665 -0.495 . . . . 10.0 109.665 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.8 tt -62.14 -50.05 73.4 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.84 -34.05 75.27 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 115.631 -0.713 . . . . 10.0 110.034 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 773' ' ' SER . . . . . 0.821 ' HB3' ' HB1' ' B' ' 19' ' ' ALA . 72.7 m -61.63 -52.87 62.6 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.467 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 16.9 mt -78.02 -22.74 48.8 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.887 -0.325 . . . . 10.0 111.675 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 31.1 t-105 -63.94 -50.37 68.9 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.952 -0.299 . . . . 10.0 110.821 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.417 ' NZ ' ' HA ' ' A' ' 773' ' ' SER . 10.9 ptpp? -62.25 -35.25 78.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.919 0.39 . . . . 10.0 110.434 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -67.28 -41.66 85.11 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 73.5 t60 -61.74 -38.16 86.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.002 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 63.6 mt -66.0 -49.02 69.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.117 179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -61.52 -45.25 95.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.543 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.32 94.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.997 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 37.9 ttm -64.39 -42.86 95.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.766 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 783' ' ' ASP . . . . . 0.466 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 38.5 t70 -64.88 -41.13 95.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.22 -0.445 . . . . 10.0 110.209 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 13.1 m-30 -62.97 -35.35 79.86 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.681 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 13.7 tp -78.37 -35.45 47.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.809 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -59.07 -38.04 78.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.597 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 787' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 0.9 OUTLIER -78.97 -1.15 34.01 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.998 -0.281 . . . . 10.0 111.157 179.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -127.14 21.39 5.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.761 -0.733 . . . . 10.0 112.066 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 9.0 tp -64.2 -27.99 43.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 111.739 0.274 . . . . 10.0 111.739 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 22.2 m80 -68.72 -11.18 59.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.716 0.293 . . . . 10.0 111.335 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 3.3 tp -101.78 -1.06 33.19 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.483 . . . . 10.0 110.156 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 3.3 mmt85 -113.99 -47.98 2.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.762 -0.653 . . . . 10.0 109.97 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -90.28 67.04 2.62 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.96 -0.638 . . . . 10.0 111.552 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 794' ' ' TYR . . . . . 0.417 ' HB2' ' H ' ' A' ' 795' ' ' ALA . 0.4 OUTLIER -81.44 -157.09 0.16 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.683 0.278 . . . . 10.0 110.792 -179.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 795' ' ' ALA . . . . . 0.417 ' H ' ' HB2' ' A' ' 794' ' ' TYR . . . -62.0 150.4 38.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.7 0.286 . . . . 10.0 111.219 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 67.81 18.38 9.69 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.688 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 50.6 mttm -142.68 164.31 30.46 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.824 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -111.11 126.75 28.07 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 109.59 -0.522 . . . . 10.0 109.59 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.77 -24.37 71.17 Favored 'Trans proline' 0 CA--C 1.529 0.231 0 C-N-CA 122.902 2.401 . . . . 10.0 113.535 -178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 800' ' ' LYS . . . . . 0.45 ' HB2' ' NZ ' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -91.0 -48.42 6.99 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.89 -0.324 . . . . 10.0 110.65 -179.674 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 -63.55 -38.88 92.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.389 -0.369 . . . . 10.0 111.219 -179.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -65.11 -40.23 94.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.065 0.46 . . . . 10.0 109.922 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -60.56 -42.52 96.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.749 -0.66 . . . . 10.0 110.06 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 804' ' ' LYS . . . . . 0.402 ' HG2' HG21 ' A' ' 651' ' ' VAL . 88.0 mttt -65.98 -39.72 90.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.571 -0.74 . . . . 10.0 110.601 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 805' ' ' ARG . . . . . 0.42 HH11 ' HG2' ' A' ' 805' ' ' ARG . 41.3 ttp85 -61.34 -45.31 94.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.015 0.436 . . . . 10.0 110.431 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -65.66 -46.97 77.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.279 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 3.5 p -64.59 -37.54 87.92 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.608 -0.269 . . . . 10.0 111.652 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -64.74 -45.79 84.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.757 0.313 . . . . 10.0 110.2 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 13.2 m -64.82 -42.29 95.09 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.01 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 38.5 ttm -60.84 -37.29 81.56 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.629 -0.714 . . . . 10.0 110.866 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -70.23 -41.45 73.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.442 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.21 -50.05 74.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.669 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -62.41 -33.83 75.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.387 179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 11.6 ttt -63.82 -47.83 79.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.515 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 91.2 mt -62.46 -41.45 98.76 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.929 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -63.09 -44.25 96.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.848 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 12.1 m -73.46 -29.82 62.78 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.896 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 55.0 tp -62.56 -56.79 14.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.976 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 819' ' ' LYS . . . . . 0.406 ' O ' HG12 ' A' ' 823' ' ' ILE . 43.5 pttt -62.24 -28.87 70.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.264 -0.425 . . . . 10.0 110.674 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -62.35 -67.05 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.32 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . 0.528 ' HA ' ' OG ' ' A' ' 824' ' ' SER . 1.3 mm-40 -61.43 -28.61 69.39 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 -178.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 5.6 t -60.23 -41.05 85.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 178.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 823' ' ' ILE . . . . . 0.562 HD12 ' HG3' ' A' ' 680' ' ' ARG . 22.4 mm -76.56 -46.49 31.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.251 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 824' ' ' SER . . . . . 0.528 ' OG ' ' HA ' ' A' ' 821' ' ' GLU . 0.1 OUTLIER -63.47 -42.25 98.59 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 121.029 -0.268 . . . . 10.0 111.372 -179.42 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 97.5 m -59.42 -39.56 83.9 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.7 0.286 . . . . 10.0 111.194 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 76.3 mt -67.73 -17.97 64.74 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.099 0.476 . . . . 10.0 110.612 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 3.9 m -100.77 -29.52 12.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.157 179.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 828' ' ' LYS . . . . . 0.675 ' HE3' ' O ' ' A' ' 713' ' ' ASP . 77.7 mttt -70.1 -16.22 63.09 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.276 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 14.2 p -59.75 131.45 24.35 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.334 0.587 . . . . 10.0 111.055 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -97.88 96.9 8.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.823 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 40.4 t -105.31 143.47 16.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.636 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -52.09 120.12 5.08 Favored 'General case' 0 C--N 1.332 -0.177 0 O-C-N 123.677 0.611 . . . . 10.0 110.472 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 33.7 mmt -94.18 126.53 48.24 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.914 -0.584 . . . . 10.0 111.404 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -85.45 -178.94 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.143 2.562 . . . . 10.0 111.563 178.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -86.52 148.57 25.46 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.781 0.324 . . . . 10.0 110.616 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.911 -0.566 . . . . 10.0 109.727 179.268 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.5 tpt . . . . . 0 N--CA 1.481 1.085 0 CA-C-O 121.076 0.465 . . . . 10.0 110.91 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 16.5 tpt -124.41 136.13 53.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.761 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 19.6 pt -93.2 147.55 5.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.202 -0.453 . . . . 10.0 111.297 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.19 -7.79 57.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.173 -0.467 . . . . 10.0 111.613 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 87.3 mt -83.45 72.03 10.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.082 0.468 . . . . 10.0 110.394 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -130.78 42.63 3.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.766 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -76.53 104.41 7.03 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.888 0.375 . . . . 10.0 110.56 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.505 ' NE ' ' HA ' ' B' ' 8' ' ' ARG . 4.5 mmp_? -127.7 15.28 6.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.951 0.405 . . . . 10.0 111.249 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -109.77 130.66 55.5 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 7.4 mtpp -66.09 140.27 58.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.494 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 31.2 mt -117.71 98.9 52.1 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -88.38 30.08 0.44 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.984 2.456 . . . . 10.0 111.296 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 20.8 tp -59.98 -33.42 71.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.388 -178.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.24 -55.48 27.73 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 19.1 m -75.27 -28.8 20.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.774 0.321 . . . . 10.0 111.13 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.25 87.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.493 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 79.9 t -72.81 -41.11 61.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.693 0.282 . . . . 10.0 110.968 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.73 88.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.32 0.581 . . . . 10.0 110.537 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.821 ' HB1' ' HB3' ' A' ' 773' ' ' SER . . . -79.76 -30.37 40.73 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.08 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -78.06 12.06 19.79 Favored Glycine 0 CA--C 1.52 0.356 0 CA-C-N 115.853 -0.612 . . . . 10.0 113.951 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.657 HG22 ' HA ' ' A' ' 230' ' ' GLU . 10.5 t -59.3 -26.65 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 121.621 0.724 . . . . 10.0 110.808 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 18.4 tpt -153.83 90.15 1.36 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.032 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.9 m -147.78 -166.92 2.66 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.384 -0.825 . . . . 10.0 109.076 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -88.61 134.93 33.74 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.957 -0.386 . . . . 10.0 109.957 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -85.49 2.28 45.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.079 0.466 . . . . 10.0 110.645 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.54 104.47 16.85 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.362 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 52.1 tpp -144.18 147.55 33.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.992 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.575 -0.726 . . . . 10.0 110.164 179.631 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.455 HG23 ' OE2' ' A' ' 96' ' ' GLU . 92.8 t . . . . . 0 N--CA 1.479 0.984 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -78.23 132.48 37.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.173 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.99 173.33 12.95 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.886 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.31 129.28 40.47 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.138 -0.319 . . . . 10.0 110.138 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.3 mmt180 -61.85 139.52 58.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.176 -0.466 . . . . 10.0 111.897 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.8 m120 72.35 -19.16 0.3 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.057 0.943 . . . . 10.0 112.046 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -102.9 -64.85 1.04 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.825 0.345 . . . . 10.0 111.586 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -70.07 -27.73 64.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.441 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.7 p -55.67 -62.44 1.69 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.765 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 97.8 mt -62.69 -36.59 83.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.472 -0.331 . . . . 10.0 111.523 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.0 ttp-105 -63.87 -48.84 75.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.576 -0.283 . . . . 10.0 110.914 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.416 ' O ' HG23 ' A' ' 24' ' ' VAL . 26.2 mtp180 -65.85 -38.12 88.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.922 0.391 . . . . 10.0 110.042 179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.406 ' O ' HG23 ' A' ' 25' ' ' VAL . 41.8 mtt -62.29 -41.64 98.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.431 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.407 ' HD3' ' O ' ' A' ' 22' ' ' ARG . 15.5 tpp180 -61.75 -36.52 81.25 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.308 -0.406 . . . . 10.0 109.91 179.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -63.76 -37.64 88.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.205 -0.452 . . . . 10.0 109.899 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 20' ' ' ARG . 44.5 t -72.79 -37.35 54.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.849 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.507 HG13 HD12 ' A' ' 88' ' ' LEU . 36.3 t -57.84 -36.13 54.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.663 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -59.9 -40.27 88.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.182 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.1 mt -66.04 -41.88 90.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.912 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 73.8 mt -61.97 -37.61 78.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.716 -0.675 . . . . 10.0 110.414 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -66.56 -25.21 66.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.018 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -93.17 -17.58 23.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.983 0.421 . . . . 10.0 111.073 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 18.3 mtt -88.02 -25.51 23.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.022 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.491 ' HB3' ' HD3' ' A' ' 33' ' ' PRO . 20.2 tt0 -56.78 -49.7 92.27 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 116.166 -0.47 . . . . 10.0 112.01 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 51.2 Cg_exo -55.53 -28.96 67.28 Favored 'Trans proline' 0 C--N 1.363 1.323 0 C-N-CA 122.138 1.892 . . . . 10.0 112.474 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -72.66 -40.78 66.06 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.995 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 23.6 mmt -67.59 -29.86 69.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.836 -0.62 . . . . 10.0 110.483 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 23.0 mt-10 -62.89 -32.15 73.35 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.224 0.535 . . . . 10.0 110.251 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -78.13 -24.8 47.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.112 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.9 mp -72.86 142.28 47.95 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.251 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 p -75.56 172.02 13.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.712 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -58.35 -43.71 88.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.101 0.477 . . . . 10.0 110.689 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -67.93 -34.54 76.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.764 -0.653 . . . . 10.0 111.245 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -63.94 -36.05 82.68 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.547 -0.297 . . . . 10.0 110.822 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.4 mt -61.55 -46.62 89.15 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.04 -0.726 . . . . 10.0 109.04 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -65.69 -35.7 81.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.289 -0.869 . . . . 10.0 109.643 178.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.76 -36.7 92.32 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.622 -0.717 . . . . 10.0 111.311 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -67.18 -39.29 86.39 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.491 -0.559 . . . . 10.0 109.491 178.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.7 m -60.73 -45.97 92.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.738 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.48 -35.16 79.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.803 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -62.22 -42.43 99.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.311 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -59.64 -40.21 86.89 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.3 -0.409 . . . . 10.0 109.982 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 4.7 tpp180 -62.68 -43.31 99.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.767 -0.652 . . . . 10.0 109.955 179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.536 ' O ' ' HG2' ' A' ' 56' ' ' LYS . . . -67.84 -42.09 81.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.633 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 55.8 mtp180 -61.57 -40.0 93.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.74 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 33.2 mt -62.92 -34.17 76.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.168 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.59 -34.87 76.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.158 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 56.0 mmtt -76.9 -43.88 33.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.077 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 145.77 78.3 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.725 -0.75 . . . . 10.0 112.335 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -130.62 144.94 51.77 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.647 -0.501 . . . . 10.0 109.647 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.5 t -85.75 131.52 34.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.441 HD11 ' O ' ' A' ' 118' ' ' LEU . 15.5 tp -56.17 -42.38 76.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.036 0.446 . . . . 10.0 111.038 -179.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.4 mp0 -66.75 -16.22 64.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.832 -0.622 . . . . 10.0 111.537 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -88.4 -14.88 36.95 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.042 0.448 . . . . 10.0 110.536 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.4 mt -87.49 -9.93 53.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.4 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.522 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 76.4 mt -47.3 -53.29 29.75 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 113.399 0.888 . . . . 10.0 113.399 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.522 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 52.1 Cg_exo -54.37 -56.82 2.18 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.905 1.737 . . . . 10.0 113.199 -179.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -65.06 -43.41 92.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.89 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.65 -48.72 80.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.569 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -65.25 -34.0 77.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.851 -179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.04 -44.66 83.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.451 -0.341 . . . . 10.0 110.562 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.7 t -62.54 -48.6 87.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.436 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 71.4 t -61.9 -39.74 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.502 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.477 ' HD3' ' OE1' ' A' ' 32' ' ' GLU . 5.4 ttt180 -58.46 -46.13 87.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.454 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -68.9 -42.77 76.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.628 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.34 -36.79 76.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.456 . . . . 10.0 110.489 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 18.9 m -63.19 -34.06 76.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.708 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.405 ' O ' ' HA2' ' A' ' 80' ' ' GLY . 11.2 mtmm -70.47 -30.5 67.33 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.732 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.6 mtt180 -89.47 -38.8 13.79 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 48.9 t -81.47 -64.54 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.793 0.33 . . . . 10.0 111.632 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -82.07 -33.28 29.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.739 0.304 . . . . 10.0 111.816 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.405 ' HA2' ' O ' ' A' ' 76' ' ' LYS . . . 91.89 13.73 57.45 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.582 -0.818 . . . . 10.0 111.392 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 59.0 ttm -125.02 127.5 47.08 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.697 0.284 . . . . 10.0 110.267 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -78.63 131.73 36.8 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.241 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -59.91 117.38 4.97 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 179.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -58.82 154.89 14.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.194 0.521 . . . . 10.0 112.005 -178.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.68 -43.05 94.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.285 -0.87 . . . . 10.0 111.275 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 m -65.77 -29.02 45.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 10.0 111.143 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -67.22 -34.16 76.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.076 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.507 HD12 HG13 ' A' ' 25' ' ' VAL . 68.2 mt -64.15 -37.13 86.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.705 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 53.2 mt -65.31 -49.99 67.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.732 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -61.94 -36.71 93.24 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.49 -0.777 . . . . 10.0 112.325 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -62.64 -33.46 86.72 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.134 -0.555 . . . . 10.0 112.308 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.485 ' HG3' ' O ' ' A' ' 88' ' ' LEU . 56.1 mtt -74.07 -36.72 64.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.967 0.413 . . . . 10.0 110.146 179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 95.9 t -64.35 -35.57 74.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.34 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 94.2 mt -77.39 -0.8 27.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.643 -0.708 . . . . 10.0 112.195 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -83.84 -32.27 25.35 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.267 0.556 . . . . 10.0 109.924 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.455 ' OE2' HG23 ' A' ' 9' ' ' VAL . 56.3 mt-10 -98.22 -178.93 4.2 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.274 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.46 ' HG2' HD23 ' A' ' 407' ' ' LEU . 21.9 ttt85 -80.5 71.73 7.36 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.469 ' SG ' ' HB3' ' A' ' 408' ' ' ASP . 14.6 m -141.32 162.93 34.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.432 -178.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.685 HD12 HG11 ' A' ' 211' ' ' VAL . 36.3 mm -110.36 127.27 67.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.468 -0.787 . . . . 10.0 108.988 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -101.25 105.66 16.78 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.886 0.374 . . . . 10.0 111.5 -178.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.418 ' HB3' HG23 ' A' ' 393' ' ' THR . 11.1 mt-10 -76.99 107.03 9.04 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.413 -0.588 . . . . 10.0 109.413 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 55.6 mtt -104.11 -177.44 3.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.187 -0.461 . . . . 10.0 110.059 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -116.55 141.37 48.28 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.847 0.356 . . . . 10.0 111.088 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.21 106.74 2.11 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.204 179.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 138.93 -41.82 1.31 Allowed Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.803 -0.713 . . . . 10.0 111.963 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.04 -73.04 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.845 0.355 . . . . 10.0 110.554 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 159.52 126.77 0.87 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.593 -0.813 . . . . 10.0 112.445 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -109.04 -60.68 1.72 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.906 0.384 . . . . 10.0 110.177 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.77 -31.85 72.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.847 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.1 mp -72.75 -14.77 61.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.58 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 20.4 m -100.32 -30.59 11.78 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.266 0.555 . . . . 10.0 110.618 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.439 ' HB1' HD21 ' A' ' 207' ' ' LEU . . . -66.03 -9.81 34.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.415 -0.812 . . . . 10.0 112.504 -179.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.412 HG22 ' CZ ' ' A' ' 147' ' ' PHE . 0.6 OUTLIER -71.92 -22.91 61.41 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.722 0.267 . . . . 10.0 111.722 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.414 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 54.9 mt -72.58 -56.79 3.68 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.214 0.45 . . . . 10.0 112.214 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 35.5 Cg_endo -63.12 -31.13 75.64 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 122.15 1.9 . . . . 10.0 112.327 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.72 -45.92 77.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.989 -0.55 . . . . 10.0 110.51 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.427 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 62.9 t80 -63.06 -45.74 90.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.598 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.441 ' O ' HD11 ' A' ' 60' ' ' LEU . 44.7 tp -60.39 -51.79 67.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.944 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -71.38 -14.94 62.33 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.862 0.319 . . . . 10.0 111.862 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -81.77 -22.85 36.97 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.685 0.279 . . . . 10.0 110.411 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.6 mt -61.9 -31.17 71.45 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.866 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.38 -19.36 61.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.239 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 73.33 9.19 76.95 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.193 -0.527 . . . . 10.0 113.117 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -76.33 -18.33 58.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.733 0.301 . . . . 10.0 110.867 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 103.16 127.97 6.24 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.637 -0.792 . . . . 10.0 113.243 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.1 t -105.84 118.74 53.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.524 -0.547 . . . . 10.0 109.524 178.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 39.5 m170 -101.09 101.74 12.55 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.853 0.359 . . . . 10.0 111.043 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 38.3 t -92.19 116.53 33.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.767 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.507 ' HB ' HG12 ' A' ' 208' ' ' VAL . 84.0 t -105.27 114.78 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.917 -178.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -101.71 164.12 11.91 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.634 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 9.7 m -69.52 -26.95 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -148.32 175.18 11.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.718 0.294 . . . . 10.0 110.705 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -78.35 -25.44 46.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.68 -179.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.21 -56.13 26.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.724 0.297 . . . . 10.0 110.717 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.8 mt -65.78 -38.22 88.44 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.917 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.64 -51.62 69.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.798 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -70.47 -31.48 68.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.039 0.447 . . . . 10.0 110.693 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 138' ' ' ARG . 1.7 ttp180 -63.08 -57.51 10.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.806 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.23 -32.65 73.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.876 -0.602 . . . . 10.0 111.888 -178.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.502 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -59.38 -39.4 83.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.903 0.382 . . . . 10.0 111.042 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -90.4 -28.5 18.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.209 -0.45 . . . . 10.0 111.391 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -73.17 -43.95 60.71 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.537 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -89.2 -1.36 58.05 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.865 0.364 . . . . 10.0 111.15 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 58.4 ttm-85 -61.62 -49.23 87.63 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' PRO . . . . . 0.465 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 18.3 Cg_exo -66.93 -1.26 5.77 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 122.163 1.909 . . . . 10.0 112.621 -179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 7.8 tp -101.93 -52.33 3.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.202 179.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . 0.412 ' CZ ' HG22 ' A' ' 113' ' ' THR . 24.3 m-85 -69.47 -45.49 68.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.165 -0.471 . . . . 10.0 111.586 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -70.1 -15.35 62.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.111 0.481 . . . . 10.0 110.941 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -73.78 -27.39 61.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.344 178.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 66.8 mt -98.93 -11.03 22.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.384 -0.825 . . . . 10.0 110.823 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 115.19 -5.64 21.71 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.293 -0.956 . . . . 10.0 114.149 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 82.7 mt -82.29 131.19 35.23 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 117.339 0.57 . . . . 10.0 110.639 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 11.0 p -86.3 134.42 33.75 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.217 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . 0.404 HG21 ' HA ' ' A' ' 144' ' ' ARG . 40.4 t -106.83 127.34 62.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.409 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -123.22 134.89 9.67 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.764 -0.731 . . . . 10.0 111.969 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 5.4 tp -108.91 130.57 61.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.898 0.38 . . . . 10.0 110.305 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -111.89 102.3 10.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.111 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.457 ' O ' ' HB2' ' A' ' 161' ' ' MET . 97.0 mt -90.9 141.99 27.16 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.451 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' PRO . . . . . 0.423 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 32.2 Cg_exo -59.12 112.0 1.08 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.85 2.366 . . . . 10.0 112.41 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 100.12 18.68 21.32 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.995 -0.621 . . . . 10.0 112.447 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . 0.52 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 8.2 ttp -82.07 140.13 46.14 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 109.881 -0.415 . . . . 10.0 109.881 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.88 153.17 32.4 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.509 2.139 . . . . 10.0 112.832 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . 0.472 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -54.2 -49.0 92.67 Favored Pre-proline 0 CA--C 1.538 0.483 0 N-CA-C 112.939 0.718 . . . . 10.0 112.939 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.472 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 50.5 Cg_exo -55.67 -36.35 94.68 Favored 'Trans proline' 0 C--N 1.36 1.158 0 C-N-CA 121.824 1.683 . . . . 10.0 112.155 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -70.63 -43.1 69.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.41 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.52 ' HE2' ' O ' ' A' ' 161' ' ' MET . 62.5 mttm -61.34 -46.26 90.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.568 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -57.87 -39.34 77.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.059 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -68.91 -37.31 78.87 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.839 0.352 . . . . 10.0 111.204 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -74.09 -39.19 63.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.09 -0.504 . . . . 10.0 111.454 -179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -75.8 -25.06 56.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.442 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.84 -5.97 54.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.872 0.368 . . . . 10.0 110.591 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -78.78 175.7 10.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.127 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -74.12 -44.42 53.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.821 0.344 . . . . 10.0 110.537 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 70.4 mt -126.69 123.87 63.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.931 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 3.2 m -112.92 128.12 56.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.998 0.428 . . . . 10.0 111.448 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -104.24 135.24 46.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.752 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.19 173.34 44.19 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.304 -0.951 . . . . 10.0 112.826 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 1.1 m -92.35 151.81 20.08 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.151 0.18 . . . . 10.0 110.538 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -56.85 -43.44 81.17 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.673 0.62 . . . . 10.0 112.673 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 16.6 t30 -59.08 -51.94 67.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.687 0.28 . . . . 10.0 111.532 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.423 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 4.0 tp10 -66.14 -37.4 85.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.986 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -59.67 -39.78 85.61 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.88 0.372 . . . . 10.0 110.913 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -74.97 -41.8 31.7 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.738 -0.744 . . . . 10.0 111.548 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -62.95 -36.76 84.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.033 0.445 . . . . 10.0 110.389 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . 0.41 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 11.3 m-20 -60.35 -44.57 95.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.012 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -62.83 -38.14 89.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.339 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' LEU . . . . . 0.403 HD11 HG22 ' A' ' 375' ' ' ILE . 74.8 mt -63.03 -48.16 79.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.776 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 40.9 mtm-85 -67.55 -37.76 83.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.799 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -61.62 -50.36 72.87 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.514 -0.766 . . . . 10.0 111.498 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.01 1.18 28.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.754 -0.657 . . . . 10.0 112.463 -178.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 22.5 ttp -108.47 11.01 27.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.113 0.482 . . . . 10.0 110.566 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -79.31 170.67 16.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.869 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -106.34 -30.32 9.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.952 0.406 . . . . 10.0 110.451 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.32 139.65 24.11 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.169 -0.678 . . . . 10.0 109.169 178.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.87 -24.31 78.9 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.831 2.354 . . . . 10.0 113.202 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -76.96 -16.02 59.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.68 0.276 . . . . 10.0 111.125 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -76.88 -9.95 59.04 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.345 -0.389 . . . . 10.0 110.646 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -54.87 155.54 4.31 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.787 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 11.4 m -133.26 -15.4 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.784 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -87.32 -175.2 5.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.305 0.574 . . . . 10.0 111.691 -179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -145.12 -171.23 3.61 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.36 -0.837 . . . . 10.0 108.861 179.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 24.5 tttm -65.44 131.54 46.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.008 0.432 . . . . 10.0 110.637 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 19.9 mt -83.85 60.7 5.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.337 0.589 . . . . 10.0 109.629 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -76.59 -60.22 2.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.512 -0.767 . . . . 10.0 112.868 -178.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -127.83 135.0 49.46 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 111.988 0.366 . . . . 10.0 111.988 -178.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.538 ' HB2' ' CD1' ' A' ' 384' ' ' TYR . . . -133.14 126.21 31.21 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.429 -0.805 . . . . 10.0 109.751 178.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . 0.439 HD21 ' HB1' ' A' ' 112' ' ' ALA . 59.1 tp -123.07 116.06 22.86 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.117 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' VAL . . . . . 0.507 HG12 ' HB ' ' A' ' 129' ' ' VAL . 15.5 m -99.19 141.54 16.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.204 0.526 . . . . 10.0 111.21 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -64.67 -72.6 0.14 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.127 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' GLU . . . . . 0.47 ' OE1' ' HA ' ' A' ' 391' ' ' THR . 31.1 mm-40 -109.02 109.51 20.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.768 0.318 . . . . 10.0 110.82 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.685 HG11 HD12 ' A' ' 99' ' ' ILE . 34.0 m -69.32 -20.96 24.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.944 0.402 . . . . 10.0 110.653 179.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.98 -46.05 82.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.578 -0.737 . . . . 10.0 111.58 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.33 -39.4 8.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.745 0.646 . . . . 10.0 112.745 -178.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 58.6 mt -74.34 -30.33 26.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 113.225 0.824 . . . . 10.0 113.225 -177.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 215' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 219' ' ' ALA . 42.5 mt -112.7 -45.58 3.21 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.925 0.713 . . . . 10.0 112.925 -178.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 216' ' ' ILE . . . . . . . . . . . . . 37.8 mm -79.02 -65.92 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.736 0.643 . . . . 10.0 112.736 -178.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.72 -61.22 2.75 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.734 0.642 . . . . 10.0 112.734 -177.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -90.78 74.85 6.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.983 0.421 . . . . 10.0 110.724 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 215' ' ' LEU . . . -109.47 -51.38 2.88 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.251 -0.432 . . . . 10.0 111.575 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.31 3.14 36.98 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.036 -178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 1.5 m -67.85 112.72 11.35 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.54 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -91.91 126.77 0.93 Allowed 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 122.918 2.412 . . . . 10.0 113.15 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 223' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 374' ' ' SER . 58.1 mt -82.81 88.7 6.76 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.894 -0.593 . . . . 10.0 109.428 178.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 18.3 mt -94.6 113.28 28.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.88 -179.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 225' ' ' ILE . . . . . 0.435 ' HB ' HD23 ' A' ' 372' ' ' LEU . 4.0 mt -79.85 152.87 4.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.426 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 226' ' ' SER . . . . . 0.462 ' HB3' ' OD1' ' A' ' 369' ' ' ASN . 2.2 m -52.59 122.12 8.37 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.331 0.652 . . . . 10.0 112.445 -179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -72.15 144.77 36.75 Favored Glycine 0 N--CA 1.451 -0.366 0 CA-C-N 115.686 -0.688 . . . . 10.0 112.65 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -78.69 -55.77 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.559 0 C-N-CA 122.512 2.141 . . . . 10.0 112.466 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -158.88 96.47 1.35 Allowed 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.76 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . 0.556 ' OE2' ' HB3' ' A' ' 370' ' ' GLN . 3.1 mt-10 -87.68 -8.77 55.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.655 0.74 . . . . 10.0 109.143 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 231' ' ' ASP . . . . . 0.476 ' HA ' ' CE ' ' A' ' 235' ' ' MET . 2.0 t0 -154.96 177.49 11.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.451 -1.249 . . . . 10.0 108.384 178.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.575 ' HB3' ' OE2' ' A' ' 234' ' ' GLU . 70.2 m -156.95 159.7 38.35 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.891 0.377 . . . . 10.0 110.711 -179.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 233' ' ' SER . . . . . 0.461 ' HA ' ' HB ' ' A' ' 365' ' ' ILE . 1.0 OUTLIER -63.1 -31.19 72.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.981 -0.554 . . . . 10.0 111.361 -179.757 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . 0.575 ' OE2' ' HB3' ' A' ' 232' ' ' SER . 1.3 pm0 -93.88 -2.18 53.74 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.936 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 235' ' ' MET . . . . . 0.502 ' SD ' ' HA3' ' B' ' 20' ' ' GLY . 29.7 mtp -90.0 -69.18 0.74 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.363 -179.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.62 -29.02 68.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.204 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 237' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 241' ' ' LYS . 29.6 tptt -64.24 -29.36 70.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.721 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -72.97 -42.12 63.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.3 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 18.4 t -68.32 -40.63 82.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.333 0.587 . . . . 10.0 109.956 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -83.41 11.33 7.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.566 -0.743 . . . . 10.0 111.284 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 241' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 237' ' ' LYS . 3.6 tptm -92.91 -27.29 17.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.665 0.269 . . . . 10.0 111.305 -179.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 11.2 tp -90.89 -19.59 7.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.0 0.429 . . . . 10.0 111.119 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 243' ' ' ILE . . . . . 0.493 ' N ' ' HD2' ' A' ' 244' ' ' PRO . 68.0 mt -63.14 -47.71 85.08 Favored Pre-proline 0 CA--C 1.54 0.589 0 N-CA-C 112.701 0.63 . . . . 10.0 112.701 -179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 244' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 243' ' ' ILE . 56.5 Cg_endo -68.98 18.77 0.16 Allowed 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.272 1.981 . . . . 10.0 113.594 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 245' ' ' HIS . . . . . 0.412 ' H ' ' C ' ' A' ' 243' ' ' ILE . 6.1 t-80 -115.27 1.66 13.84 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.471 -0.566 . . . . 10.0 109.471 178.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 246' ' ' LEU . . . . . 0.679 HD13 ' HB2' ' A' ' 252' ' ' GLU . 15.0 mt -105.58 -169.29 1.57 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.484 -0.78 . . . . 10.0 110.079 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 7.9 pt -135.62 149.51 28.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.611 0.243 . . . . 10.0 111.44 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 248' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -84.86 73.92 10.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.17 0.509 . . . . 10.0 110.445 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 9.2 tp60 -178.95 -22.47 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.016 -0.993 . . . . 10.0 109.598 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 250' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 251' ' ' LYS . 30.1 tt0 -162.85 134.41 5.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.339 -0.846 . . . . 10.0 109.674 179.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 250' ' ' GLU . 5.8 mtmm 80.04 105.9 0.07 Allowed 'General case' 0 N--CA 1.471 0.602 0 O-C-N 124.161 0.913 . . . . 10.0 112.18 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 252' ' ' GLU . . . . . 0.679 ' HB2' HD13 ' A' ' 246' ' ' LEU . 1.4 mp0 47.93 39.3 10.71 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.005 -0.998 . . . . 10.0 112.237 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -114.7 -34.71 5.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.898 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 254' ' ' SER . . . . . 0.409 ' HA ' ' CD2' ' A' ' 257' ' ' PHE . 20.0 m -78.22 100.35 6.62 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 113.303 0.853 . . . . 10.0 113.303 -177.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -68.97 -39.75 79.28 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.168 -1.419 . . . . 10.0 107.168 176.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 62.8 m -147.5 -86.09 0.1 Allowed 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 113.655 -1.611 . . . . 10.0 107.664 177.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 257' ' ' PHE . . . . . 0.409 ' CD2' ' HA ' ' A' ' 254' ' ' SER . 77.1 m-85 62.87 -50.56 0.19 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.532 0.938 . . . . 10.0 113.532 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 69.62 18.56 7.62 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.199 0.6 . . . . 10.0 110.368 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 80.82 -49.44 3.93 Favored Glycine 0 C--N 1.33 0.247 0 CA-C-N 115.751 -0.658 . . . . 10.0 112.75 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -71.69 -41.75 68.27 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.737 0.303 . . . . 10.0 111.578 -179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 83.4 -140.72 19.99 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.625 -0.99 . . . . 10.0 110.625 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -164.93 -87.39 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.973 0.387 . . . . 10.0 110.921 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -119.6 136.07 54.53 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.85 -0.426 . . . . 10.0 109.85 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 1.8 m -80.48 41.75 0.56 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.874 0.369 . . . . 10.0 111.151 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 25.1 m -110.77 -9.88 11.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.863 0.363 . . . . 10.0 110.991 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 266' ' ' ASP . . . . . 0.528 ' OD1' ' HG2' ' A' ' 268' ' ' LYS . 4.0 t70 -156.95 174.0 16.17 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.344 -0.613 . . . . 10.0 109.344 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -135.51 1.84 2.9 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.67 0.271 . . . . 10.0 111.409 -178.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 268' ' ' LYS . . . . . 0.528 ' HG2' ' OD1' ' A' ' 266' ' ' ASP . 5.7 ptpp? -122.83 141.19 52.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.167 0.508 . . . . 10.0 111.44 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 4.1 m -83.79 95.66 8.51 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.35 -0.982 . . . . 10.0 108.35 177.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -60.56 -10.49 5.19 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.967 -0.56 . . . . 10.0 112.06 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -82.47 -13.89 55.97 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.154 -0.313 . . . . 10.0 110.154 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 50.7 t 67.94 98.82 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 O-C-N 123.679 0.612 . . . . 10.0 109.422 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.01 -66.51 1.06 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.334 0.864 . . . . 10.0 113.334 -177.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 4.2 mm? 57.47 75.19 0.38 Allowed 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.59 -0.893 . . . . 10.0 108.59 -177.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 12.6 p -112.65 -85.43 0.58 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 114.145 1.165 . . . . 10.0 114.145 -176.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 71.6 137.6 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.629 0.771 . . . . 10.0 109.814 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.46 17.64 0.13 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.728 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . -90.8 -29.18 13.73 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 111.146 -0.781 . . . . 10.0 111.146 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.511 ' O ' HG22 ' A' ' 282' ' ' ILE . 4.2 mm? 73.54 -6.88 1.67 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.345 0.658 . . . . 10.0 111.437 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 10.9 m -81.82 -26.77 9.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 120.933 0.397 . . . . 10.0 110.295 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 13.8 tp -74.41 -34.54 63.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.108 -0.497 . . . . 10.0 110.419 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 282' ' ' ILE . . . . . 0.511 HG22 ' O ' ' A' ' 279' ' ' LEU . 9.0 tp -70.26 -22.56 24.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.65 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -71.2 -34.81 71.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.146 0.498 . . . . 10.0 110.047 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -81.89 -27.26 33.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.608 -0.723 . . . . 10.0 109.915 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 285' ' ' LEU . . . . . 0.431 ' HG ' ' CG ' ' A' ' 252' ' ' GLU . 1.0 OUTLIER -68.7 -40.93 79.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.622 -0.717 . . . . 10.0 109.599 179.068 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 66.9 mt -65.73 153.38 41.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.162 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 287' ' ' VAL . . . . . 0.504 HG12 ' N ' ' A' ' 288' ' ' LYS . 23.3 t 71.49 169.6 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 109.174 -0.676 . . . . 10.0 109.174 -178.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 288' ' ' LYS . . . . . 0.504 ' N ' HG12 ' A' ' 287' ' ' VAL . 0.0 OUTLIER 78.29 150.93 0.11 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.089 0.955 . . . . 10.0 110.642 -179.695 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 64.88 -161.06 0.28 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.751 -177.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -123.12 53.87 0.73 Allowed Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.34 -0.933 . . . . 10.0 112.283 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 291' ' ' ILE . . . . . 0.592 ' HB ' ' HB3' ' B' ' 14' ' ' ALA . 7.2 tt -125.83 110.85 25.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.803 0.335 . . . . 10.0 110.433 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 56.7 tpp 55.42 65.51 1.46 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.51 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.95 6.08 8.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.179 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -85.07 174.73 9.49 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.317 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -79.05 68.4 3.1 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.103 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -133.61 174.95 9.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.789 0.328 . . . . 10.0 110.955 -179.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 86.4 p -116.92 178.32 4.39 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.243 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.79 -12.53 30.97 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.565 0.209 . . . . 10.0 111.565 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 2.7 p90 -101.01 13.94 33.56 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.173 0.511 . . . . 10.0 110.965 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 3.7 m -73.53 148.4 87.9 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.3 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -55.99 -25.6 54.5 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.971 2.448 . . . . 10.0 112.904 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -76.87 -19.24 57.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.825 0.345 . . . . 10.0 111.145 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 303' ' ' ASN . . . . . 0.584 ' OD1' ' HB2' ' A' ' 306' ' ' LEU . 63.4 t30 -101.79 94.29 5.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.965 0.412 . . . . 10.0 110.37 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 304' ' ' ILE . . . . . 0.534 HG21 ' HB1' ' A' ' 781' ' ' ALA . 2.3 tp -124.73 -55.73 2.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.328 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . 0.403 ' H ' HG23 ' A' ' 304' ' ' ILE . 0.2 OUTLIER -64.13 -38.41 90.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.049 0.452 . . . . 10.0 110.751 -179.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 306' ' ' LEU . . . . . 0.584 ' HB2' ' OD1' ' A' ' 303' ' ' ASN . 85.5 mt -75.54 -31.86 60.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.326 179.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 307' ' ' MET . . . . . . . . . . . . . 10.3 tpt -63.9 -39.24 93.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.478 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -75.57 -18.3 59.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.104 0.478 . . . . 10.0 110.178 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -74.29 -41.75 60.69 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.737 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 28.8 m -73.78 -34.04 39.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.641 0.258 . . . . 10.0 111.224 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.87 -40.04 79.49 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.12 0.486 . . . . 10.0 110.069 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 312' ' ' ALA . . . . . 0.492 ' O ' ' HG2' ' A' ' 315' ' ' ARG . . . -69.31 -30.39 68.45 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.087 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -71.08 -29.87 65.84 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.642 -0.708 . . . . 10.0 110.526 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 1.4 mp -75.16 -44.52 46.27 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.526 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 315' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 312' ' ' ALA . 37.2 ptt180 -65.17 -33.71 76.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.877 0.37 . . . . 10.0 110.08 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 316' ' ' ALA . . . . . 0.4 ' HA ' ' HB2' ' A' ' 320' ' ' PHE . . . -89.86 39.58 0.96 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.374 0.607 . . . . 10.0 110.203 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -147.73 -42.01 0.17 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.477 -0.783 . . . . 10.0 109.929 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -107.03 -47.95 3.59 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.165 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 319' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.16 -50.88 51.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.519 -179.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 320' ' ' PHE . . . . . 0.4 ' HB2' ' HA ' ' A' ' 316' ' ' ALA . 15.0 m-85 -81.4 108.53 15.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.637 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 321' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -99.04 137.21 37.89 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.549 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 322' ' ' ARG . . . . . 0.475 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 2.0 ttp180 -63.13 151.47 40.05 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.524 -0.307 . . . . 10.0 111.219 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 323' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 1.1 m-20 76.85 -46.15 0.5 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.909 0.884 . . . . 10.0 112.63 178.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 324' ' ' VAL . . . . . . . . . . . . . 8.8 p -90.17 -36.03 8.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 111.989 0.366 . . . . 10.0 111.989 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -103.02 -40.5 6.46 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.959 -0.296 . . . . 10.0 111.18 -179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -145.86 147.58 31.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.726 0.298 . . . . 10.0 110.651 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 9.1 tp -125.73 132.7 70.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 328' ' ' VAL . . . . . . . . . . . . . 13.4 t -96.9 113.17 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 110.06 -0.348 . . . . 10.0 110.06 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -158.68 153.15 24.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.295 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 61.12 23.66 13.83 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.454 0.471 . . . . 10.0 110.847 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 71.06 17.45 75.65 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.841 -0.618 . . . . 10.0 111.833 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -132.41 172.14 12.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.884 0.373 . . . . 10.0 110.769 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 62.0 t -116.9 119.87 63.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.56 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 82.3 mt -108.39 135.94 45.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.116 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 3.1 mp -81.79 127.85 39.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 121.083 0.468 . . . . 10.0 110.647 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.18 125.49 57.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.961 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -81.88 115.38 21.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.23 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -70.38 -25.26 63.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.325 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -62.18 -50.3 72.37 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -178.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.38 -18.26 10.5 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.825 0.676 . . . . 10.0 112.825 -178.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 86.81 39.56 7.52 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.622 -0.799 . . . . 10.0 111.261 -179.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -107.93 129.25 55.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.623 0.249 . . . . 10.0 110.662 -179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -80.96 98.04 7.74 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 63.2 mtt -86.36 99.05 11.34 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.088 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 345' ' ' GLN . . . . . 0.451 ' CD ' ' H ' ' A' ' 345' ' ' GLN . 0.6 OUTLIER -83.94 -26.2 29.49 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.957 179.532 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -91.86 55.89 2.97 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.931 -0.652 . . . . 10.0 112.093 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 347' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 347' ' ' ARG . 2.1 mmt85 -140.82 93.42 2.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.054 0.454 . . . . 10.0 110.541 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 7.6 ttp85 -91.03 90.87 8.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.047 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -79.9 114.74 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.2 -0.455 . . . . 10.0 111.021 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 2.5 m -75.29 -161.14 0.14 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.421 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 33.0 t70 66.33 12.48 8.65 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.466 0.65 . . . . 10.0 110.933 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 71.88 23.42 78.02 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.853 -0.612 . . . . 10.0 112.508 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 11.6 tp -58.09 -48.93 78.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.706 0.288 . . . . 10.0 111.217 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 354' ' ' HIS . . . . . 0.458 ' CE1' HE22 ' A' ' 355' ' ' GLN . 15.4 p80 -94.65 -5.76 44.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.696 -0.402 . . . . 10.0 111.117 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 355' ' ' GLN . . . . . 0.458 HE22 ' CE1' ' A' ' 354' ' ' HIS . 1.3 mp0 -65.68 -45.95 80.92 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.195 0.522 . . . . 10.0 110.061 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 356' ' ' ALA . . . . . . . . . . . . . . . -66.29 -28.79 68.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.184 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.9 -43.2 82.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.683 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . 0.604 ' OE1' ' HA ' ' A' ' 365' ' ' ILE . 83.4 mt-10 -64.2 -32.45 74.03 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.17 179.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 359' ' ' ALA . . . . . . . . . . . . . . . -78.55 -25.89 45.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.796 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -67.71 -55.97 11.13 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.419 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -91.81 -171.48 2.89 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.398 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -84.96 63.96 4.31 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.868 -0.682 . . . . 10.0 112.047 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 2.2 t -122.71 163.22 21.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.611 -0.515 . . . . 10.0 109.611 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -100.15 107.29 19.13 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.248 -0.279 . . . . 10.0 110.248 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 365' ' ' ILE . . . . . 0.604 ' HA ' ' OE1' ' A' ' 358' ' ' GLU . 2.7 mp -58.47 132.23 23.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.493 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 13.3 mm-40 -71.51 160.12 33.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.898 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -81.46 -3.31 52.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.914 0.388 . . . . 10.0 110.578 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 64.23 -177.37 0.16 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.168 -0.924 . . . . 10.0 112.224 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.462 ' OD1' ' HB3' ' A' ' 226' ' ' SER . 4.6 t30 -170.08 99.68 0.29 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.331 -0.849 . . . . 10.0 109.444 -179.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 370' ' ' GLN . . . . . 0.556 ' HB3' ' OE2' ' A' ' 230' ' ' GLU . 5.3 tt0 -147.23 -50.75 0.19 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 371' ' ' THR . . . . . 0.461 ' H ' ' CD ' ' A' ' 230' ' ' GLU . 0.2 OUTLIER -125.34 129.14 49.35 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 114.443 1.275 . . . . 10.0 114.443 -176.818 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 372' ' ' LEU . . . . . 0.552 HD12 ' HE3' ' A' ' 776' ' ' LYS . 8.9 tp -130.81 -43.18 1.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.961 -1.018 . . . . 10.0 108.505 177.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -164.67 151.09 10.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.396 -1.275 . . . . 10.0 107.868 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 374' ' ' SER . . . . . 0.45 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 20.1 m -151.23 148.69 28.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.214 0.53 . . . . 10.0 112.228 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.403 HG22 HD11 ' A' ' 187' ' ' LEU . 16.6 tt -162.03 141.12 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.135 -0.939 . . . . 10.0 109.274 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 5.7 p -96.7 148.39 22.93 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.845 -0.428 . . . . 10.0 109.845 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -58.06 -42.08 84.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 10.0 111.094 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 378' ' ' GLN . . . . . 0.538 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 0.0 OUTLIER -60.95 -29.72 69.81 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.263 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -95.78 -8.66 33.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.763 0.316 . . . . 10.0 111.011 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -83.52 -50.0 8.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.191 0.519 . . . . 10.0 109.719 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -73.91 -4.92 37.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.636 0.731 . . . . 10.0 110.007 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 15.9 ttt180 -82.96 -4.24 58.02 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.102 -0.953 . . . . 10.0 109.829 179.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.469 HD11 HH21 ' A' ' 656' ' ' ARG . 29.5 mt -106.87 4.3 27.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.597 179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.538 ' CD1' ' HB2' ' A' ' 206' ' ' ALA . 17.3 m-85 -97.58 143.46 28.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.053 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -70.74 -74.36 0.15 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.295 0.569 . . . . 10.0 110.721 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -95.0 102.89 14.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.734 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 97' ' ' ARG . 46.5 tp -109.96 118.49 36.59 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.089 -0.505 . . . . 10.0 109.99 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -132.15 161.6 32.94 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.324 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -162.75 163.05 35.02 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.41 -0.9 . . . . 10.0 112.371 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 390' ' ' MET . . . . . 0.632 ' O ' ' HB ' ' A' ' 391' ' ' THR . 27.8 mtm -124.48 178.85 5.19 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 110.096 -0.335 . . . . 10.0 110.096 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 391' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' A' ' 390' ' ' MET . 1.4 t 167.52 -177.75 0.02 OUTLIER 'General case' 0 C--O 1.234 0.276 0 O-C-N 123.774 0.671 . . . . 10.0 109.914 178.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -92.04 143.5 16.58 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.389 -0.684 . . . . 10.0 111.389 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 393' ' ' THR . . . . . 0.418 HG23 ' HB3' ' A' ' 101' ' ' GLU . 0.2 OUTLIER -55.4 108.28 0.41 Allowed 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.562 0.345 . . . . 10.0 111.671 -179.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -145.86 -19.75 0.46 Allowed 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.062 0.393 . . . . 10.0 112.062 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 31.6 t70 59.41 -101.27 0.12 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 -179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 396' ' ' THR . . . . . 0.512 HG23 ' HB3' ' A' ' 565' ' ' ARG . 5.2 m 54.52 -104.28 0.21 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 122.946 0.498 . . . . 10.0 112.29 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -81.51 32.36 0.35 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.969 0.414 . . . . 10.0 111.518 -179.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 398' ' ' ALA . . . . . 0.563 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -67.1 -18.83 65.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.99 0.424 . . . . 10.0 110.781 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -74.11 -15.29 61.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.883 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -84.74 -24.6 28.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.579 -0.282 . . . . 10.0 110.979 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 401' ' ' PHE . . . . . 0.563 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 22.5 m-85 -56.57 -54.49 45.36 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.741 0.305 . . . . 10.0 111.629 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.7 m -76.47 -8.81 57.94 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 40.7 m -95.47 -47.46 6.26 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.268 0.47 . . . . 10.0 112.268 -178.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 20.0 mt -86.13 -74.13 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.264 0.468 . . . . 10.0 112.264 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 405' ' ' TYR . . . . . 0.538 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 68.7 m-85 -78.95 -8.04 58.55 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.482 0.549 . . . . 10.0 112.482 -177.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm 62.13 58.82 1.75 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.12 0.486 . . . . 10.0 110.763 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 407' ' ' LEU . . . . . 0.48 HD13 HD11 ' A' ' 99' ' ' ILE . 2.4 mt -114.29 156.56 24.15 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.429 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . 0.469 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . 20.3 t0 -95.46 147.06 23.94 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.61 -0.885 . . . . 10.0 108.61 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 1.8 m -109.13 104.5 13.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.888 0.375 . . . . 10.0 111.324 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 5.9 t -114.71 129.01 71.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.667 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 61.5 t -90.48 123.59 42.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 110.04 -0.355 . . . . 10.0 110.04 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 50.1 t -90.73 126.65 55.17 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.842 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.17 150.39 88.42 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.556 2.171 . . . . 10.0 111.966 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 16.4 p -77.23 164.24 25.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.015 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -68.63 -35.59 77.5 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.764 -0.828 . . . . 10.0 108.764 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 55.7 mmt-85 -134.69 143.21 45.51 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 114.944 -1.025 . . . . 10.0 108.829 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -60.64 136.63 68.17 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.662 2.241 . . . . 10.0 112.896 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 73.8 mtm -84.92 130.35 34.66 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.324 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.1 mt -111.51 36.13 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.364 0.602 . . . . 10.0 109.962 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 420' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 420' ' ' ARG . 35.4 ttp180 -71.38 123.39 22.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.031 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 14.4 mttm -83.11 99.6 10.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.29 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 422' ' ' ASP . . . . . 0.537 ' OD1' ' HD2' ' A' ' 572' ' ' ARG . 9.0 m-20 -86.46 110.57 19.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.496 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 43.9 mt -94.61 157.28 37.35 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.358 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -71.42 176.29 8.21 Favored 'Trans proline' 0 C--O 1.238 0.489 0 C-N-CA 122.739 2.293 . . . . 10.0 112.894 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -86.63 115.76 24.3 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.445 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . 0.502 ' HA ' HD23 ' A' ' 426' ' ' LEU . 9.9 mt -89.7 87.36 6.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.13 0.49 . . . . 10.0 109.792 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 427' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 588' ' ' LEU . 8.9 t -86.3 126.55 40.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.748 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 428' ' ' TYR . . . . . 0.417 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 5.3 m-85 -112.14 177.49 4.63 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.234 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 84.9 mmm -71.76 -77.04 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.633 0.254 . . . . 10.0 111.396 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 67.0 p -88.12 157.51 18.82 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.96 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -61.27 -30.45 70.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.468 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -60.13 -39.96 88.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.221 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 433' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -64.84 -41.2 95.92 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.034 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 434' ' ' LYS . . . . . 0.505 ' O ' HG13 ' A' ' 438' ' ' ILE . 38.8 ttpt -59.19 -51.47 69.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.061 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 435' ' ' ILE . . . . . 0.454 ' O ' HG12 ' A' ' 439' ' ' ILE . 46.5 mm -63.1 -44.25 99.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.593 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . 0.483 ' O ' ' HG2' ' A' ' 440' ' ' GLU . 24.7 tp60 -57.65 -45.17 85.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.866 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -63.11 -37.65 88.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.805 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 438' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 434' ' ' LYS . 88.8 mt -59.67 -44.25 93.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.097 179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 439' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 435' ' ' ILE . 30.3 mm -62.09 -38.87 81.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.013 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 436' ' ' GLN . 5.9 mm-40 -65.05 -42.44 94.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.871 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . 0.6 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 15.2 t70 -67.71 -42.45 81.96 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.8 -0.444 . . . . 10.0 109.8 179.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.513 HG12 HG11 ' A' ' 452' ' ' VAL . 56.1 mt -58.07 -41.38 80.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.694 179.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -59.97 -40.9 90.69 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.15 0.5 . . . . 10.0 110.596 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.95 -28.12 69.3 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.564 -0.744 . . . . 10.0 111.074 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 14.3 mmt180 -86.11 -43.11 13.33 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.908 -179.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.54 -42.49 98.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.619 -0.264 . . . . 10.0 111.362 -179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -71.83 -9.93 59.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.471 -0.332 . . . . 10.0 111.232 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 4.1 ttmm -104.69 -4.48 22.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.331 -0.395 . . . . 10.0 110.642 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 79.3 30.15 46.97 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.837 -0.697 . . . . 10.0 112.418 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' GLN . . . . . 0.457 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 63.8 tt0 -108.33 131.28 21.86 Favored Pre-proline 0 C--N 1.327 -0.391 0 O-C-N 122.796 -0.238 . . . . 10.0 111.027 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -69.63 143.71 52.36 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.684 2.256 . . . . 10.0 111.442 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.513 HG11 HG12 ' A' ' 442' ' ' ILE . 49.0 t -120.42 125.46 74.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.874 0.369 . . . . 10.0 111.676 -178.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 32.5 tp -113.1 105.82 13.92 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.276 -0.639 . . . . 10.0 109.276 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 39.6 t -93.4 122.66 45.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.452 -179.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -105.24 91.64 0.78 Allowed Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.751 -0.738 . . . . 10.0 112.14 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.32 140.08 29.9 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.363 -0.236 . . . . 10.0 110.363 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 20.9 pt -77.76 -35.94 21.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 112.506 0.558 . . . . 10.0 112.506 -179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 7.4 p -122.99 159.45 28.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.95 0.405 . . . . 10.0 112.023 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 74.5 mt -64.72 -36.98 78.96 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -56.52 -46.63 80.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.988 -1.005 . . . . 10.0 110.327 178.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.13 -32.89 72.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.439 179.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 17.2 m -64.39 -44.44 91.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.134 179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -68.85 -40.44 79.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.322 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.9 -53.83 54.02 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.417 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.63 -31.59 54.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-O 120.92 0.39 . . . . 10.0 110.877 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 35.4 t -68.63 -41.05 80.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.119 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -59.86 -48.85 80.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.592 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -64.24 -39.51 94.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.866 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 19.8 mt -62.92 -34.43 77.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.986 0.422 . . . . 10.0 110.628 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 7.9 m -71.83 -42.73 66.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.734 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -61.75 -39.5 91.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.846 -0.616 . . . . 10.0 110.372 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -72.76 -18.27 61.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.855 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 79.72 47.93 6.95 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 121.062 -0.589 . . . . 10.0 112.706 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 65.9 mt -118.77 128.43 75.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 110.396 -0.224 . . . . 10.0 110.396 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 21.5 mmtm -62.24 129.75 42.22 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 54.9 p-80 -161.0 149.49 16.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.759 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -127.53 157.72 39.37 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.209 -0.451 . . . . 10.0 109.842 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 20.6 t -121.6 130.76 74.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.662 0.268 . . . . 10.0 111.027 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 90.3 mt -83.5 90.08 7.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.004 -0.543 . . . . 10.0 109.599 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -85.16 126.65 33.81 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.433 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -61.23 -22.83 65.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.692 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -85.93 -2.45 58.28 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.066 0.46 . . . . 10.0 110.57 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -130.49 59.41 1.65 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.312 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -61.68 -33.82 74.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.056 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.49 74.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.864 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' ASN . . . . . 0.424 ' O ' HG13 ' A' ' 490' ' ' ILE . 0.2 OUTLIER -88.54 -33.48 17.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.891 179.48 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -51.5 -57.38 9.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.715 -0.675 . . . . 10.0 111.6 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -54.2 -39.78 66.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.585 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -66.13 -35.75 81.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.246 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 486' ' ' ASN . 47.9 mt -74.66 -41.99 48.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.493 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 95.6 t -60.41 -34.83 59.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.746 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -59.6 -28.4 67.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.634 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -124.39 26.94 7.17 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.922 0.391 . . . . 10.0 110.57 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -74.55 -21.9 59.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.17 0.51 . . . . 10.0 110.655 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -94.82 16.23 61.7 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.98 -0.629 . . . . 10.0 111.737 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -74.28 138.01 75.16 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 110.115 -0.328 . . . . 10.0 110.115 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_exo -53.05 125.84 19.6 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.661 2.24 . . . . 10.0 112.952 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 69.5 22.33 6.43 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.067 0.766 . . . . 10.0 113.067 178.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -100.95 122.73 44.0 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 121.122 -0.231 . . . . 10.0 110.491 179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 35.3 t -97.95 115.64 38.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.912 0.387 . . . . 10.0 110.44 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 3.9 m -115.33 121.88 44.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.572 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 47.7 mt -101.19 124.36 54.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.271 -0.422 . . . . 10.0 109.94 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -114.44 116.54 29.03 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.817 0.342 . . . . 10.0 111.182 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 21.4 m -81.13 113.94 19.63 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.586 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 63.83 81.46 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.326 -0.852 . . . . 10.0 110.883 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 53.4 tpp -60.95 122.46 14.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.248 -0.887 . . . . 10.0 110.957 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -87.69 166.73 14.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.886 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -65.56 157.7 47.4 Favored Glycine 0 N--CA 1.453 -0.187 0 C-N-CA 121.219 -0.515 . . . . 10.0 112.471 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 68.98 -93.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.977 0.511 . . . . 10.0 110.861 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 88.8 132.78 4.42 Favored Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 121.1 -0.572 . . . . 10.0 111.843 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.62 143.28 25.24 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 122.499 0.32 . . . . 10.0 110.926 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -64.67 98.6 0.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 10.0 110.646 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 70.4 mt -73.6 101.94 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.129 0.49 . . . . 10.0 109.819 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' VAL . . . . . 0.425 ' HB ' ' O ' ' A' ' 517' ' ' GLY . 6.3 t -71.67 132.02 33.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.865 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.468 HD11 ' OD1' ' A' ' 580' ' ' ASP . 34.0 mt -66.37 125.83 26.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.591 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 93.36 -0.81 68.81 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.101 -0.571 . . . . 10.0 111.847 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' GLY . . . . . 0.425 ' O ' ' HB ' ' A' ' 514' ' ' VAL . . . 106.2 -167.91 14.58 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 110.986 -0.846 . . . . 10.0 110.986 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.9 p -127.06 98.18 5.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 117.278 0.539 . . . . 10.0 110.991 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 52.9 p-90 -58.51 -29.47 66.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.877 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -62.25 -30.01 70.81 Favored 'General case' 0 C--N 1.334 -0.077 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.783 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -86.25 -34.42 20.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.467 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -65.89 -43.95 86.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.612 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . 0.406 HG12 HD12 ' A' ' 537' ' ' ILE . 34.1 m -70.48 -20.07 22.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.94 0.4 . . . . 10.0 110.593 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -91.87 -0.1 57.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.27 -0.423 . . . . 10.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -90.29 -10.79 42.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.573 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 44.2 mt -96.04 154.0 17.47 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.834 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -72.62 -57.11 4.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.85 0.357 . . . . 10.0 110.152 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -119.2 88.6 37.76 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.975 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.05 103.3 1.16 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.996 2.464 . . . . 10.0 111.515 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 18.8 p -81.56 173.39 12.43 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.358 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.75 -43.23 80.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.484 0.183 . . . . 10.0 111.446 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 532' ' ' GLU . 1.6 mp0 -62.28 -41.02 98.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.887 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -68.24 -44.43 75.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.952 0.406 . . . . 10.0 110.408 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 90.3 mt -64.33 -42.48 95.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.254 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -64.89 -42.52 94.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.481 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -58.32 -51.6 69.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.344 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . 0.406 HD12 HG12 ' A' ' 523' ' ' VAL . 96.7 mt -64.83 -37.31 79.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.29 -0.413 . . . . 10.0 110.665 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -62.18 -47.68 83.41 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.977 0.418 . . . . 10.0 110.303 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -69.54 -37.82 77.24 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.504 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . 0.576 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 13.2 t70 -61.31 -49.13 78.28 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.512 -0.767 . . . . 10.0 109.238 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -60.43 -39.81 88.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.867 -1.061 . . . . 10.0 110.337 179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 41.7 tp60 -52.05 -48.61 64.52 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.308 0.38 . . . . 10.0 110.914 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 26.0 t -60.09 -47.44 91.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.91 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 544' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 6.2 mtm180 -67.99 -35.73 78.82 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.925 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -64.29 -48.55 75.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.474 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.37 -31.23 71.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.458 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.5 94.76 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.434 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 548' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 544' ' ' ARG . 99.4 t -65.43 -37.64 80.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.464 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 79.0 mt -63.23 -45.82 89.85 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.048 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -70.18 -18.41 63.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.022 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 551' ' ' ALA . . . . . 0.457 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -82.92 -28.46 29.9 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.961 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 129.97 6.34 4.06 Favored Glycine 0 CA--C 1.519 0.324 0 C-N-CA 120.445 -0.883 . . . . 10.0 113.302 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 84.12 -167.6 43.78 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.67 -0.776 . . . . 10.0 112.43 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 36.6 tp -71.67 119.56 16.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.908 0.385 . . . . 10.0 110.879 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -91.45 118.94 30.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.748 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 25.3 mm -103.22 134.99 42.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.289 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 557' ' ' ILE . . . . . . . . . . . . . 40.6 mt -126.48 121.59 59.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.018 0.437 . . . . 10.0 110.691 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.38 115.71 4.99 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.115 -0.794 . . . . 10.0 111.115 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 20.5 p -71.51 -40.3 70.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.021 0.439 . . . . 10.0 111.266 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -137.55 151.27 48.21 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.036 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 561' ' ' ARG . . . . . 0.588 ' HB2' HD22 ' A' ' 594' ' ' LEU . 3.5 mmt85 -90.88 150.7 21.42 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.339 -0.615 . . . . 10.0 109.339 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -94.94 146.24 24.37 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.806 -0.358 . . . . 10.0 110.588 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -59.46 -51.95 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . 0.408 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.1 OUTLIER -75.05 117.27 16.71 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.233 -0.894 . . . . 10.0 110.127 179.039 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 565' ' ' ARG . . . . . 0.532 ' HA ' ' HB3' ' A' ' 568' ' ' ASP . 17.1 tpt180 -66.33 -26.62 67.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.125 -0.488 . . . . 10.0 110.216 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -58.87 -36.84 75.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.526 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 59.9 mt -92.75 -34.78 6.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.646 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 568' ' ' ASP . . . . . 0.532 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 2.2 t70 -60.89 -44.81 96.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.101 0.477 . . . . 10.0 110.693 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -69.55 -24.82 63.77 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.933 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -66.52 -26.83 67.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.747 0.308 . . . . 10.0 110.49 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.405 ' O ' ' HG2' ' A' ' 574' ' ' ARG . 57.2 tp -73.13 -33.94 65.82 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.327 -0.62 . . . . 10.0 109.327 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 572' ' ' ARG . . . . . 0.537 ' HD2' ' OD1' ' A' ' 422' ' ' ASP . 13.5 ttp180 -76.66 -30.68 56.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.078 179.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -81.82 27.77 3.34 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 121.011 -0.614 . . . . 10.0 113.525 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 574' ' ' ARG . . . . . 0.405 ' HG2' ' O ' ' A' ' 571' ' ' LEU . 0.3 OUTLIER -77.46 -54.92 5.85 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 179.075 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.78 172.63 10.65 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.994 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 85.11 47.39 5.27 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.692 -0.766 . . . . 10.0 111.573 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 577' ' ' ARG . . . . . 0.584 ' H ' ' HB3' ' A' ' 580' ' ' ASP . 54.4 mtt180 -108.53 121.16 44.39 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.185 -0.302 . . . . 10.0 110.185 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 59.46 28.99 18.5 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.701 0.63 . . . . 10.0 112.701 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 104.75 4.47 42.54 Favored Glycine 0 N--CA 1.454 -0.111 0 C-N-CA 120.292 -0.956 . . . . 10.0 113.866 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 580' ' ' ASP . . . . . 0.584 ' HB3' ' H ' ' A' ' 577' ' ' ARG . 0.9 OUTLIER -67.79 157.8 33.93 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.942 0.371 . . . . 10.0 110.253 179.23 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -92.7 -103.99 0.12 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.572 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 97.75 175.61 33.78 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.696 -0.764 . . . . 10.0 112.3 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -153.8 120.63 5.63 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.328 -0.249 . . . . 10.0 110.328 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.97 119.64 34.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.818 0.342 . . . . 10.0 110.864 -179.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -117.51 113.54 22.15 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.136 -0.483 . . . . 10.0 109.959 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -102.87 147.0 27.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.897 0.379 . . . . 10.0 111.035 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 587' ' ' TYR . . . . . 0.489 ' HB3' ' HG3' ' A' ' 434' ' ' LYS . 31.4 m-85 -135.33 158.14 45.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.474 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 588' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 427' ' ' VAL . 10.1 tp -165.78 163.26 18.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.239 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 589' ' ' SER . . . . . 0.517 ' O ' ' HB2' ' A' ' 592' ' ' ASP . 0.6 OUTLIER -124.1 159.48 29.88 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.558 -0.292 . . . . 10.0 110.33 179.275 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 590' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 428' ' ' TYR . 77.9 mmm -74.7 -17.95 60.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.222 0.534 . . . . 10.0 110.282 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -111.03 24.17 13.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.275 -0.875 . . . . 10.0 109.088 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 592' ' ' ASP . . . . . 0.517 ' HB2' ' O ' ' A' ' 589' ' ' SER . 0.9 OUTLIER -76.32 176.82 7.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.127 -0.942 . . . . 10.0 111.954 -178.71 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -82.32 -28.65 31.54 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.661 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.588 HD22 ' HB2' ' A' ' 561' ' ' ARG . 9.3 tp -70.62 -13.42 62.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.957 -0.565 . . . . 10.0 111.142 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 16.3 mmt -76.06 12.08 1.26 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.969 0.414 . . . . 10.0 111.559 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.516 ' NH1' ' HA ' ' A' ' 596' ' ' ARG . 10.9 mmm180 -110.87 -4.03 15.4 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.572 -0.286 . . . . 10.0 111.059 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.506 HG12 ' O ' ' A' ' 594' ' ' LEU . 28.0 pt -82.82 -10.16 11.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 121.22 0.533 . . . . 10.0 110.459 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -87.8 3.85 46.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.53 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.42 -83.2 0.03 OUTLIER 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.281 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 3.2 m -69.96 125.47 26.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.864 0.364 . . . . 10.0 110.825 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -69.36 -15.95 63.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 10.0 110.984 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 602' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 602' ' ' ARG . 4.5 mmt180 -64.94 -32.48 74.22 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.051 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.5 t -61.95 -55.35 24.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.21 0.528 . . . . 10.0 109.69 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 3.6 m -66.19 -35.52 80.65 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.576 -0.738 . . . . 10.0 110.675 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -65.57 -38.01 94.24 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.972 -0.632 . . . . 10.0 112.453 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 29.9 tpp -73.13 -26.07 61.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.098 0.475 . . . . 10.0 110.757 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 51.9 mtt -72.35 -12.6 61.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.73 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -76.13 -7.19 54.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.019 0.438 . . . . 10.0 110.725 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -83.25 9.37 10.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.085 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 6.3 mp -80.9 -16.01 54.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.014 0.435 . . . . 10.0 110.478 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 89.97 -48.61 3.25 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.0 -0.619 . . . . 10.0 112.562 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 69.3 -66.65 0.25 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.394 0.677 . . . . 10.0 111.387 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt 66.32 94.23 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.249 0 O-C-N 123.527 0.517 . . . . 10.0 110.686 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 614' ' ' PRO . . . . . 0.417 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 65.1 Cg_exo -50.29 107.85 0.19 Allowed 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 123.26 2.64 . . . . 10.0 112.994 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 118.82 -17.47 10.88 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.734 -0.746 . . . . 10.0 112.288 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -93.8 132.68 37.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.953 0.406 . . . . 10.0 110.788 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -102.9 91.6 4.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.475 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 6.4 tp -66.75 -35.69 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.548 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 47.45 66.7 0.95 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.576 -0.738 . . . . 10.0 112.193 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 3.3 m170 -109.04 114.73 57.88 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.606 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.86 -15.88 40.85 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.158 2.572 . . . . 10.0 114.207 -178.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -63.58 -29.02 70.33 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.75 -0.38 . . . . 10.0 110.494 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 23.4 t -69.44 -46.16 76.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 87.9 m -59.21 -44.08 92.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.015 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.47 -31.7 72.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.97 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -70.9 -40.84 71.94 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.944 -0.391 . . . . 10.0 109.944 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 97.2 mt -66.53 -49.11 77.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.434 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -58.66 -35.88 73.27 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.968 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -64.92 -41.05 95.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.935 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -69.53 -40.63 76.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.894 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 631' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 -60.17 -44.17 95.25 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.314 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 52.9 ttt85 -65.67 -32.6 74.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.35 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 55.4 mttt -65.27 -35.95 82.6 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.649 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 634' ' ' VAL . . . . . . . . . . . . . 96.8 t -63.47 -44.17 98.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 109.253 -0.647 . . . . 10.0 109.253 178.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.408 ' OE2' ' HA ' ' A' ' 564' ' ' SER . 6.8 mm-40 -66.0 -39.12 90.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.383 -0.826 . . . . 10.0 110.096 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 19.7 m -64.62 -33.52 76.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.048 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -66.94 -36.5 82.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.28 0.562 . . . . 10.0 109.532 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -64.7 -36.83 85.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.309 -0.86 . . . . 10.0 110.007 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -59.04 -40.29 84.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.467 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -61.28 -41.35 96.81 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.077 0.465 . . . . 10.0 110.185 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 43.2 mt -66.35 -42.46 90.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.986 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 642' ' ' ARG . . . . . 0.606 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 2.1 mmm180 -62.68 -42.06 99.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.98 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 17.7 ttpt -59.64 -40.7 88.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.336 -0.847 . . . . 10.0 110.687 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -63.17 -39.31 94.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.281 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 78.6 mt -69.5 -38.62 77.69 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.38 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 646' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 89.9 mt -60.1 -36.33 77.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.143 -0.48 . . . . 10.0 110.881 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -68.13 -20.65 64.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.494 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -96.02 -44.15 7.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.19 0.519 . . . . 10.0 110.361 179.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -69.18 -27.86 65.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.839 -0.619 . . . . 10.0 112.026 -178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 650' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -65.28 -30.92 71.83 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.146 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 651' ' ' VAL . . . . . 0.557 ' O ' ' HG3' ' A' ' 655' ' ' GLN . 30.1 t -62.7 -46.7 95.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.57 -30.44 68.23 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.826 -0.625 . . . . 10.0 110.152 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 653' ' ' ASN . . . . . 0.472 ' HA ' ' NH1' ' A' ' 656' ' ' ARG . 13.9 t30 -66.67 -48.0 70.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.539 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.81 -47.24 85.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.869 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 655' ' ' GLN . . . . . 0.557 ' HG3' ' O ' ' A' ' 651' ' ' VAL . 41.4 mt-30 -64.51 -38.69 91.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.257 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 656' ' ' ARG . . . . . 0.472 ' NH1' ' HA ' ' A' ' 653' ' ' ASN . 18.9 ttp-105 -63.7 -48.46 77.0 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.506 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -61.83 -43.92 97.88 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.537 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -62.93 -50.89 69.06 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.869 -179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 659' ' ' ILE . . . . . 0.455 HG13 HD21 ' A' ' 771' ' ' LEU . 7.5 tp -69.49 -34.97 64.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 111.984 0.364 . . . . 10.0 111.984 -178.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -68.1 -36.35 79.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.567 0.222 . . . . 10.0 110.584 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 51.3 m -62.0 -48.09 81.89 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -63.6 -45.24 91.27 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.675 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 34.6 ttt-85 -60.4 -35.47 75.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.821 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -71.04 -38.02 72.55 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.686 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -61.93 -49.4 76.3 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.986 -0.376 . . . . 10.0 109.986 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 666' ' ' LEU . . . . . 0.471 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 49.4 mt -66.78 -18.25 65.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.795 -0.638 . . . . 10.0 110.713 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 39.5 tp -81.28 -41.57 21.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.731 -0.668 . . . . 10.0 111.008 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -78.65 -40.08 35.19 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.563 0.579 . . . . 10.0 112.563 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 27.4 m -59.68 140.0 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 121.403 0.621 . . . . 10.0 111.58 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 4.1 m -92.8 -10.08 38.14 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.683 -0.689 . . . . 10.0 110.823 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -130.28 160.97 32.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.026 -0.534 . . . . 10.0 109.946 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 672' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.01 14.41 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.877 0.37 . . . . 10.0 111.017 -178.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 5.7 m -54.21 -58.73 6.26 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.851 0.358 . . . . 10.0 111.827 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 674' ' ' GLU . . . . . 0.415 ' HA ' ' OE2' ' A' ' 674' ' ' GLU . 5.0 mm-40 -63.52 -34.83 78.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 10.0 112.018 -179.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 675' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -45.92 87.05 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.794 0.331 . . . . 10.0 110.272 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 676' ' ' ILE . . . . . 0.493 ' O ' ' HB2' ' A' ' 680' ' ' ARG . 36.0 mm -67.43 -37.68 79.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.142 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -63.71 -47.75 79.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.216 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 44.8 m -55.42 -48.29 74.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.154 -0.475 . . . . 10.0 111.745 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 679' ' ' ILE . . . . . 0.435 ' O ' HG23 ' A' ' 683' ' ' VAL . 42.5 pt -75.71 -25.49 17.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.732 -0.387 . . . . 10.0 111.291 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 680' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 676' ' ' ILE . 27.4 ttm-85 -61.66 -45.51 93.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.989 0.423 . . . . 10.0 110.396 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 681' ' ' GLU . . . . . 0.54 ' HG2' HD21 ' A' ' 740' ' ' LEU . 30.0 mt-10 -68.14 -26.89 66.0 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.644 -0.707 . . . . 10.0 111.0 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -80.45 -48.42 12.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.026 -0.533 . . . . 10.0 111.35 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 683' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 679' ' ' ILE . 79.1 t -59.84 -47.93 89.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.44 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -60.86 -39.72 90.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.17 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -61.71 -48.93 78.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.413 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.84 -39.72 82.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.158 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 10.5 m -64.72 -39.47 93.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.374 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.7 mt -70.47 -48.02 62.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.621 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 689' ' ' ASP . . . . . 0.409 ' HA ' ' O ' ' A' ' 692' ' ' ILE . 4.5 m-20 -58.36 -29.08 65.7 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.873 -179.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -65.13 -26.97 68.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.806 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -115.81 -17.23 11.08 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.824 0.345 . . . . 10.0 111.457 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 692' ' ' ILE . . . . . 0.506 HG23 ' CD1' ' A' ' 701' ' ' TRP . 67.0 mt -128.21 105.53 19.84 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.432 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.16 138.64 52.5 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.46 2.107 . . . . 10.0 111.422 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -51.18 108.69 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 123.056 2.504 . . . . 10.0 113.465 -179.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 59.17 80.78 0.18 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.678 -0.692 . . . . 10.0 111.482 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 3.5 p -137.23 -164.35 1.57 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.434 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 89.9 mt -85.69 146.79 26.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.709 -0.223 . . . . 10.0 110.917 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . 0.452 ' HA ' ' CE3' ' A' ' 701' ' ' TRP . 19.5 tt0 -58.07 -39.11 77.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.434 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.17 -16.93 64.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.957 0.408 . . . . 10.0 111.422 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 24.2 ttt -87.0 -14.47 41.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.229 0.538 . . . . 10.0 110.115 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 701' ' ' TRP . . . . . 0.506 ' CD1' HG23 ' A' ' 692' ' ' ILE . 43.8 m0 -84.5 120.22 26.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.617 -0.719 . . . . 10.0 110.28 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -85.9 81.72 8.43 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 703' ' ' ILE . . . . . 0.482 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.9 mm -60.98 -48.82 91.45 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.872 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 704' ' ' PRO . . . . . 0.482 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 50.9 Cg_exo -54.94 -49.12 17.73 Favored 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 122.091 1.861 . . . . 10.0 112.192 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -63.9 -43.18 97.91 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.89 -0.671 . . . . 10.0 112.223 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.517 ' O ' ' HG ' ' A' ' 710' ' ' LEU . 54.0 tp -63.94 -42.13 97.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.547 0.213 . . . . 10.0 110.847 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 707' ' ' GLN . . . . . 0.48 ' O ' ' HD3' ' A' ' 711' ' ' LYS . 9.3 mt-30 -62.03 -50.73 70.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.759 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -60.98 -36.17 78.74 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -62.31 -48.23 80.75 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.278 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 710' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 706' ' ' LEU . 88.0 mt -64.33 -34.69 78.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.787 0.327 . . . . 10.0 111.219 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 707' ' ' GLN . 8.6 mtpp -74.89 -14.91 60.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.261 -0.427 . . . . 10.0 112.125 -179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -110.15 -45.17 3.63 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.743 0.306 . . . . 10.0 111.618 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -73.06 -41.99 63.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.393 -0.367 . . . . 10.0 111.322 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -109.66 -8.51 14.95 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.988 -0.285 . . . . 10.0 111.7 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 715' ' ' ASP . . . . . 0.485 ' HB2' ' HA ' ' A' ' 828' ' ' LYS . 0.2 OUTLIER 61.64 29.74 18.3 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.098 179.741 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 36.7 tp -117.01 127.73 54.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.861 0.362 . . . . 10.0 110.721 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -90.1 106.38 18.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.39 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 41.7 mt -118.26 119.58 33.09 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.918 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.13 71.38 6.71 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.948 2.432 . . . . 10.0 112.254 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 58.0 mt -64.34 -42.37 95.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.843 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -63.38 -27.88 69.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.963 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 722' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -73.69 -47.24 41.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.309 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 37.4 m0 -66.7 -40.44 88.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.18 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 35.5 tp -58.94 -24.24 62.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.506 -0.77 . . . . 10.0 112.88 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.17 -28.95 13.87 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.814 0.302 . . . . 10.0 111.814 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -86.8 -36.82 18.32 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.178 0.436 . . . . 10.0 112.178 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -120.83 90.07 46.15 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-O 120.739 0.304 . . . . 10.0 110.916 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.31 -14.57 34.48 Favored 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.506 2.138 . . . . 10.0 111.663 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.17 -6.59 53.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.754 -0.657 . . . . 10.0 111.388 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 50.0 mt -68.79 -37.56 79.36 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.801 0.334 . . . . 10.0 110.458 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 54.57 -101.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.461 -0.791 . . . . 10.0 111.806 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.84 -55.35 0.77 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.775 0.322 . . . . 10.0 111.296 -178.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -56.4 -54.91 40.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.542 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 1.8 m -63.11 -28.61 70.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.996 0.426 . . . . 10.0 110.982 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 5.5 tp -65.24 -43.23 92.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 179.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -60.57 -46.92 88.41 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.441 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -58.44 -46.0 87.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.535 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 26.4 mmm-85 -56.92 -41.46 78.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.071 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 96.3 mt -66.9 -47.32 82.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.723 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 740' ' ' LEU . . . . . 0.54 HD21 ' HG2' ' A' ' 681' ' ' GLU . 60.1 tp -62.8 -51.4 67.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.815 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -60.49 -44.19 96.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.739 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -59.82 -35.62 75.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.626 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 20.3 m -69.16 -40.57 78.07 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.454 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 744' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 740' ' ' LEU . 76.3 mt -64.46 -38.59 82.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.312 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.18 -53.79 54.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.756 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 48.5 t -61.45 -37.29 77.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.422 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -60.63 -46.01 91.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.624 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -61.52 -39.84 92.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.847 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 749' ' ' ARG . . . . . . . . . . . . . 16.6 mtp180 -62.1 -37.13 83.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.615 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -70.41 -39.56 74.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.096 0.474 . . . . 10.0 110.1 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 51.2 tt0 -59.89 -37.98 80.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.5 -0.773 . . . . 10.0 111.41 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -61.19 -24.61 66.44 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.888 0.329 . . . . 10.0 111.888 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 34.1 t -88.44 -46.08 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.84 0.352 . . . . 10.0 111.374 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.0 -39.17 50.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.91 0.386 . . . . 10.0 111.327 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 123.64 138.24 5.14 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.169 -0.772 . . . . 10.0 111.169 -179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 756' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -58.51 -60.63 3.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.86 0.362 . . . . 10.0 111.811 -178.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -66.71 -34.24 77.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.908 0.385 . . . . 10.0 110.74 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 8.4 tpt -63.68 -42.52 98.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.484 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 59.3 mmm -62.75 -41.72 99.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.331 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.3 mmp_? -58.2 -39.03 77.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.084 0.469 . . . . 10.0 110.3 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.89 -37.11 72.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.175 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -66.7 -48.81 68.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.024 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -58.42 -46.3 86.73 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.155 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 764' ' ' LYS . . . . . 0.471 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 79.2 tttt -59.48 -45.17 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.989 -0.551 . . . . 10.0 110.108 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.53 -43.28 99.25 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.758 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 55.6 t -62.1 -42.96 97.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.615 0.245 . . . . 10.0 110.416 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 31.3 mtp -61.43 -50.79 71.4 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.363 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 97.2 mt -61.04 -45.15 95.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.897 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 769' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' B' ' 24' ' ' ALA . 41.1 tt0 -59.53 -52.18 66.68 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.025 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 13.5 m -58.6 -45.94 88.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.758 0.313 . . . . 10.0 111.024 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . 0.455 HD21 HG13 ' A' ' 659' ' ' ILE . 7.1 tt -62.11 -46.05 90.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.466 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -62.75 -45.67 91.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.851 -0.613 . . . . 10.0 111.094 -179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 773' ' ' SER . . . . . 0.568 ' HB3' ' HB3' ' B' ' 22' ' ' MET . 15.7 m -63.44 -44.41 94.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.718 -0.674 . . . . 10.0 111.094 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 22.8 mt -65.73 -40.07 91.79 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.841 0.353 . . . . 10.0 110.838 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 45.8 t-105 -59.9 -39.25 84.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.927 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.552 ' HE3' HD12 ' A' ' 372' ' ' LEU . 25.1 mttp -61.39 -48.67 80.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.289 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 12.6 tm-20 -65.87 -44.23 85.99 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 778' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -57.32 -33.5 67.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.471 -0.786 . . . . 10.0 111.426 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.6 mt -61.91 -53.67 52.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.745 0.307 . . . . 10.0 110.593 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -66.91 -40.31 87.65 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.801 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 781' ' ' ALA . . . . . 0.534 ' HB1' HG21 ' A' ' 304' ' ' ILE . . . -59.04 -43.95 91.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.762 -0.654 . . . . 10.0 111.495 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 782' ' ' MET . . . . . . . . . . . . . 63.2 mmm -61.38 -49.25 77.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.427 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 783' ' ' ASP . . . . . 0.539 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 10.4 t70 -66.19 -39.11 89.43 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.924 -0.31 . . . . 10.0 111.099 -179.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -61.05 -34.52 75.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.87 0.367 . . . . 10.0 110.92 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 26.3 tp -79.52 -33.98 41.58 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 178.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 786' ' ' ARG . . . . . 0.408 ' O ' HG12 ' A' ' 789' ' ' ILE . 48.5 ttt180 -62.68 -40.77 98.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.921 -1.036 . . . . 10.0 110.999 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 787' ' ' GLN . . . . . 0.539 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 10.7 pt20 -88.48 9.05 25.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.148 0.499 . . . . 10.0 110.474 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -114.72 31.11 6.5 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.9 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 789' ' ' ILE . . . . . 0.408 HG12 ' O ' ' A' ' 786' ' ' ARG . 23.7 mm -78.37 65.16 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 121.773 0.797 . . . . 10.0 110.438 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 11.2 m80 -127.21 -60.62 1.19 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.628 -0.878 . . . . 10.0 108.628 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 99.4 mt -87.28 -3.51 59.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.934 178.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -105.56 10.4 33.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.582 -0.736 . . . . 10.0 109.551 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -137.12 146.37 18.28 Favored Glycine 0 N--CA 1.445 -0.73 0 CA-C-N 115.56 -0.746 . . . . 10.0 111.664 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 5.0 p90 -144.21 -174.49 4.3 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 110.461 -0.2 . . . . 10.0 110.461 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -77.16 158.66 30.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.319 -0.401 . . . . 10.0 111.125 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 67.22 15.8 10.07 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.549 -0.75 . . . . 10.0 111.284 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 9.8 tptm -139.47 145.93 39.41 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.076 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -98.23 143.49 26.38 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -52.65 -34.44 63.67 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.435 2.09 . . . . 10.0 112.074 178.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 800' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.76 154.56 33.91 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 178.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 74.87 -52.58 0.67 Allowed 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.945 0.498 . . . . 10.0 109.786 -178.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -62.03 -51.37 68.27 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.157 -0.474 . . . . 10.0 109.955 179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -62.31 -31.41 72.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.378 0.608 . . . . 10.0 109.972 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -67.4 -32.69 73.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.72 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 38.2 mtm105 -57.3 -47.52 81.28 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.251 0.548 . . . . 10.0 109.734 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 806' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.48 -43.69 76.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.389 -0.823 . . . . 10.0 110.756 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 17.2 m -60.29 -44.19 95.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.737 -0.665 . . . . 10.0 112.01 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -69.27 -43.17 74.45 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.159 -0.216 . . . . 10.0 110.89 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 19.4 m -61.73 -39.06 90.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.946 0.403 . . . . 10.0 110.261 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 37.4 ttm -64.01 -40.38 96.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.168 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -68.02 -40.35 82.95 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.387 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.19 91.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.369 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -63.03 -36.12 82.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.368 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 12.8 ttt -62.9 -45.47 92.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.446 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 96.5 mt -63.9 -42.43 97.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.936 -0.575 . . . . 10.0 110.541 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -63.84 -37.39 87.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.189 -0.459 . . . . 10.0 110.432 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 37.4 m -72.3 -30.7 65.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.617 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 24.6 tp -56.97 -57.61 11.76 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.99 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 40.9 pttt -65.26 -32.48 74.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.959 0.409 . . . . 10.0 110.513 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -61.82 -58.4 8.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.616 -0.72 . . . . 10.0 110.934 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -62.9 -36.62 83.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 10.0 111.852 -178.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 39.9 t -61.58 -54.62 32.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 120.643 0.259 . . . . 10.0 110.655 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 41.1 mm -63.42 -38.99 83.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.698 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 40.7 t -60.23 -50.69 72.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.738 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 28.5 m -59.43 -45.76 90.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.703 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 92.8 mt -62.32 -24.86 67.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 10.0 112.047 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 6.6 m -94.59 -37.86 11.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.687 0.279 . . . . 10.0 111.403 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 828' ' ' LYS . . . . . 0.485 ' HA ' ' HB2' ' A' ' 715' ' ' ASP . 29.4 mtpp -69.29 -25.42 64.24 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.536 0.569 . . . . 10.0 112.536 -178.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.08 115.34 9.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.43 0.634 . . . . 10.0 110.404 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -100.97 140.15 35.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.898 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 6.9 m -130.65 174.75 12.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.081 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 13.5 ptt-85 -73.26 100.4 3.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.117 0.484 . . . . 10.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 1.6 ttp -106.32 103.63 46.53 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.137 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -78.82 -175.35 2.7 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.679 2.253 . . . . 10.0 111.613 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -66.78 125.02 24.55 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.029 0.442 . . . . 10.0 110.585 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.555 -0.736 . . . . 10.0 109.73 179.715 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.1 tmm? . . . . . 0 N--CA 1.479 1.005 0 N-CA-C 109.799 -0.445 . . . . 10.0 109.799 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -74.81 152.56 38.98 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.639 0.257 . . . . 10.0 110.318 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 19.7 mt -81.15 78.73 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.376 0.608 . . . . 10.0 110.04 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 7.3 m -90.56 103.83 16.48 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.624 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 89.7 mt -74.12 77.52 1.75 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.133 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.15 134.62 43.91 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.145 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -92.06 134.25 35.0 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.041 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 13.6 mtm-85 -86.5 -142.59 0.1 Allowed 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.825 -0.805 . . . . 10.0 108.825 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 -85.25 158.12 20.41 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.785 -0.766 . . . . 10.0 109.97 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 13.9 ptpt -59.48 156.68 12.68 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.385 0.612 . . . . 10.0 112.472 -178.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mp -114.71 100.52 53.43 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 115.569 -0.741 . . . . 10.0 110.397 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -73.43 71.7 3.75 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.665 2.243 . . . . 10.0 111.783 179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 36.4 mt -119.91 -88.4 0.62 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.211 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . 0.592 ' HB3' ' HB ' ' A' ' 291' ' ' ILE . . . -76.82 -21.55 54.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.986 0.422 . . . . 10.0 110.802 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -69.57 -21.35 24.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.278 0.561 . . . . 10.0 109.848 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -74.2 -16.96 60.96 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.747 -0.661 . . . . 10.0 110.263 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 78.5 t -63.66 -32.67 57.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.092 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . 0.481 ' HB2' HD11 ' A' ' 306' ' ' LEU . . . -64.19 -41.4 97.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.137 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.6 -12.66 60.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.721 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . 0.502 ' HA3' ' SD ' ' A' ' 235' ' ' MET . . . -71.71 -33.67 63.25 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 111.563 -0.615 . . . . 10.0 111.563 179.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 10.9 t -69.36 -22.12 25.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.773 0.797 . . . . 10.0 109.424 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.568 ' HB3' ' HB3' ' A' ' 773' ' ' SER . 27.8 mtt -92.59 56.02 2.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.981 -1.009 . . . . 10.0 110.379 -179.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 74.4 m -85.86 95.61 9.5 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.278 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 769' ' ' GLN . . . -156.74 56.86 0.54 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.482 . . . . 10.0 110.265 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -83.34 141.83 31.49 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.824 -179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -76.88 -14.82 59.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.946 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 12.9 tpt -72.46 140.01 48.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.457 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.456 -0.783 . . . . 10.0 110.687 -179.985 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 110.052 -0.351 . . . . 10.0 110.052 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -68.11 130.38 42.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.728 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 142.43 163.26 9.6 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.804 -0.713 . . . . 10.0 112.157 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.94 160.57 9.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.795 0.331 . . . . 10.0 110.692 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.566 ' HD3' ' OD2' ' A' ' 408' ' ' ASP . 3.9 mmp_? -77.05 146.52 37.26 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 60.63 -89.88 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.93 -1.032 . . . . 10.0 113.685 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -46.22 -62.9 1.14 Allowed 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.905 1.076 . . . . 10.0 113.905 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 16' ' ' ARG . 4.9 tpt180 -66.17 -31.67 72.66 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.809 0.3 . . . . 10.0 111.809 -178.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.403 ' O ' ' HG3' ' A' ' 21' ' ' MET . 0.2 OUTLIER -66.46 -48.77 68.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.726 0.298 . . . . 10.0 110.899 -179.835 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.9 mt -60.92 -36.18 78.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.364 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -47.01 87.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.86 0.362 . . . . 10.0 110.375 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 20' ' ' ARG . 2.6 ttp85 -67.21 -33.85 76.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.095 0.474 . . . . 10.0 110.354 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.683 ' HG2' ' SD ' ' A' ' 92' ' ' MET . 62.1 mtt -69.86 -37.4 76.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.334 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.7 tpp180 -62.07 -33.73 74.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.111 -0.495 . . . . 10.0 109.996 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -63.21 -41.14 99.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.766 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.6 t -68.2 -36.65 76.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.659 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.434 HG13 HD12 ' A' ' 88' ' ' LEU . 46.2 t -60.24 -37.59 74.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.078 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -62.55 -38.92 91.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.581 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.9 mt -68.12 -42.54 85.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.938 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 79.1 mt -60.78 -39.55 82.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.288 0.565 . . . . 10.0 109.843 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -67.86 -21.97 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.819 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -86.45 -23.1 26.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.58 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.9 mmt -84.77 -23.01 29.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.616 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.61 ' O ' ' HG3' ' A' ' 36' ' ' GLU . 16.3 tt0 -55.84 -52.11 75.0 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 112.423 0.527 . . . . 10.0 112.423 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 75.8 Cg_exo -52.23 -37.41 70.24 Favored 'Trans proline' 0 C--N 1.361 1.195 0 C-N-CA 121.957 1.771 . . . . 10.0 112.399 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -72.32 -39.06 68.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.393 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 22.7 mmt -65.42 -39.29 91.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.593 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.61 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 28.7 mt-10 -63.92 -25.22 68.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.257 0.551 . . . . 10.0 110.06 178.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -82.33 -30.68 30.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.078 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.3 mp -73.25 148.42 43.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.474 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.6 p -75.45 167.42 21.93 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.387 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.9 -37.51 87.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.53 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -68.92 -32.52 72.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.511 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -66.37 -33.72 76.35 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.485 -0.325 . . . . 10.0 110.508 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.32 -46.12 88.15 Favored 'General case' 0 CA--C 1.521 -0.171 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.7 ttpt -61.92 -34.13 75.51 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.08 -0.964 . . . . 10.0 109.481 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.06 -34.37 86.47 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.684 -0.689 . . . . 10.0 111.421 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -66.54 -36.2 82.09 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.024 -0.362 . . . . 10.0 110.024 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.7 m -61.7 -45.68 92.93 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.158 0.504 . . . . 10.0 109.647 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.11 -33.41 75.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.775 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -60.7 -47.7 85.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.292 -0.867 . . . . 10.0 110.284 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -61.42 -41.12 96.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.976 0.417 . . . . 10.0 109.979 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -59.06 -40.27 84.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.529 -0.759 . . . . 10.0 110.402 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -77.59 -36.47 51.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.368 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.42 HH12 ' CD ' ' A' ' 66' ' ' GLU . 63.2 mtp180 -64.68 -31.19 72.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.519 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 44.1 mt -60.4 -31.99 70.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.844 0.354 . . . . 10.0 110.8 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.5 -28.43 66.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.502 . . . . 10.0 110.479 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 18.6 mmmt -76.23 -14.53 60.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.658 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 110.32 22.36 6.51 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.805 -0.712 . . . . 10.0 112.287 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -73.22 144.43 46.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.785 0.326 . . . . 10.0 110.153 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.0 t -86.86 136.72 22.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.164 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.42 HD11 ' O ' ' A' ' 118' ' ' LEU . 13.9 tp -62.34 -39.64 93.78 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.108 0.48 . . . . 10.0 110.1 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -69.87 -16.48 63.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.21 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -90.9 -15.3 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.403 0.62 . . . . 10.0 110.259 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.0 mt -86.42 -11.98 50.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.104 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.504 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 85.0 mt -50.38 -51.89 59.72 Favored Pre-proline 0 CA--C 1.541 0.617 0 N-CA-C 113.459 0.911 . . . . 10.0 113.459 -178.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.504 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 52.2 Cg_exo -53.12 -35.89 74.62 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 122.164 1.91 . . . . 10.0 113.488 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.488 ' O ' HG23 ' A' ' 70' ' ' VAL . 44.5 mt-10 -89.74 -45.45 9.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.724 0.297 . . . . 10.0 111.507 -179.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.496 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -60.1 -47.88 84.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.232 -0.44 . . . . 10.0 112.142 -178.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.1 m-30 -64.12 -30.67 71.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.721 0.296 . . . . 10.0 110.67 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.13 -43.95 81.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.134 -0.484 . . . . 10.0 109.965 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 66' ' ' GLU . 47.5 t -61.33 -43.58 96.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.827 179.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 67' ' ' ALA . 45.9 t -62.01 -46.19 97.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.318 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.438 ' HD3' ' CD ' ' A' ' 32' ' ' GLU . 11.6 ttm180 -60.64 -41.54 95.14 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.18 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.511 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 18.9 tp10 -63.95 -50.87 66.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.575 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.49 -33.33 71.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.035 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 46.3 m -59.32 -42.82 92.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.362 -0.381 . . . . 10.0 111.282 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.511 ' HE2' ' HA ' ' A' ' 73' ' ' GLU . 40.1 mtmt -73.19 -16.98 61.41 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 112.299 0.481 . . . . 10.0 112.299 -178.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 -100.13 -37.13 9.08 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.993 -0.283 . . . . 10.0 111.636 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 85.5 t -82.96 -51.45 14.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 120.785 0.326 . . . . 10.0 111.796 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -99.71 -38.31 8.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.928 0.394 . . . . 10.0 111.206 -178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.39 4.43 49.95 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.94 -0.648 . . . . 10.0 111.517 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 63.9 mtt -111.26 138.13 48.11 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.859 -0.423 . . . . 10.0 109.859 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -90.48 135.32 33.77 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.857 0.36 . . . . 10.0 110.673 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.68 112.15 4.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.165 -0.47 . . . . 10.0 109.854 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -59.14 152.83 19.47 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.25 0.547 . . . . 10.0 111.778 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -61.82 -36.55 81.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.286 -0.87 . . . . 10.0 111.644 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.6 m -64.67 -31.62 54.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.06 0.457 . . . . 10.0 110.894 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -73.21 -27.9 61.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.281 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.434 HD12 HG13 ' A' ' 25' ' ' VAL . 97.7 mt -66.28 -33.88 76.73 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.718 -0.475 . . . . 10.0 109.718 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.91 -50.07 67.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.471 178.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -62.56 -32.5 83.48 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.317 -0.856 . . . . 10.0 112.066 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -60.21 -36.4 90.62 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 121.06 -0.591 . . . . 10.0 112.196 179.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.683 ' SD ' ' HG2' ' A' ' 21' ' ' MET . 25.0 ttm -74.9 -36.15 62.23 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.888 -0.412 . . . . 10.0 109.888 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.4 t -64.41 -41.74 93.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.152 0.501 . . . . 10.0 109.958 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 91.4 mt -73.95 -4.43 35.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.672 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -91.43 -21.36 21.0 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.242 0.544 . . . . 10.0 109.948 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -105.47 -174.26 2.49 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.827 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -83.56 67.59 9.46 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.135 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 74.2 m -149.2 166.86 27.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.138 0.494 . . . . 10.0 111.731 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.586 HD12 HG11 ' A' ' 211' ' ' VAL . 35.8 mm -113.26 135.5 52.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.173 178.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -110.3 124.8 52.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.923 0.392 . . . . 10.0 111.824 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.31 129.26 36.56 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 108' ' ' LYS . 2.9 ttt -136.12 135.98 39.73 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.895 0.378 . . . . 10.0 111.082 -179.134 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.435 ' HD2' ' OG1' ' A' ' 393' ' ' THR . 13.6 mmm180 -67.96 152.37 45.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.088 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.68 96.33 1.58 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.762 -0.653 . . . . 10.0 111.509 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 138.88 -15.5 3.31 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.382 -0.913 . . . . 10.0 113.537 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -84.23 27.22 0.7 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.978 0.362 . . . . 10.0 111.978 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.71 56.06 16.79 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.561 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.458 ' HA ' ' SD ' ' A' ' 102' ' ' MET . 50.6 tttm -55.38 -50.83 68.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.853 0.358 . . . . 10.0 111.745 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -24.65 63.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.947 0.403 . . . . 10.0 111.829 -179.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 21.2 tp -72.52 -31.64 65.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.336 -0.393 . . . . 10.0 110.867 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 19.0 m -71.41 -28.56 64.09 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.851 0.358 . . . . 10.0 111.7 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.81 66.13 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.771 1.026 . . . . 10.0 113.771 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 17.0 p -75.46 -22.39 57.32 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.319 0.489 . . . . 10.0 112.319 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 48.4 mt -68.26 -57.68 8.59 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 112.338 0.496 . . . . 10.0 112.338 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -64.63 -28.39 60.85 Favored 'Trans proline' 0 C--N 1.356 0.965 0 C-N-CA 122.055 1.837 . . . . 10.0 112.032 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.34 -49.26 67.54 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.458 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -62.43 -45.88 91.07 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.896 0.379 . . . . 10.0 110.685 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.42 ' O ' HD11 ' A' ' 60' ' ' LEU . 25.8 tp -59.45 -50.27 74.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.788 -0.642 . . . . 10.0 111.842 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -75.71 -19.13 59.3 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.897 0.332 . . . . 10.0 111.897 -178.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.7 -26.73 65.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.889 0.376 . . . . 10.0 110.942 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 47.6 mt -61.2 -23.02 65.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.561 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 67.2 p -69.74 -24.22 63.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.869 0.366 . . . . 10.0 110.831 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 74.35 9.7 81.49 Favored Glycine 0 C--N 1.333 0.389 0 CA-C-N 115.933 -0.576 . . . . 10.0 112.656 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -86.59 -11.78 50.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.702 0.287 . . . . 10.0 111.525 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.08 110.84 2.6 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.5 -0.857 . . . . 10.0 113.834 178.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 62.1 t -84.59 114.56 25.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 56.1 m170 -93.11 104.07 16.3 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.943 0.402 . . . . 10.0 111.034 -178.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 39.2 t -93.48 123.9 45.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.204 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 96.3 t -105.2 121.92 57.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.993 -179.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 2.7 p -108.83 165.36 11.62 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.512 . . . . 10.0 110.459 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 15.5 m -75.9 -29.83 20.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.85 0.357 . . . . 10.0 111.529 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -145.04 168.54 20.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.33 -0.395 . . . . 10.0 110.405 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.08 -23.09 63.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.166 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -58.73 -52.5 65.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.569 -0.741 . . . . 10.0 110.646 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 30.5 mt -69.47 -35.68 75.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.716 0.293 . . . . 10.0 110.461 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.43 -50.89 71.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.05 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.29 -36.41 61.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.018 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.44 HH21 ' CG ' ' A' ' 139' ' ' ASP . 5.9 ttp85 -56.33 -58.88 6.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.523 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . 0.44 ' CG ' HH21 ' A' ' 138' ' ' ARG . 1.5 m-20 -69.36 -31.97 70.73 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.08 -0.509 . . . . 10.0 112.019 -178.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.493 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -60.87 -37.89 83.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.762 0.315 . . . . 10.0 111.214 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.2 mm-40 -91.59 -28.86 17.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.486 -0.325 . . . . 10.0 111.487 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -74.59 -43.86 53.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.827 0.346 . . . . 10.0 111.383 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 40.3 m-20 -88.41 -0.89 57.68 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.072 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 53.3 ttm-85 -61.69 -49.93 84.26 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.591 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' PRO . . . . . 0.47 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 17.2 Cg_exo -68.86 5.02 1.51 Allowed 'Trans proline' 0 C--N 1.361 1.218 0 C-N-CA 122.353 2.035 . . . . 10.0 112.504 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 12.6 tp -105.93 -52.45 2.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.726 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -73.86 -46.48 44.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.499 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.428 ' HA ' ' O ' ' A' ' 152' ' ' LEU . 82.3 mt-10 -68.91 -19.65 64.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.883 0.373 . . . . 10.0 111.047 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -73.39 -24.24 60.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.302 0.573 . . . . 10.0 109.556 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 71.4 mt -96.56 -11.18 25.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.938 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 114.99 -6.63 21.83 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.509 -0.853 . . . . 10.0 113.592 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 148' ' ' GLU . 92.4 mt -80.89 144.95 31.58 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.167 0.484 . . . . 10.0 110.733 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 12.1 p -95.39 133.15 39.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.508 -0.315 . . . . 10.0 111.108 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 35.2 t -108.97 130.73 61.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.441 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -124.98 145.53 15.74 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 111.665 -0.574 . . . . 10.0 111.665 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 4.2 tp -119.08 129.16 75.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 120.962 0.41 . . . . 10.0 110.511 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -114.26 112.67 23.48 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.162 -0.472 . . . . 10.0 109.999 179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 49.3 mt -109.46 148.98 39.19 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.384 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' PRO . . . . . 0.486 ' HA ' ' OE2' ' A' ' 181' ' ' GLU . 19.0 Cg_endo -58.3 121.24 9.65 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.753 2.302 . . . . 10.0 112.539 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.2 6.74 62.79 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.933 -0.651 . . . . 10.0 112.928 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . 0.449 ' O ' ' HE2' ' A' ' 166' ' ' LYS . 44.2 ttm -67.31 139.07 94.56 Favored Pre-proline 0 C--N 1.325 -0.473 0 C-N-CA 122.049 0.14 . . . . 10.0 110.96 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . 0.408 ' HD2' ' HG3' ' A' ' 161' ' ' MET . 71.9 Cg_exo -52.69 147.32 31.65 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.885 2.39 . . . . 10.0 112.367 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . 0.459 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -54.47 -48.75 94.04 Favored Pre-proline 0 CA--C 1.54 0.563 0 N-CA-C 112.785 0.661 . . . . 10.0 112.785 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.459 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 51.8 Cg_exo -57.65 -42.33 61.36 Favored 'Trans proline' 0 C--N 1.358 1.062 0 C-N-CA 121.946 1.764 . . . . 10.0 112.346 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -64.96 -41.7 95.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.836 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.449 ' HE2' ' O ' ' A' ' 161' ' ' MET . 60.8 mttm -58.91 -43.5 91.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.137 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -58.13 -40.61 81.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.932 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -68.48 -40.65 80.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.288 -0.414 . . . . 10.0 110.682 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -65.86 -43.01 89.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.351 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' TYR . . . . . 0.431 ' HD2' ' O ' ' A' ' 166' ' ' LYS . 42.1 m-85 -74.34 -22.79 59.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.998 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -78.19 -14.37 59.48 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.654 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -71.58 173.14 8.43 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.305 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -74.72 -39.43 61.9 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.286 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 3.0 mp -127.61 121.35 56.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.883 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 6.4 m -112.36 111.98 23.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.847 0.356 . . . . 10.0 111.359 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -91.34 133.34 35.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.101 -0.5 . . . . 10.0 109.692 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -167.72 179.55 41.03 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.347 -0.93 . . . . 10.0 112.838 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.09 152.16 21.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.541 0.21 . . . . 10.0 110.549 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -60.47 -41.38 94.07 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.953 0.353 . . . . 10.0 111.953 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -56.46 -50.95 70.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.43 -0.35 . . . . 10.0 111.709 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.486 ' OE2' ' HA ' ' A' ' 159' ' ' PRO . 3.8 tp10 -70.71 -38.49 73.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.91 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -56.81 -39.44 74.17 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.861 0.363 . . . . 10.0 111.152 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -70.72 -44.33 57.18 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.821 -0.704 . . . . 10.0 112.242 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -67.17 -35.28 79.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.915 0.388 . . . . 10.0 110.738 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . 0.435 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 6.8 m-20 -59.16 -44.62 92.14 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.689 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -62.85 -38.22 89.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.466 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' LEU . . . . . 0.471 HD22 ' HB1' ' A' ' 373' ' ' ALA . 54.2 mt -62.65 -47.19 84.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.514 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 188' ' ' ARG . 42.4 mtm-85 -67.27 -40.7 86.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 10.0 110.491 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.11 -49.12 78.88 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.395 -0.821 . . . . 10.0 111.608 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -79.66 -3.6 47.98 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.784 -0.644 . . . . 10.0 112.656 -178.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 23.0 ttp -104.21 4.0 33.44 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.879 0.371 . . . . 10.0 110.966 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . . . . . . . . . . . -69.72 174.01 5.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.82 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -109.34 -21.59 12.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.053 0.454 . . . . 10.0 110.601 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -131.05 142.33 45.2 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.871 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' PRO . . . . . 0.409 ' HD3' ' O ' ' A' ' 667' ' ' LEU . 13.2 Cg_endo -57.72 -30.18 88.19 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.811 2.341 . . . . 10.0 112.721 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -69.91 -17.5 63.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.963 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -83.14 -13.03 56.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.302 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -56.09 157.74 4.43 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.382 0.426 . . . . 10.0 111.426 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 8.2 m -128.57 -25.26 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.228 -0.442 . . . . 10.0 112.007 -179.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -92.77 -178.2 4.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.065 0.459 . . . . 10.0 111.361 -179.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -134.03 -178.2 4.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.765 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 17.4 ttmm -57.32 131.8 51.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.274 0.559 . . . . 10.0 111.593 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 12.5 mt -82.65 74.57 9.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.158 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -84.33 -63.45 1.34 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.94 -178.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -128.3 137.28 51.88 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.065 0.459 . . . . 10.0 111.731 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.468 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -129.71 127.59 40.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.364 -0.835 . . . . 10.0 109.984 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . . . . . . . . . 61.8 tp -119.79 108.9 14.96 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.08 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 1.3 p -98.75 131.26 46.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 CA-C-O 121.048 0.452 . . . . 10.0 110.776 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -59.05 -66.21 0.54 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.614 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' GLU . . . . . 0.521 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 34.3 tt0 -112.3 111.05 21.64 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.833 0.349 . . . . 10.0 110.577 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.586 HG11 HD12 ' A' ' 99' ' ' ILE . 34.3 m -82.34 -18.59 10.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.844 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . 0.418 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 1.0 OUTLIER -51.82 -57.49 9.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.173 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . 0.408 ' HA ' ' HB2' ' A' ' 217' ' ' ASP . 4.9 p -88.61 -59.17 2.3 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.965 -0.561 . . . . 10.0 112.051 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' ILE . . . . . . . . . . . . . 69.2 mt -52.73 -38.31 27.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 113.913 1.079 . . . . 10.0 113.913 -177.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 215' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 211' ' ' VAL . 8.0 mt -96.47 -53.79 3.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.933 0.716 . . . . 10.0 112.933 -178.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 216' ' ' ILE . . . . . 0.418 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 46.7 mm -75.91 -57.15 6.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 113.064 0.764 . . . . 10.0 113.064 -177.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 217' ' ' ASP . . . . . 0.408 ' HB2' ' HA ' ' A' ' 213' ' ' SER . 67.0 m-20 -64.22 -42.7 96.48 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.035 0.383 . . . . 10.0 112.035 -178.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -90.09 16.65 8.04 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.21 0.448 . . . . 10.0 112.21 -178.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.88 -38.69 91.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.883 0.373 . . . . 10.0 111.071 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 220' ' ' ARG . . . . . 0.412 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 3.5 mtp-105 -106.13 31.68 4.95 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.308 -0.406 . . . . 10.0 111.488 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 33.9 m -105.12 102.99 39.56 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 222' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 72.5 Cg_endo -94.95 129.38 0.48 Allowed 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.095 2.53 . . . . 10.0 113.473 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 223' ' ' LEU . . . . . 0.475 ' O ' ' HA ' ' A' ' 374' ' ' SER . 86.9 mt -82.91 110.87 18.27 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 178.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 77.0 mt -108.33 125.95 65.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 65.8 mt -96.28 111.92 27.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 108.578 -0.897 . . . . 10.0 108.578 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 226' ' ' SER . . . . . . . . . . . . . 20.1 m -86.47 148.56 25.49 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.784 0.326 . . . . 10.0 111.144 -179.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -167.46 92.22 0.1 Allowed Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.828 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 228' ' ' PRO . . . . . 0.429 ' HA ' ' OE1' ' A' ' 370' ' ' GLN . 9.5 Cg_exo -71.7 119.57 6.31 Favored 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 122.862 2.375 . . . . 10.0 112.781 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 229' ' ' ALA . . . . . 0.489 ' O ' ' HA ' ' B' ' 21' ' ' VAL . . . -154.94 80.89 1.08 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.964 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 68.11 176.93 0.26 Allowed 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.738 0.648 . . . . 10.0 110.359 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -168.85 -82.57 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.004 0.431 . . . . 10.0 110.361 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 236' ' ' TYR . 15.1 m -140.63 38.42 1.84 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.462 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 233' ' ' SER . . . . . . . . . . . . . 1.4 p -56.12 -75.07 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.899 -179.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -69.11 -23.08 63.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.281 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 235' ' ' MET . . . . . . . . . . . . . 22.0 ttm -66.23 -55.04 18.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.588 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . 0.521 ' HB3' ' HB2' ' A' ' 359' ' ' ALA . 0.5 OUTLIER -61.25 -36.93 81.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.598 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 237' ' ' LYS . . . . . 0.459 ' O ' ' HD3' ' A' ' 241' ' ' LYS . 64.8 mmtt -65.49 -15.35 62.57 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.021 -0.536 . . . . 10.0 112.326 -179.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 34.2 tpt85 -108.7 -33.32 7.03 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.836 -0.346 . . . . 10.0 110.875 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 239' ' ' VAL . . . . . 0.415 ' O ' HG23 ' A' ' 242' ' ' ILE . 89.7 t -75.96 -40.19 37.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.949 0.404 . . . . 10.0 111.083 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.58 22.41 0.35 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.591 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 241' ' ' LYS . . . . . 0.459 ' HD3' ' O ' ' A' ' 237' ' ' LYS . 1.8 mptm? -112.82 15.97 19.66 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.616 0.228 . . . . 10.0 111.616 -179.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 242' ' ' ILE . . . . . 0.457 HD13 ' H ' ' A' ' 242' ' ' ILE . 0.2 OUTLIER -90.3 -11.35 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-O 120.955 0.407 . . . . 10.0 111.005 179.763 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 243' ' ' ILE . . . . . 0.43 ' HB ' ' HD3' ' A' ' 244' ' ' PRO . 44.8 mt -58.38 -47.06 99.48 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.952 0.723 . . . . 10.0 112.952 -179.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 244' ' ' PRO . . . . . 0.43 ' HD3' ' HB ' ' A' ' 243' ' ' ILE . 23.9 Cg_exo -66.14 -0.34 4.03 Favored 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 122.165 1.91 . . . . 10.0 113.78 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -105.07 6.47 33.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.038 0.447 . . . . 10.0 110.271 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 18.9 mt -98.53 167.87 10.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.221 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 247' ' ' ILE . . . . . 0.422 ' O ' ' HG3' ' A' ' 248' ' ' ARG . 2.4 mt -121.35 14.5 6.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.652 0.263 . . . . 10.0 111.209 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 248' ' ' ARG . . . . . 0.494 ' HA ' ' CG ' ' A' ' 253' ' ' ASP . 3.4 ptm180 40.67 77.51 0.05 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.951 0.9 . . . . 10.0 112.397 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 249' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -171.12 -44.97 0.02 OUTLIER 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.985 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 250' ' ' GLU . . . . . 0.461 ' O ' ' HE2' ' A' ' 251' ' ' LYS . 1.6 tt0 -153.25 128.8 10.0 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.823 0.305 . . . . 10.0 111.823 -179.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.461 ' HE2' ' O ' ' A' ' 250' ' ' GLU . 0.1 OUTLIER 72.73 130.11 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.112 0.883 . . . . 10.0 112.953 177.412 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 252' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 68.18 -58.39 0.46 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.661 -1.154 . . . . 10.0 113.34 178.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 253' ' ' ASP . . . . . 0.494 ' CG ' ' HA ' ' A' ' 248' ' ' ARG . 1.3 p30 -70.65 -34.39 72.0 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.663 0.246 . . . . 10.0 111.663 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.91 130.24 35.11 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.148 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . 0.468 ' HG2' HG23 ' A' ' 256' ' ' THR . 0.6 OUTLIER -85.06 -32.51 22.82 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.839 0.352 . . . . 10.0 110.37 -179.565 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 256' ' ' THR . . . . . 0.468 HG23 ' HG2' ' A' ' 255' ' ' GLU . 6.2 p -124.8 -90.95 0.55 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.688 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 18.7 t80 58.32 -91.35 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.309 -0.86 . . . . 10.0 111.072 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 53.69 29.38 9.34 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.134 0.492 . . . . 10.0 111.429 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . 112.72 -47.8 1.0 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.807 -0.711 . . . . 10.0 112.73 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -118.28 -72.46 0.69 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.958 0.408 . . . . 10.0 110.276 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 83.87 -91.56 1.64 Allowed Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.777 -0.725 . . . . 10.0 113.435 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -145.32 172.77 12.68 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.464 0.173 . . . . 10.0 110.559 -178.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -88.8 -175.43 4.88 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.363 -0.381 . . . . 10.0 110.518 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 9.9 m -73.59 97.03 2.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.159 0.504 . . . . 10.0 112.117 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 265' ' ' VAL . . . . . 0.539 HG23 ' H ' ' A' ' 266' ' ' ASP . 0.0 OUTLIER -150.41 -70.1 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.504 178.432 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 266' ' ' ASP . . . . . 0.539 ' H ' HG23 ' A' ' 265' ' ' VAL . 34.7 t70 -169.88 129.81 0.98 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.607 -0.724 . . . . 10.0 109.678 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -76.62 85.15 3.28 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.979 -0.748 . . . . 10.0 108.979 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 268' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 318' ' ' ALA . 2.4 ttmp? -157.71 83.26 0.89 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.781 -179.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 10.6 m -76.64 85.0 3.3 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.258 0.552 . . . . 10.0 109.933 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -60.72 -20.34 60.95 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.41 -0.814 . . . . 10.0 111.306 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -74.95 -9.77 58.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.017 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 272' ' ' VAL . . . . . 0.526 HG12 ' H ' ' A' ' 274' ' ' LEU . 21.8 t 67.72 -81.7 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 C-N-CA 123.122 0.569 . . . . 10.0 110.776 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 1.2 t30 59.66 29.99 19.58 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 122.73 0.412 . . . . 10.0 111.467 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 274' ' ' LEU . . . . . 0.526 ' H ' HG12 ' A' ' 272' ' ' VAL . 9.3 tp 58.58 -142.76 0.65 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.243 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 275' ' ' THR . . . . . . . . . . . . . 7.7 t -167.93 166.49 13.32 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 121.324 -0.15 . . . . 10.0 110.793 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 55.46 104.09 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.329 0 O-C-N 124.315 1.009 . . . . 10.0 112.743 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 277' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.23 16.06 11.46 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.32 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . . . . . . . . . . . -123.57 -24.52 1.92 Allowed Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.446 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 90.4 mt 62.04 57.09 2.15 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.198 0.523 . . . . 10.0 110.826 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 280' ' ' VAL . . . . . 0.427 ' H ' ' H ' ' A' ' 281' ' ' LEU . 9.6 p -159.1 -13.3 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.849 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 281' ' ' LEU . . . . . 0.427 ' H ' ' H ' ' A' ' 280' ' ' VAL . 7.7 mp -79.64 -47.44 15.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.93 0.395 . . . . 10.0 109.995 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 282' ' ' ILE . . . . . . . . . . . . . 30.5 pt -72.39 1.48 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.589 -0.732 . . . . 10.0 112.159 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.72 -33.79 72.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.891 0.377 . . . . 10.0 110.401 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -77.22 -15.54 59.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.251 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.09 -31.32 62.77 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 178.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 77.2 mt -65.84 161.28 21.37 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.67 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 287' ' ' VAL . . . . . 0.411 ' O ' ' HG2' ' A' ' 288' ' ' LYS . 41.0 t 70.02 154.31 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 115.639 -0.709 . . . . 10.0 110.668 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 288' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 287' ' ' VAL . 0.0 OUTLIER 72.04 176.11 0.28 Allowed 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.845 0.858 . . . . 10.0 111.527 179.368 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 289' ' ' GLU . . . . . 0.446 ' HA ' ' OE1' ' A' ' 289' ' ' GLU . 4.8 mm-40 72.11 -78.44 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.357 0.663 . . . . 10.0 111.728 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 290' ' ' GLY . . . . . 0.465 ' O ' ' HB ' ' A' ' 291' ' ' ILE . . . 153.44 155.1 7.02 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.571 -0.823 . . . . 10.0 112.04 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 291' ' ' ILE . . . . . 0.465 ' HB ' ' O ' ' A' ' 290' ' ' GLY . 26.3 mm 75.53 127.56 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 C-N-CA 123.001 0.52 . . . . 10.0 109.869 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER 67.77 26.82 7.65 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 -178.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 15.9 p-10 -77.43 58.09 1.64 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.789 -1.096 . . . . 10.0 111.162 -179.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -152.06 -163.9 1.84 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.47 -0.786 . . . . 10.0 109.615 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -81.61 79.54 1.83 Allowed Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.545 -0.836 . . . . 10.0 111.777 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -142.41 -179.43 6.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.596 0.236 . . . . 10.0 110.568 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 8.6 t -117.6 -171.19 2.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.851 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 307' ' ' MET . 26.6 tp -104.33 -14.95 15.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.213 -0.448 . . . . 10.0 111.442 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 299' ' ' TYR . . . . . . . . . . . . . 50.2 p90 -110.37 16.65 21.5 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.765 -0.374 . . . . 10.0 111.356 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 1.4 m -59.63 131.36 88.44 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.334 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 301' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -66.75 -11.9 33.79 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.843 2.362 . . . . 10.0 112.32 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 302' ' ' ALA . . . . . 0.407 ' HA ' ' HA ' ' A' ' 810' ' ' MET . . . -77.02 -13.04 60.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.287 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 303' ' ' ASN . . . . . 0.511 HD21 ' HB2' ' A' ' 306' ' ' LEU . 18.1 t30 -143.16 92.47 2.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.071 0.462 . . . . 10.0 110.597 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 1.8 tp -98.8 -21.87 5.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.332 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 2.0 tpt -60.43 -53.06 62.12 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.273 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 306' ' ' LEU . . . . . 0.511 ' HB2' HD21 ' A' ' 303' ' ' ASN . 3.0 mm? -76.04 -32.74 59.49 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.929 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 307' ' ' MET . . . . . 0.445 ' HG3' ' O ' ' A' ' 298' ' ' LEU . 0.1 OUTLIER -62.27 -38.06 87.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.922 0.391 . . . . 10.0 111.155 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -80.42 -6.65 58.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.546 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 64.8 m170 -95.97 -36.3 11.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.627 -0.26 . . . . 10.0 110.545 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 26.9 m -69.47 -32.31 52.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.821 0.343 . . . . 10.0 110.473 179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -75.14 -23.8 57.88 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.397 0.618 . . . . 10.0 110.248 179.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 312' ' ' ALA . . . . . 0.481 ' O ' ' HG2' ' A' ' 315' ' ' ARG . . . -68.15 -33.79 75.14 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.311 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 313' ' ' ALA . . . . . . . . . . . . . . . -65.78 -29.77 70.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.338 0.59 . . . . 10.0 110.201 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 9.2 mp -74.08 -43.19 58.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.573 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 315' ' ' ARG . . . . . 0.481 ' HG2' ' O ' ' A' ' 312' ' ' ALA . 36.0 ptt180 -71.09 -23.03 62.03 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.459 -0.337 . . . . 10.0 110.922 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -89.41 13.9 12.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.375 0.607 . . . . 10.0 110.1 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -129.67 -39.67 1.43 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.94 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . 0.549 ' O ' ' HG3' ' A' ' 268' ' ' LYS . . . -105.25 -35.97 7.38 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.351 0.5 . . . . 10.0 112.351 -178.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 319' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 319' ' ' LEU . 3.3 mm? -84.37 -65.81 0.97 Allowed 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 121.041 -0.264 . . . . 10.0 111.282 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -83.44 115.93 22.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.007 0.432 . . . . 10.0 110.275 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 321' ' ' THR . . . . . 0.613 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 0.3 OUTLIER -101.69 130.37 48.05 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.964 -0.562 . . . . 10.0 111.42 -179.3 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 322' ' ' ARG . . . . . 0.577 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 2.2 tpt180 -65.59 139.7 58.46 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.471 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 323' ' ' ASP . . . . . 0.577 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 25.5 m-20 85.48 -14.59 0.56 Allowed 'General case' 0 N--CA 1.477 0.892 0 O-C-N 124.442 1.089 . . . . 10.0 113.443 178.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 324' ' ' VAL . . . . . 0.613 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 2.2 p -121.45 -47.07 2.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 C-N-CA 120.579 -0.449 . . . . 10.0 111.088 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -88.95 -34.7 16.8 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.407 0.622 . . . . 10.0 110.164 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -148.16 145.6 28.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.753 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 14.4 tt -133.24 110.11 14.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 121.545 0.688 . . . . 10.0 110.036 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 328' ' ' VAL . . . . . 0.541 HG21 ' HG3' ' A' ' 361' ' ' GLU . 41.4 t -95.63 114.13 31.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.857 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 329' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -138.07 134.24 34.48 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.804 -0.634 . . . . 10.0 110.323 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 62.53 20.95 12.32 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.372 0.42 . . . . 10.0 111.303 179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 331' ' ' GLY . . . . . . . . . . . . . . . 87.71 2.74 81.43 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.535 -0.84 . . . . 10.0 112.224 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -99.54 123.91 44.24 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 110.315 -0.254 . . . . 10.0 110.315 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 333' ' ' VAL . . . . . . . . . . . . . 25.9 t -91.19 97.79 7.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 26.6 mt -99.56 128.43 51.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.684 -179.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 335' ' ' ILE . . . . . 0.434 HD12 ' HB3' ' A' ' 347' ' ' ARG . 52.9 mt -91.49 133.2 33.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.664 -0.495 . . . . 10.0 109.664 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 336' ' ' VAL . . . . . 0.412 ' HB ' ' O ' ' A' ' 324' ' ' VAL . 2.9 t -112.39 112.13 39.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.964 0.411 . . . . 10.0 111.186 -178.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -71.2 123.68 22.76 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.338 -0.616 . . . . 10.0 109.338 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.5 -5.51 59.18 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.033 0.383 . . . . 10.0 112.033 -178.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 31.5 m80 -80.2 -50.54 10.12 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.97 -0.292 . . . . 10.0 111.539 -179.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 38.7 p -116.46 -2.82 11.95 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 111.899 0.333 . . . . 10.0 111.899 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 69.55 55.9 9.28 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.667 -0.777 . . . . 10.0 111.618 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -115.94 123.4 47.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.823 0.344 . . . . 10.0 111.38 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.84 103.64 15.44 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.198 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 59.5 mtt -102.31 110.13 22.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.585 -179.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -88.98 -25.76 21.86 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.944 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -106.52 65.1 0.27 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.645 -0.788 . . . . 10.0 112.164 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 347' ' ' ARG . . . . . 0.434 ' HB3' HD12 ' A' ' 335' ' ' ILE . 1.2 tmt_? -140.57 125.16 17.93 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.673 -0.491 . . . . 10.0 109.673 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 348' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -101.35 163.39 12.3 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.851 -0.425 . . . . 10.0 109.851 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 349' ' ' TRP . . . . . 0.431 ' HB3' ' HB2' ' A' ' 353' ' ' LEU . 12.4 m95 -145.78 120.69 9.98 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.217 -0.29 . . . . 10.0 110.217 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.24 178.88 1.35 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.82 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 9.1 t70 68.66 2.32 3.39 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.791 -0.641 . . . . 10.0 111.255 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 74.2 33.55 56.63 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.836 -0.697 . . . . 10.0 112.265 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 349' ' ' TRP . 82.6 mt -59.16 -47.83 83.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.848 0.356 . . . . 10.0 110.847 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 354' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -84.7 -10.69 57.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.344 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 355' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -64.32 -41.22 96.92 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.967 0.413 . . . . 10.0 110.273 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 356' ' ' ALA . . . . . 0.45 ' HB2' ' HB1' ' A' ' 312' ' ' ALA . . . -69.28 -28.88 66.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.591 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 357' ' ' VAL . . . . . . . . . . . . . 48.7 t -67.38 -52.27 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.597 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -61.67 -25.57 67.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.735 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 359' ' ' ALA . . . . . 0.521 ' HB2' ' HB3' ' A' ' 236' ' ' TYR . . . -75.76 -44.95 39.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.419 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 360' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -68.68 -41.9 78.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.793 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 361' ' ' GLU . . . . . 0.541 ' HG3' HG21 ' A' ' 328' ' ' VAL . 23.3 mm-40 -81.5 160.63 23.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.084 -0.507 . . . . 10.0 109.777 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -86.12 59.54 4.68 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.631 -0.795 . . . . 10.0 112.743 -179.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 363' ' ' VAL . . . . . . . . . . . . . 8.0 m -135.19 177.47 6.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.587 0.232 . . . . 10.0 111.034 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -83.5 139.06 33.14 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.485 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 365' ' ' ILE . . . . . . . . . . . . . 47.6 mt -84.18 140.46 16.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.287 179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 366' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -73.85 153.41 39.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.898 0.38 . . . . 10.0 110.629 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -86.9 -27.27 23.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.792 -179.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 368' ' ' GLU . . . . . 0.473 ' HA ' ' OE1' ' A' ' 368' ' ' GLU . 6.0 mm-40 62.86 -121.26 0.61 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.966 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -149.53 134.2 17.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.541 0.21 . . . . 10.0 110.795 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 370' ' ' GLN . . . . . 0.429 ' OE1' ' HA ' ' A' ' 228' ' ' PRO . 22.2 mp0 -114.01 165.93 12.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.885 0.374 . . . . 10.0 110.744 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 22.7 m -112.14 133.32 54.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.373 -179.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 62.5 mt -99.33 -37.58 9.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.164 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 373' ' ' ALA . . . . . 0.471 ' HB1' HD22 ' A' ' 187' ' ' LEU . . . -162.62 155.41 19.47 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.638 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 374' ' ' SER . . . . . 0.475 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 41.6 m -155.13 135.59 13.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.411 -0.359 . . . . 10.0 110.495 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.415 ' HB ' HD21 ' A' ' 187' ' ' LEU . 18.9 tt -149.73 136.8 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.165 0.507 . . . . 10.0 110.62 178.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.64 143.73 26.45 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.855 -0.612 . . . . 10.0 109.715 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -55.5 -48.42 74.66 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.835 0.35 . . . . 10.0 110.522 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 378' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -57.59 -40.24 78.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.643 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 62.7 m-20 -73.99 -14.94 61.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.981 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -88.63 -42.53 11.96 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.319 -0.622 . . . . 10.0 109.319 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -70.05 -18.41 63.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.769 -0.651 . . . . 10.0 110.7 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -74.3 -11.39 60.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.407 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 43.1 mt -93.49 0.44 56.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.564 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.468 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 26.1 m-85 -94.52 142.33 27.57 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.591 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -75.1 -61.51 1.87 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.196 0.522 . . . . 10.0 109.976 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -102.34 107.68 18.78 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 44.8 tp -120.72 120.02 34.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.971 -0.558 . . . . 10.0 109.911 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -143.04 166.49 24.49 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.524 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -173.89 173.92 46.06 Favored Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.083 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 13.6 mtm -110.93 146.88 35.8 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.707 0.289 . . . . 10.0 110.232 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 6.7 t -126.63 160.13 31.59 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -84.7 163.11 38.25 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.489 -0.863 . . . . 10.0 111.985 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 393' ' ' THR . . . . . 0.435 ' OG1' ' HD2' ' A' ' 103' ' ' ARG . 3.2 m -71.08 73.1 0.62 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.196 0.522 . . . . 10.0 110.482 179.214 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . . . . . . . . . . . -135.44 -30.54 1.01 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.778 -0.646 . . . . 10.0 111.8 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 395' ' ' ASP . . . . . . . . . . . . . 19.9 t70 61.51 -114.55 0.56 Allowed 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 108.83 -0.804 . . . . 10.0 108.83 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 396' ' ' THR . . . . . . . . . . . . . 14.0 m 65.52 -86.39 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.898 0.703 . . . . 10.0 112.898 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -84.03 30.51 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 10.0 111.456 -178.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 398' ' ' ALA . . . . . . . . . . . . . . . -58.13 -45.6 87.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.456 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -65.61 -23.15 66.76 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.628 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 400' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -75.86 -29.3 58.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.633 0.254 . . . . 10.0 110.443 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 401' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -60.02 -42.52 94.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.994 0.426 . . . . 10.0 110.524 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 402' ' ' SER . . . . . . . . . . . . . 1.4 m -81.84 -5.76 58.49 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.963 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 17.8 m -106.14 -40.85 5.52 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.855 -0.338 . . . . 10.0 111.795 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 53.9 mt -85.99 -46.31 16.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.554 -0.293 . . . . 10.0 111.593 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 405' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -108.51 -6.11 16.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.625 0.25 . . . . 10.0 111.316 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 406' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt 58.96 44.76 15.98 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.017 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 407' ' ' LEU . . . . . 0.431 HD13 HD11 ' A' ' 99' ' ' ILE . 36.1 mt -112.02 138.13 49.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.776 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . 0.566 ' OD2' ' HD3' ' A' ' 13' ' ' ARG . 28.7 t0 -82.47 142.62 31.75 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.729 -0.471 . . . . 10.0 109.729 179.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 1.8 m -100.79 106.31 17.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.931 0.396 . . . . 10.0 111.487 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 83.9 t -107.05 132.81 53.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.205 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 60.2 t -96.76 126.55 49.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.52 -0.309 . . . . 10.0 110.398 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 44.8 t -95.73 131.56 29.06 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.548 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -65.17 154.42 73.56 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.645 2.23 . . . . 10.0 112.757 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.5 p -79.91 168.68 18.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.034 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -78.9 -33.41 45.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.436 0.636 . . . . 10.0 109.407 179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 416' ' ' ARG . . . . . . . . . . . . . 38.4 mtm180 -124.22 151.07 65.39 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.401 -0.818 . . . . 10.0 109.557 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.68 110.4 1.44 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.502 2.135 . . . . 10.0 111.999 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 58.8 ttp -72.92 102.52 3.47 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.112 0.482 . . . . 10.0 110.545 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.8 pt -96.14 60.72 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.238 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 -86.25 128.53 34.92 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -93.81 97.97 10.77 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.832 0.348 . . . . 10.0 111.136 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -90.14 122.19 32.88 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.068 -0.715 . . . . 10.0 109.068 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 22.4 mt -104.65 150.78 38.95 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.734 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 424' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.98 141.77 98.65 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.945 2.43 . . . . 10.0 112.56 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -60.26 131.91 52.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.976 -0.557 . . . . 10.0 110.907 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.27 106.4 17.59 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.951 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 427' ' ' VAL . . . . . . . . . . . . . 72.8 t -103.93 123.19 57.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.834 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 428' ' ' TYR . . . . . 0.434 ' HB3' ' HB2' ' A' ' 433' ' ' GLU . 2.5 m-85 -105.91 -175.18 2.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.625 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -83.54 -77.42 0.25 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.438 -0.505 . . . . 10.0 110.27 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 76.0 p -83.77 156.39 22.56 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.2 -0.296 . . . . 10.0 110.2 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 431' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -62.93 -27.07 69.13 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.024 -0.361 . . . . 10.0 110.024 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -58.12 -45.15 87.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.796 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 433' ' ' GLU . . . . . 0.434 ' HB2' ' HB3' ' A' ' 428' ' ' TYR . 18.8 mt-10 -65.73 -42.22 91.31 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.492 178.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 434' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -57.82 -51.59 68.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.803 -1.09 . . . . 10.0 111.344 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 435' ' ' ILE . . . . . . . . . . . . . 45.7 mm -67.87 -38.46 80.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.682 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.82 -39.59 92.31 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.813 0.34 . . . . 10.0 110.459 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -61.57 -38.11 86.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.24 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 438' ' ' ILE . . . . . 0.427 HG23 HG21 ' A' ' 557' ' ' ILE . 84.4 mt -63.37 -44.46 99.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.648 178.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 439' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.99 -43.77 96.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.262 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -60.48 -43.04 97.37 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.44 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . 0.616 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 30.2 t70 -66.47 -42.93 86.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.108 179.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . . . . . . . . . 75.3 mt -61.14 -39.36 82.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.451 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -59.07 -39.98 83.77 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.999 0.428 . . . . 10.0 110.44 178.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.25 -39.69 82.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.914 -0.585 . . . . 10.0 110.221 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.616 ' HG2' ' O ' ' A' ' 441' ' ' ASP . 10.7 mmt180 -66.91 -46.73 73.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.246 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -36.41 82.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.883 0.373 . . . . 10.0 110.597 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -66.39 -32.9 74.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.996 -0.547 . . . . 10.0 111.33 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -89.89 -5.51 56.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.179 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 77.98 29.17 54.99 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.821 -0.704 . . . . 10.0 111.719 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' GLN . . . . . 0.557 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 62.4 tt0 -99.38 126.96 35.84 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-O 120.401 0.143 . . . . 10.0 111.015 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.15 142.62 56.42 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 122.592 2.195 . . . . 10.0 111.307 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 52.3 t -119.86 131.45 72.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.569 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 43.3 tp -120.18 104.25 9.93 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.396 -0.594 . . . . 10.0 109.396 178.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 32.2 t -90.23 124.07 42.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.789 -0.642 . . . . 10.0 110.256 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -104.37 81.58 0.34 Allowed Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.799 -0.715 . . . . 10.0 111.977 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.13 104.82 13.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.886 0.374 . . . . 10.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' ILE . . . . . . . . . . . . . 33.9 pt -72.41 -21.52 20.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.194 0.521 . . . . 10.0 110.166 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' SER . . . . . 0.488 ' HB2' ' HB2' ' A' ' 461' ' ' LYS . 1.1 m -99.27 118.98 37.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.483 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 57.2 mt -59.09 -41.35 83.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.945 0.402 . . . . 10.0 111.865 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 27.6 mp0 -63.93 -24.63 67.8 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.186 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 458' ' ' SER . 0.1 OUTLIER -77.69 -31.42 52.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.426 -0.352 . . . . 10.0 110.607 -179.488 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 49.1 m -60.49 -38.91 85.82 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.126 0.488 . . . . 10.0 109.939 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.46 -42.98 82.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.342 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 55.1 tp -64.13 -52.1 60.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.663 -0.698 . . . . 10.0 111.498 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.0 -30.34 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 120.672 0.272 . . . . 10.0 111.013 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 9.1 t -66.75 -40.97 88.48 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.36 -47.02 83.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.121 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -60.97 -40.49 93.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.141 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 17.0 mt -65.92 -35.81 81.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.951 0.405 . . . . 10.0 110.586 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 8.0 m -75.04 -33.83 61.8 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.091 0.472 . . . . 10.0 109.803 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -64.4 -41.17 96.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.111 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -75.86 -31.51 59.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.306 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 94.82 41.38 4.12 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.014 -0.613 . . . . 10.0 112.497 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 35.1 mt -110.53 137.81 41.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 CA-C-O 120.664 0.269 . . . . 10.0 110.999 -179.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 45.5 mttm -61.57 134.98 57.46 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.477 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -163.68 156.47 18.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.78 0.324 . . . . 10.0 111.177 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -140.33 133.36 29.39 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . 0.559 HG22 HD12 ' A' ' 502' ' ' ILE . 20.1 t -105.0 133.69 48.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.857 0.36 . . . . 10.0 111.426 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.428 ' HB3' ' OE2' ' A' ' 487' ' ' GLU . 80.0 mt -84.93 138.83 32.26 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -144.34 135.94 25.79 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.293 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -59.2 -24.32 63.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 10.0 112.018 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -78.7 -9.27 59.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.605 0.24 . . . . 10.0 110.963 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' PHE . . . . . 0.49 ' O ' ' HG3' ' A' ' 487' ' ' GLU . 59.2 m-85 -131.79 49.95 2.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.524 -0.307 . . . . 10.0 110.992 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' HIS . . . . . 0.447 ' HA ' ' OE1' ' A' ' 487' ' ' GLU . 3.3 m80 -57.46 -33.64 68.16 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.912 0.387 . . . . 10.0 111.26 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.92 -33.57 76.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.103 0.478 . . . . 10.0 110.468 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -77.83 -36.68 49.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.693 -0.685 . . . . 10.0 109.647 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' A' ' 483' ' ' PHE . 49.4 mt-10 -59.29 -39.01 81.64 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.661 -0.7 . . . . 10.0 110.523 179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -59.61 -27.13 66.05 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.297 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -88.51 -38.24 15.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.861 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.87 -48.09 72.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.104 -0.498 . . . . 10.0 111.393 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 81.3 t -60.63 -30.95 47.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.828 0.347 . . . . 10.0 111.062 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -61.83 -28.37 69.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.312 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -120.36 21.58 11.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.824 0.345 . . . . 10.0 110.846 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -67.71 -20.03 65.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.996 0.427 . . . . 10.0 110.911 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -98.01 11.97 64.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.876 -0.678 . . . . 10.0 112.068 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -73.39 140.13 79.03 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 110.088 -0.338 . . . . 10.0 110.088 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -52.3 123.16 12.04 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.701 2.267 . . . . 10.0 113.047 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 73.68 15.99 3.94 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 123.948 0.78 . . . . 10.0 112.921 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -91.56 119.88 31.88 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.978 -0.289 . . . . 10.0 110.567 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 40.2 t -100.15 107.99 22.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.067 0.461 . . . . 10.0 110.374 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 8.0 m -107.39 129.84 54.87 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.528 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' ILE . . . . . 0.559 HD12 HG22 ' A' ' 478' ' ' VAL . 61.1 mt -109.54 114.18 46.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.502 -0.317 . . . . 10.0 110.219 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -97.37 114.93 26.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.817 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 16.0 m -86.48 112.45 21.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.107 -0.497 . . . . 10.0 111.203 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 65.8 t30 58.75 77.18 0.31 Allowed 'General case' 0 N--CA 1.467 0.419 0 O-C-N 123.667 0.604 . . . . 10.0 111.204 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -68.35 141.11 55.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.942 -179.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -91.66 -171.09 2.79 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.677 -0.692 . . . . 10.0 110.404 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -75.73 153.8 44.5 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.695 -0.764 . . . . 10.0 112.475 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.521 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 59.2 mtt180 66.6 -80.83 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.293 0.637 . . . . 10.0 112.104 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 91.57 144.76 13.65 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.114 -0.565 . . . . 10.0 111.928 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.03 154.13 41.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.63 0.252 . . . . 10.0 111.206 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -75.71 120.58 21.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.883 0.373 . . . . 10.0 110.961 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 93.4 mt -99.58 108.76 23.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.788 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 6.8 t -78.79 131.07 35.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.92 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 48.9 mt -65.85 127.38 31.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.86 -0.609 . . . . 10.0 110.321 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 95.97 -9.44 68.05 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.084 -0.579 . . . . 10.0 111.672 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 113.72 -176.67 17.39 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.864 -0.894 . . . . 10.0 110.864 -179.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 5.3 p -121.75 93.37 3.98 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.147 0.498 . . . . 10.0 110.642 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 17.9 p-90 -60.35 -27.04 67.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.443 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -62.5 -36.37 82.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.721 -0.672 . . . . 10.0 110.226 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.36 -35.15 35.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.061 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' GLU . . . . . 0.413 ' O ' ' HG ' ' A' ' 526' ' ' LEU . 47.8 mt-10 -62.62 -44.96 94.97 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.822 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 28.1 m -71.65 -25.95 25.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-O 120.994 0.426 . . . . 10.0 110.809 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -73.7 -25.51 60.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.151 0.5 . . . . 10.0 110.171 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -87.18 -0.83 57.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.491 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 522' ' ' GLU . 88.4 mt -84.24 148.57 26.64 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.886 0.374 . . . . 10.0 111.21 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -69.3 -39.92 77.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.9 -0.591 . . . . 10.0 111.172 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -152.85 88.66 3.85 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 109.809 -0.441 . . . . 10.0 109.809 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.21 104.11 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.057 2.504 . . . . 10.0 112.359 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 530' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.17 148.71 29.43 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.722 -0.672 . . . . 10.0 109.875 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -52.41 -50.85 61.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.951 0.405 . . . . 10.0 111.669 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 51.0 mp0 -64.69 -31.87 73.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.629 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -68.99 -44.09 73.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.029 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 79.1 mt -61.59 -42.72 95.2 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.183 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -61.21 -42.06 97.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.378 179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -63.57 -47.33 81.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.552 . . . . 10.0 110.167 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 61.2 mt -63.95 -37.51 79.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.462 -0.335 . . . . 10.0 110.254 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -61.78 -43.29 99.15 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -68.63 -43.43 76.37 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.449 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.67 -47.18 86.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.582 -0.736 . . . . 10.0 109.868 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 61.3 t90 -63.83 -39.5 94.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.335 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -54.04 -48.46 70.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.579 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 39.0 t -61.85 -43.88 98.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.607 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 544' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -65.72 -44.11 87.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 10.0 110.95 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -58.94 -50.86 72.47 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.373 -0.83 . . . . 10.0 111.167 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.49 -24.02 63.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.347 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -67.48 -36.82 81.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.273 0.559 . . . . 10.0 109.716 178.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.16 -32.06 55.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.549 -0.75 . . . . 10.0 110.008 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 84.3 mt -64.33 -39.95 94.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.188 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -69.97 -36.26 75.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.918 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 551' ' ' ALA . . . . . 0.557 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -64.94 -49.16 71.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.465 -0.789 . . . . 10.0 110.793 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 141.42 23.43 0.24 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.399 -0.905 . . . . 10.0 113.609 179.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 74.47 -166.78 54.81 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.68 -0.771 . . . . 10.0 112.502 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 30.5 tp -75.44 125.84 29.81 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.17 -0.307 . . . . 10.0 110.17 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -98.53 110.61 23.18 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.391 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 27.4 mm -90.24 133.89 30.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.818 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 557' ' ' ILE . . . . . 0.427 HG21 HG23 ' A' ' 438' ' ' ILE . 14.0 mt -124.82 121.34 60.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.264 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -107.42 134.29 12.12 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.834 -0.698 . . . . 10.0 111.496 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 17.3 p -92.57 -57.32 2.71 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.112 0.482 . . . . 10.0 111.362 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -114.31 133.05 55.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.438 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 561' ' ' ARG . . . . . 0.523 ' H ' HD21 ' A' ' 588' ' ' LEU . 16.6 mmt180 -77.36 134.62 38.42 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 178.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -78.26 139.4 38.89 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.201 -0.296 . . . . 10.0 110.201 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -57.14 -48.09 79.52 Favored 'General case' 0 CA--C 1.521 -0.156 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . 0.468 ' HA ' ' OE2' ' A' ' 635' ' ' GLU . 0.3 OUTLIER -77.53 114.94 16.88 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.186 178.121 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 565' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -65.8 -24.08 66.84 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.535 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 566' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -61.42 -48.86 79.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.961 0.41 . . . . 10.0 110.463 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 69.0 mt -75.83 -34.83 28.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.118 0.485 . . . . 10.0 110.205 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 568' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -63.31 -41.1 98.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.35 -0.841 . . . . 10.0 110.621 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 569' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -75.59 -35.27 60.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.859 -0.609 . . . . 10.0 110.831 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 570' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -62.68 -27.42 69.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.909 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 20.4 tp -71.35 -28.59 64.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.1 0.476 . . . . 10.0 110.218 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -81.25 -30.43 34.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.248 0.547 . . . . 10.0 109.905 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.34 7.41 17.88 Favored Glycine 0 CA--C 1.52 0.382 0 CA-C-N 115.627 -0.715 . . . . 10.0 113.446 -179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 574' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -74.16 -30.59 62.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.988 0.394 . . . . 10.0 109.989 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 2.4 t -93.65 162.96 13.73 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.191 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 66.46 51.98 38.64 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.869 -0.681 . . . . 10.0 112.161 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 577' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -88.71 146.24 25.17 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.266 -0.272 . . . . 10.0 110.266 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 60.61 20.51 10.4 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 123.544 0.528 . . . . 10.0 110.438 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 579' ' ' GLY . . . . . . . . . . . . . . . 75.5 40.4 32.79 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.995 -0.548 . . . . 10.0 112.641 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 580' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.33 -163.72 1.01 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.73 0.265 . . . . 10.0 110.963 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -92.33 177.32 6.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.266 0.555 . . . . 10.0 111.981 -179.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 153.42 173.51 22.71 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.583 -0.735 . . . . 10.0 111.664 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . . . . . . . . . 2.6 p -146.96 148.45 31.76 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.005 -0.369 . . . . 10.0 110.005 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.6 137.42 31.89 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.621 0.248 . . . . 10.0 111.137 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 585' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -158.91 147.88 18.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.47 -0.332 . . . . 10.0 110.735 178.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -115.19 147.62 40.09 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.266 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -130.02 111.62 12.68 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 588' ' ' LEU . . . . . 0.523 HD21 ' H ' ' A' ' 561' ' ' ARG . 4.9 mp -122.18 179.39 4.56 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.115 0.483 . . . . 10.0 111.594 -178.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 51.9 p -132.3 179.91 5.83 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.059 179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 71.4 mmm -83.46 -8.32 59.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.857 0.361 . . . . 10.0 111.151 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.12 9.74 40.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.196 0.522 . . . . 10.0 110.062 179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.67 149.2 38.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.659 -0.7 . . . . 10.0 110.533 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -59.94 -28.17 67.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.164 -0.471 . . . . 10.0 111.603 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.654 ' O ' HG12 ' A' ' 597' ' ' ILE . 7.2 tp -63.8 -26.41 68.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.415 -179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 22.4 mmt -77.44 -2.74 36.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.875 0.369 . . . . 10.0 111.286 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 30.8 mmm180 -101.92 -1.51 31.86 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.231 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.654 HG12 ' O ' ' A' ' 594' ' ' LEU . 16.6 pt -94.36 4.6 8.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.965 0.412 . . . . 10.0 110.807 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -86.17 19.76 2.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.953 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 71.44 -59.29 0.55 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.733 0.813 . . . . 10.0 111.997 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 1.7 m -122.1 139.28 53.91 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.304 -0.258 . . . . 10.0 110.304 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -64.93 -26.16 68.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.09 0.471 . . . . 10.0 110.336 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.2 -32.56 70.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.461 179.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.8 t -67.35 -45.56 85.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.67 -0.492 . . . . 10.0 109.67 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.01 -22.97 63.06 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.669 -0.696 . . . . 10.0 110.404 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -59.92 -25.95 62.42 Favored Glycine 0 C--N 1.332 0.331 0 CA-C-N 115.912 -0.585 . . . . 10.0 112.715 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -65.41 -18.55 65.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.666 0.269 . . . . 10.0 111.047 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -94.99 -14.57 24.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.514 -0.312 . . . . 10.0 110.907 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 608' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -69.01 -30.42 68.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.893 0.378 . . . . 10.0 110.747 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 9.8 mmmm -98.28 30.2 3.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.912 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 38.8 tp -84.99 -8.47 58.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.618 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 91.42 -57.01 3.13 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.711 -0.756 . . . . 10.0 111.808 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 612' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 69.88 -69.26 0.17 Allowed 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.352 0.661 . . . . 10.0 111.795 179.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp 66.57 93.58 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.277 0 O-C-N 123.563 0.539 . . . . 10.0 110.858 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 614' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -59.29 101.94 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.96 2.44 . . . . 10.0 112.472 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 123.18 -18.81 7.81 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.036 -0.602 . . . . 10.0 111.86 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -98.55 136.96 37.9 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.123 -0.325 . . . . 10.0 110.123 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -80.45 104.9 11.3 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.331 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 9.1 tp -61.8 -35.9 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.046 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 40.22 65.91 0.68 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.72 0.808 . . . . 10.0 112.942 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -117.77 108.97 42.02 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.44 -23.2 44.22 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 123.062 2.508 . . . . 10.0 114.447 -178.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 65.6 p-90 -68.13 -18.93 64.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.749 -0.38 . . . . 10.0 111.433 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 87.5 t -64.5 -49.29 81.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.05 -33.68 75.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.616 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -69.14 -44.72 71.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.51 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -63.17 -43.57 97.87 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.591 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 89.8 mt -63.51 -44.78 98.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.559 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -61.32 -37.58 83.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.988 0.423 . . . . 10.0 110.677 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -66.13 -45.56 80.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.042 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . . . . . . . . . . . -62.89 -45.71 91.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.638 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 631' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 635' ' ' GLU . 44.1 mt-30 -60.64 -48.63 80.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.778 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -60.92 -34.2 74.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.527 -0.306 . . . . 10.0 110.189 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -64.71 -42.57 95.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 10.0 109.998 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 634' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 637' ' ' ARG . 70.1 t -62.81 -42.39 96.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.025 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.602 ' HA ' ' ND2' ' A' ' 638' ' ' ASN . 4.5 mm-40 -68.26 -28.98 67.68 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.743 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 51.1 m -67.37 -28.47 67.98 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.461 0.648 . . . . 10.0 109.339 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 637' ' ' ARG . . . . . 0.506 ' HB3' ' O ' ' A' ' 634' ' ' VAL . 16.8 ttp180 -67.31 -38.18 84.55 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.137 -0.938 . . . . 10.0 109.64 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . 0.602 ' ND2' ' HA ' ' A' ' 635' ' ' GLU . 12.2 m-20 -60.26 -45.42 93.34 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.579 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 639' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -57.53 -46.02 84.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.125 -0.943 . . . . 10.0 111.533 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 640' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -61.51 -43.81 98.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.618 0.247 . . . . 10.0 110.801 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 73.9 mt -64.57 -46.81 91.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.372 -0.377 . . . . 10.0 110.275 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 642' ' ' ARG . . . . . 0.444 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 12.2 mtm-85 -61.1 -42.41 98.46 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.061 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -58.05 -44.13 87.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.602 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 644' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.42 -44.88 95.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.621 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 71.7 mt -66.54 -40.76 89.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.072 -0.513 . . . . 10.0 111.005 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 646' ' ' LEU . . . . . 0.451 ' O ' ' HB2' ' A' ' 650' ' ' ASP . 82.6 mt -61.68 -27.92 69.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.385 -0.37 . . . . 10.0 111.115 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -69.0 -20.69 64.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.96 0.41 . . . . 10.0 110.682 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 648' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -101.52 -39.7 7.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.658 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -67.19 -34.21 77.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.653 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 650' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 4.4 t0 -65.94 -26.93 67.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.91 0.386 . . . . 10.0 111.153 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 24.3 t -63.07 -44.47 99.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.158 0.504 . . . . 10.0 110.1 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -71.7 -29.13 64.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.701 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -66.91 -46.68 74.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.379 -0.828 . . . . 10.0 110.43 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -57.23 -48.71 78.14 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.516 0.51 . . . . 10.0 110.533 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 655' ' ' GLN . . . . . 0.453 HE22 ' HB2' ' A' ' 807' ' ' SER . 74.2 mt-30 -62.23 -42.53 99.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.792 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 9.8 ttp-105 -63.31 -42.58 99.03 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 120.974 0.416 . . . . 10.0 109.984 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 46.1 ttp180 -59.87 -47.09 87.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.769 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -66.37 -46.66 75.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.973 -0.558 . . . . 10.0 112.046 -179.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 659' ' ' ILE . . . . . 0.41 HD12 ' HA ' ' A' ' 659' ' ' ILE . 10.1 tp -69.07 -33.47 58.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 121.126 -0.23 . . . . 10.0 111.61 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 -68.11 -31.42 71.0 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.182 -0.303 . . . . 10.0 110.182 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.3 m -67.55 -45.87 74.4 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.769 -0.456 . . . . 10.0 109.769 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -65.58 -44.84 85.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.442 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 42.6 ttt-85 -61.27 -37.14 82.09 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.35 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -73.98 -35.94 64.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.203 -0.453 . . . . 10.0 111.19 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -63.5 -49.25 74.31 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.688 -0.486 . . . . 10.0 109.688 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 666' ' ' LEU . . . . . 0.451 ' O ' ' HE3' ' A' ' 764' ' ' LYS . 88.1 mt -59.76 -28.98 67.86 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.169 0.509 . . . . 10.0 110.282 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.409 ' O ' ' HD3' ' A' ' 195' ' ' PRO . 0.9 OUTLIER -74.73 -46.56 36.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.507 -0.77 . . . . 10.0 110.594 179.433 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.68 -49.34 59.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.757 -0.656 . . . . 10.0 112.051 -178.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 9.8 m -73.28 150.94 7.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.065 0.459 . . . . 10.0 111.055 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 11.1 m -101.92 -36.8 8.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.238 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -79.96 90.18 5.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.866 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 672' ' ' VAL . . . . . 0.498 ' O ' HG12 ' A' ' 676' ' ' ILE . 9.6 p -92.87 -9.97 9.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.543 0.687 . . . . 10.0 109.477 178.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.63 -42.35 67.67 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 114.829 -1.078 . . . . 10.0 111.838 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -56.22 -51.44 68.07 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.341 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 675' ' ' THR . . . . . 0.487 ' O ' HG12 ' A' ' 679' ' ' ILE . 2.4 m -60.94 -45.81 93.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.084 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 676' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 672' ' ' VAL . 48.1 mm -55.13 -47.32 77.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.474 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -70.65 -39.72 73.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.586 -0.279 . . . . 10.0 111.436 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 50.0 m -60.99 -46.58 90.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.47 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 679' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 675' ' ' THR . 38.0 pt -76.24 -21.22 15.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.563 -0.289 . . . . 10.0 111.234 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 23.5 ttm-85 -60.01 -46.91 87.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.799 0.333 . . . . 10.0 110.77 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -62.28 -45.16 94.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.64 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -62.05 -52.01 65.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.592 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 683' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 679' ' ' ILE . 88.7 t -57.81 -45.36 87.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.236 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -63.79 -46.04 86.99 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.929 -0.308 . . . . 10.0 110.592 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 51.3 tttm -61.38 -47.68 84.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.667 -0.242 . . . . 10.0 110.704 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -58.25 -39.24 78.65 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.195 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 26.8 m -69.42 -39.09 78.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.428 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.2 mt -67.97 -46.96 80.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.545 179.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 689' ' ' ASP . . . . . 0.498 ' HA ' ' O ' ' A' ' 692' ' ' ILE . 85.4 m-20 -59.81 -20.84 59.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.959 -178.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -69.46 -41.87 75.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.505 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 691' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -105.47 -14.62 15.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.947 0.403 . . . . 10.0 111.489 -179.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 692' ' ' ILE . . . . . 0.502 HG23 ' CD1' ' A' ' 701' ' ' TRP . 35.3 mt -132.67 97.66 17.12 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.678 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.12 130.76 37.83 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.333 2.022 . . . . 10.0 111.389 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 694' ' ' PRO . . . . . 0.46 ' HA ' ' NH2' ' A' ' 736' ' ' ARG . 12.1 Cg_endo -56.1 118.44 5.23 Favored 'Trans proline' 0 C--O 1.238 0.499 0 C-N-CA 122.614 2.209 . . . . 10.0 112.508 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 62.12 72.09 0.51 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.438 -0.801 . . . . 10.0 111.257 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 52.0 p -141.84 -167.38 2.43 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.994 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 78.8 mt -83.58 142.79 30.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.473 -0.331 . . . . 10.0 110.578 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . 0.505 ' HA ' ' CD2' ' A' ' 701' ' ' TRP . 24.5 tt0 -61.11 -26.32 67.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.212 0.53 . . . . 10.0 111.153 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -71.08 -16.39 62.58 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.905 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 14.6 mmt -97.35 6.3 48.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.657 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 701' ' ' TRP . . . . . 0.505 ' CD2' ' HA ' ' A' ' 698' ' ' GLU . 49.7 m0 -98.49 114.5 26.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.088 -178.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 702' ' ' ASP . . . . . 0.616 ' OD1' ' HD3' ' B' ' 6' ' ' ARG . 9.5 t70 -86.15 77.74 9.52 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.961 -0.755 . . . . 10.0 108.961 178.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 703' ' ' ILE . . . . . 0.497 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 36.9 mm -53.52 -48.75 91.86 Favored Pre-proline 0 CA--C 1.537 0.459 0 CA-C-N 115.193 -0.912 . . . . 10.0 112.13 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 704' ' ' PRO . . . . . 0.497 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 47.6 Cg_exo -56.44 -37.4 97.26 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 121.805 1.67 . . . . 10.0 112.303 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -69.45 -40.26 79.35 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 121.246 -0.502 . . . . 10.0 112.344 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 37.8 tp -67.15 -44.59 79.43 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -63.65 -37.2 86.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.966 -0.561 . . . . 10.0 109.926 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -55.93 -48.49 75.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.516 -0.765 . . . . 10.0 110.611 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -74.77 -34.84 62.53 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.869 -0.605 . . . . 10.0 111.664 -178.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 51.3 mt -68.14 -50.77 52.51 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.729 0.27 . . . . 10.0 111.729 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -66.38 -31.84 72.86 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.028 0.381 . . . . 10.0 112.028 -178.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -87.7 -71.19 0.58 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.748 0.647 . . . . 10.0 112.748 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 713' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.28 -58.53 6.83 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.214 0.82 . . . . 10.0 113.214 -176.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -79.06 -11.8 60.0 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.478 0.918 . . . . 10.0 113.478 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 2.2 t70 63.13 24.59 14.5 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.537 0.684 . . . . 10.0 110.051 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . 0.438 ' HG ' ' HG ' ' A' ' 718' ' ' LEU . 18.9 tp -104.71 98.74 8.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.582 -0.735 . . . . 10.0 110.34 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -82.99 97.16 8.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.124 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.438 ' HG ' ' HG ' ' A' ' 716' ' ' LEU . 80.3 mt -129.12 119.75 19.87 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.074 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 719' ' ' PRO . . . . . 0.425 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 92.2 Cg_endo -82.09 79.06 3.23 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.627 2.218 . . . . 10.0 111.399 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 720' ' ' ILE . . . . . 0.404 HG23 HD11 ' A' ' 735' ' ' LEU . 57.9 mt -60.96 -39.29 81.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.51 -179.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -66.04 -13.97 60.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.103 0.478 . . . . 10.0 111.162 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 722' ' ' GLU . . . . . 0.498 ' O ' ' HD2' ' A' ' 726' ' ' LYS . 4.4 tp10 -92.96 -10.4 36.55 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.701 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 45.2 m0 -96.97 -48.62 5.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.745 0.307 . . . . 10.0 111.643 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 63.2 mt -56.78 -22.63 37.4 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.269 0.84 . . . . 10.0 113.269 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.47 -19.75 21.69 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.794 0.294 . . . . 10.0 111.794 -179.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 726' ' ' LYS . . . . . 0.498 ' HD2' ' O ' ' A' ' 722' ' ' GLU . 36.3 mttp -99.93 -38.43 8.61 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.702 0.26 . . . . 10.0 111.702 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -128.74 86.41 57.62 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-O 121.162 0.506 . . . . 10.0 110.796 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -65.93 -13.27 39.08 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.925 2.417 . . . . 10.0 111.749 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 40.2 mp0 -66.02 -15.2 62.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.344 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 730' ' ' LEU . . . . . . . . . . . . . 35.6 mt -71.74 -40.24 69.51 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 110.078 -0.341 . . . . 10.0 110.078 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 53.35 -88.27 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.203 -0.908 . . . . 10.0 112.053 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -144.31 -49.94 0.28 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.901 -0.32 . . . . 10.0 111.817 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -59.25 -58.89 6.66 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.781 0.325 . . . . 10.0 110.688 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.0 -26.35 68.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.554 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . 0.404 HD11 HG23 ' A' ' 720' ' ' ILE . 27.7 tp -65.57 -47.45 75.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.903 -0.589 . . . . 10.0 109.58 178.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 736' ' ' ARG . . . . . 0.46 ' NH2' ' HA ' ' A' ' 694' ' ' PRO . 73.8 mtt-85 -64.87 -44.9 88.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.266 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -57.08 -40.34 76.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.359 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 738' ' ' ARG . . . . . . . . . . . . . 15.3 mmm-85 -61.25 -40.19 93.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.937 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 79.6 mt -64.99 -43.71 96.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.399 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 52.1 tp -71.02 -37.45 72.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.415 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -66.87 -40.89 87.99 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.984 0.421 . . . . 10.0 110.599 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 742' ' ' GLN . . . . . 0.414 ' O ' HG23 ' A' ' 746' ' ' VAL . 2.2 tp60 -66.67 -36.08 81.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.775 -0.648 . . . . 10.0 111.361 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.44 -41.57 88.96 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 744' ' ' ILE . . . . . . . . . . . . . 82.1 mt -65.8 -35.87 76.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 109.543 -0.54 . . . . 10.0 109.543 178.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.19 -55.28 26.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.98 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 749' ' ' ARG . 88.1 t -58.24 -35.87 55.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.328 179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -59.24 -51.01 71.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.304 179.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 748' ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 -64.5 -38.2 90.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.617 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 749' ' ' ARG . . . . . 0.415 ' HD3' ' HA ' ' A' ' 746' ' ' VAL . 77.2 mtp180 -61.07 -36.75 80.46 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.403 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -80.34 -36.93 33.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.589 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -60.32 -42.84 96.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.597 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -65.22 -12.63 53.36 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.248 0.462 . . . . 10.0 112.248 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 84.3 t -79.58 -43.34 23.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.725 0.298 . . . . 10.0 111.326 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 15.1 m -99.54 -20.21 5.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 112.066 0.395 . . . . 10.0 112.066 -179.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 110.04 144.35 10.23 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.707 -0.759 . . . . 10.0 112.002 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 756' ' ' ALA . . . . . 0.44 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -60.16 -43.75 95.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.732 0.301 . . . . 10.0 110.899 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -58.99 -43.72 91.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.843 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 12.9 tpt -65.2 -44.25 88.96 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.817 -0.629 . . . . 10.0 110.383 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 50.9 mmm -63.02 -46.95 85.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.144 -0.48 . . . . 10.0 111.621 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -56.48 -39.73 73.72 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.916 0.389 . . . . 10.0 110.8 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -70.94 -40.8 71.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.142 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -63.69 -44.31 94.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.869 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -57.35 -45.47 84.31 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.028 0.442 . . . . 10.0 110.503 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 764' ' ' LYS . . . . . 0.451 ' HE3' ' O ' ' A' ' 666' ' ' LEU . 72.4 tttt -62.17 -45.47 93.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.005 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -61.72 -44.18 98.26 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 115.833 -0.621 . . . . 10.0 112.309 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 65.3 t -63.47 -44.59 98.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.392 0.139 . . . . 10.0 110.906 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -57.69 -49.05 77.79 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.838 0.351 . . . . 10.0 110.583 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 73.3 mt -64.85 -39.93 94.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.812 -0.631 . . . . 10.0 110.15 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -58.89 -57.57 12.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.826 -0.625 . . . . 10.0 111.199 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 770' ' ' THR . . . . . 0.489 HG21 ' HB3' ' A' ' 821' ' ' GLU . 17.1 m -60.4 -41.05 93.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.515 -0.311 . . . . 10.0 111.369 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.45 -47.15 85.33 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.924 0.393 . . . . 10.0 109.991 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 772' ' ' ASP . . . . . 0.461 ' O ' ' HD3' ' A' ' 776' ' ' LYS . 9.9 t70 -64.82 -41.67 95.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.773 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 773' ' ' SER . . . . . 0.422 ' HB3' ' O ' ' B' ' 19' ' ' ALA . 23.2 m -62.04 -45.03 95.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.129 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 35.8 mt -69.53 -32.34 71.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.737 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -63.1 -40.01 96.39 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.84 -0.43 . . . . 10.0 109.84 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.461 ' HD3' ' O ' ' A' ' 772' ' ' ASP . 14.4 mptt -63.2 -42.79 99.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.861 -0.608 . . . . 10.0 110.268 179.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 777' ' ' GLU . . . . . . . . . . . . . 14.2 tm-20 -65.58 -49.5 68.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.792 -0.64 . . . . 10.0 109.712 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 778' ' ' HIS . . . . . 0.535 ' O ' ' HG2' ' A' ' 782' ' ' MET . 43.3 t60 -58.48 -34.23 70.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.339 -0.846 . . . . 10.0 111.276 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 779' ' ' LEU . . . . . . . . . . . . . 25.5 mt -62.08 -42.12 98.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.882 0.372 . . . . 10.0 110.275 179.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -73.05 -41.45 64.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.447 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.18 -32.01 71.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.98 -0.554 . . . . 10.0 111.695 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 782' ' ' MET . . . . . 0.535 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 84.8 mmm -62.68 -35.2 78.89 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.08 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 783' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -63.25 -50.55 69.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.854 0.359 . . . . 10.0 110.086 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -62.13 -27.07 68.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.393 -0.821 . . . . 10.0 111.24 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . 0.466 ' O ' HG12 ' A' ' 789' ' ' ILE . 9.5 mt -75.21 -45.86 37.64 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.28 178.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -60.69 -51.96 67.15 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.628 -179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 787' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.71 -28.02 63.41 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.778 0.323 . . . . 10.0 110.375 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -68.05 -18.93 71.42 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.998 -0.546 . . . . 10.0 112.746 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 789' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 785' ' ' LEU . 16.2 mm -63.05 -24.38 35.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.736 0.303 . . . . 10.0 110.717 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 34.3 m80 -69.77 -14.75 62.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.779 0.323 . . . . 10.0 110.264 179.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 16.6 mt -112.44 -34.32 5.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.669 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 792' ' ' ARG . . . . . 0.488 ' HD3' ' OE2' ' A' ' 806' ' ' GLU . 30.6 mtt180 -80.39 -21.68 42.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 10.0 111.143 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . -78.1 79.19 1.49 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.252 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 6.8 p90 -69.81 167.81 16.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.047 0.451 . . . . 10.0 110.982 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -70.13 170.92 10.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.987 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 30.3 tp60 68.81 12.53 8.68 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.886 -0.597 . . . . 10.0 111.339 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 797' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -154.76 150.88 28.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.155 -0.475 . . . . 10.0 109.967 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -89.03 139.51 28.92 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.191 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -59.92 -25.45 79.53 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.799 2.333 . . . . 10.0 112.869 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 800' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 801' ' ' GLN . 34.3 mtmm -79.59 162.58 25.24 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.52 -0.548 . . . . 10.0 109.52 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 801' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 800' ' ' LYS . 8.4 mm100 72.62 -53.53 0.7 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.536 0.522 . . . . 10.0 110.803 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -59.92 -47.87 84.03 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.432 -0.581 . . . . 10.0 109.432 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 803' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -54.91 -35.51 64.23 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.738 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -69.3 -47.01 65.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.576 . . . . 10.0 110.373 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -61.16 -41.35 96.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.538 -0.301 . . . . 10.0 111.026 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 806' ' ' GLU . . . . . 0.488 ' OE2' ' HD3' ' A' ' 792' ' ' ARG . 2.2 mm-40 -62.82 -51.05 68.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.266 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 807' ' ' SER . . . . . 0.453 ' HB2' HE22 ' A' ' 655' ' ' GLN . 6.2 p -67.6 -38.71 84.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.395 -0.366 . . . . 10.0 111.742 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -63.34 -34.23 77.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.538 0.209 . . . . 10.0 110.814 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 57.9 m -62.53 -38.41 89.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.138 0.494 . . . . 10.0 110.19 179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 810' ' ' MET . . . . . 0.407 ' HA ' ' HA ' ' A' ' 302' ' ' ALA . 46.8 ttm -71.95 -34.14 68.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.112 179.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -62.63 -41.28 98.92 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.539 -0.541 . . . . 10.0 109.539 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -66.21 -44.33 84.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.166 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -64.16 -32.09 73.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.5 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 28.7 ttp -63.18 -41.88 99.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.467 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 49.1 mt -68.06 -35.55 78.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.915 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 816' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -65.13 -45.3 85.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.059 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 7.3 m -71.75 -27.95 63.32 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.683 -0.69 . . . . 10.0 111.002 179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 29.4 tp -54.76 -58.81 6.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.348 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 819' ' ' LYS . . . . . . . . . . . . . 12.9 pttp -67.99 -26.35 65.87 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.348 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -61.17 -48.25 82.44 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.862 0.363 . . . . 10.0 110.364 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . 0.489 ' HB3' HG21 ' A' ' 770' ' ' THR . 0.8 OUTLIER -70.83 -46.69 62.3 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.332 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 822' ' ' VAL . . . . . . . . . . . . . 54.1 t -51.08 -52.52 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.807 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 823' ' ' ILE . . . . . 0.444 HD11 HG13 ' A' ' 679' ' ' ILE . 27.8 mm -64.65 -43.79 96.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.591 -0.277 . . . . 10.0 111.427 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 30.9 m -62.88 -45.9 90.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.735 0.302 . . . . 10.0 110.859 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 95.1 m -61.61 -41.87 98.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.606 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 826' ' ' LEU . . . . . . . . . . . . . 57.0 mt -71.96 -37.19 69.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.433 -0.348 . . . . 10.0 111.816 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 15.6 m -75.41 -32.83 60.87 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.81 0.338 . . . . 10.0 110.908 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 828' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -86.47 15.47 5.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.401 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.2 p -62.46 128.79 24.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -93.82 96.11 9.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.957 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 23.3 m -109.32 164.07 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.489 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 832' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 832' ' ' ARG . 10.5 mmt-85 -85.79 81.03 8.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.576 -179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 95.2 mtp -65.04 116.64 31.8 Favored Pre-proline 0 C--N 1.328 -0.335 0 N-CA-C 110.047 -0.353 . . . . 10.0 110.047 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -89.0 -152.73 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.991 2.461 . . . . 10.0 112.773 -179.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -71.25 103.22 2.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.389 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 836' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.741 -0.647 . . . . 10.0 110.455 -179.927 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mpp? . . . . . 0 N--CA 1.483 1.217 0 CA-C-O 120.672 0.272 . . . . 10.0 110.503 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 11.2 tpt -131.7 111.95 12.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.174 -0.466 . . . . 10.0 109.782 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 7.9 mt -91.51 85.79 2.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.114 0.483 . . . . 10.0 110.48 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.39 96.23 5.29 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.155 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 23.9 mt -97.21 126.15 42.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.43 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.616 ' HD3' ' OD1' ' A' ' 702' ' ' ASP . 7.8 ttm180 -99.94 131.72 45.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.737 0.303 . . . . 10.0 110.306 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.27 143.11 30.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.169 -0.469 . . . . 10.0 111.195 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.88 36.49 2.17 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.499 0.666 . . . . 10.0 109.763 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -149.44 145.0 26.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.374 -0.83 . . . . 10.0 109.331 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 26.4 tttm -139.21 134.8 33.22 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.731 0.3 . . . . 10.0 110.42 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 17.9 mt -130.01 79.96 72.0 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.239 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.91 -15.6 29.52 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.49 2.126 . . . . 10.0 112.589 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.491 ' O ' HG23 ' B' ' 17' ' ' VAL . 0.6 OUTLIER -67.02 -21.55 65.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.264 -179.591 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.38 -52.36 58.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.534 -0.303 . . . . 10.0 111.636 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 17.0 m -80.26 -21.41 11.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.59 -0.277 . . . . 10.0 111.549 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.97 -33.99 75.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.302 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.491 HG23 ' O ' ' B' ' 13' ' ' LEU . 16.2 t -77.38 -36.65 24.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.492 -0.322 . . . . 10.0 110.548 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.36 -49.84 73.97 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 121.075 0.464 . . . . 10.0 110.904 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.422 ' O ' ' HB3' ' A' ' 773' ' ' SER . . . -85.46 4.4 35.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.084 0.469 . . . . 10.0 110.448 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -102.1 20.38 45.55 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.87 -0.605 . . . . 10.0 112.395 -179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 229' ' ' ALA . 18.0 m -85.15 1.73 4.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.4 0.619 . . . . 10.0 110.472 179.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 12.9 tmm? -67.15 125.7 26.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.525 -0.761 . . . . 10.0 110.526 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -115.62 58.47 0.73 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.186 0.517 . . . . 10.0 110.564 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -122.37 21.53 10.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.977 0.418 . . . . 10.0 111.09 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 21.7 mp0 -81.26 53.1 1.96 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.109 0.481 . . . . 10.0 110.722 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -88.67 75.36 8.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.572 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -125.29 148.87 48.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.582 -179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.158 -0.925 . . . . 10.0 109.797 -179.769 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 91.1 t . . . . . 0 N--CA 1.477 0.89 0 N-CA-C 109.853 -0.425 . . . . 10.0 109.853 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -75.28 143.55 42.94 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.157 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 98.67 -151.2 19.5 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.869 -0.682 . . . . 10.0 111.617 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.96 175.33 10.14 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.585 0.231 . . . . 10.0 110.406 179.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.437 ' HD2' ' OD2' ' A' ' 408' ' ' ASP . 15.7 mmt85 -116.24 172.49 7.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.731 0.301 . . . . 10.0 111.286 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.6 t30 62.95 -90.1 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.391 -0.822 . . . . 10.0 111.36 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -59.39 -50.4 74.09 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.124 0.487 . . . . 10.0 111.4 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -68.15 -35.31 77.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.537 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.416 ' OG1' ' HA ' ' A' ' 13' ' ' ARG . 18.5 m -62.13 -46.63 88.18 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.814 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.2 mt -59.72 -40.73 88.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.879 0.371 . . . . 10.0 110.797 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.7 OUTLIER -65.28 -49.61 68.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.006 -179.801 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -63.4 -38.22 90.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.947 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.546 ' HG3' ' SD ' ' A' ' 92' ' ' MET . 0.0 OUTLIER -66.6 -42.11 87.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.711 179.57 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -58.39 -37.11 74.61 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.555 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -62.64 -37.35 86.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.355 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.3 t -75.48 -37.57 37.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.739 179.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.424 ' HA ' HD12 ' A' ' 28' ' ' ILE . 46.8 t -58.49 -36.59 59.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.927 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -59.42 -41.21 89.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.595 . . . . 10.0 109.801 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.5 mt -65.2 -43.41 95.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.876 -0.602 . . . . 10.0 109.954 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.424 HD12 ' HA ' ' A' ' 25' ' ' VAL . 64.1 mt -61.94 -41.77 92.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.204 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -63.39 -36.1 82.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.733 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.37 -24.26 50.67 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.33 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 35.6 mtt -86.2 -16.51 37.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.45 -0.341 . . . . 10.0 111.382 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.486 ' OE1' ' HD2' ' A' ' 82' ' ' ARG . 3.9 tt0 -57.88 -53.56 64.52 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-O 119.485 -0.293 . . . . 10.0 111.537 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.455 ' HD3' ' HB3' ' A' ' 32' ' ' GLU . 31.2 Cg_exo -60.52 -25.89 81.62 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.647 1.565 . . . . 10.0 111.86 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -71.84 -45.35 61.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.243 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 26.2 mmt -66.06 -26.01 67.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.663 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -67.95 -15.2 63.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.004 -0.543 . . . . 10.0 110.994 179.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.6 mtpt -93.07 -5.0 51.42 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.322 0.582 . . . . 10.0 110.038 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.7 mp -98.1 145.15 26.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.29 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.5 p -77.66 170.55 16.38 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.171 -0.468 . . . . 10.0 109.862 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.83 -43.5 90.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.149 0.5 . . . . 10.0 110.364 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -65.55 -30.53 71.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.652 -0.704 . . . . 10.0 111.043 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -70.05 -33.91 72.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.622 0.249 . . . . 10.0 110.409 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 73.3 mt -65.45 -42.24 92.58 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -64.81 -31.3 72.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.261 -0.881 . . . . 10.0 109.417 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -65.6 -34.47 89.11 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.412 -0.813 . . . . 10.0 112.144 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -65.3 -36.16 83.21 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.979 -0.378 . . . . 10.0 109.979 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.9 m -61.74 -43.67 98.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.269 0.557 . . . . 10.0 109.66 178.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -68.9 -30.29 68.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.552 -0.749 . . . . 10.0 109.774 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -68.2 -45.89 72.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.592 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -58.53 -42.84 88.68 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.178 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -60.51 -46.63 89.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.914 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.21 -32.72 73.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.352 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 43.4 mtp180 -68.24 -49.35 61.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.857 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 82.6 mt -61.05 -31.96 71.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.006 0.432 . . . . 10.0 110.535 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -62.22 -44.99 95.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.902 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -83.08 -48.99 9.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.07 -179.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 163.53 111.48 0.26 Allowed Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.51 -0.636 . . . . 10.0 111.51 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -166.66 154.68 9.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.42 -0.585 . . . . 10.0 109.42 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 43.9 t -99.83 131.67 46.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 109.981 -0.377 . . . . 10.0 109.981 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 118' ' ' LEU . 14.8 tp -60.09 -42.72 95.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.193 0.521 . . . . 10.0 110.269 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.6 mp0 -65.4 -19.68 66.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.014 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -87.21 -18.58 29.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.356 0.598 . . . . 10.0 110.176 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.7 mt -83.06 -13.68 55.3 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.951 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 65' ' ' PRO . 89.3 mt -48.69 -53.41 36.69 Favored Pre-proline 0 CA--C 1.542 0.652 0 N-CA-C 113.322 0.86 . . . . 10.0 113.322 -178.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 64' ' ' ILE . 51.1 Cg_exo -53.38 -47.34 27.93 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.021 1.814 . . . . 10.0 113.098 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.49 ' O ' HG23 ' A' ' 70' ' ' VAL . 42.0 mt-10 -74.9 -46.45 35.9 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.813 -178.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.47 ' O ' HG23 ' A' ' 71' ' ' VAL . . . -58.83 -49.97 75.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.977 -178.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -62.18 -34.73 76.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.85 -179.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.8 -44.38 85.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.192 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 66' ' ' GLU . 95.7 t -62.44 -45.69 98.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.237 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 67' ' ' ALA . 59.1 t -61.8 -44.94 99.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.127 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.7 ttm180 -60.26 -42.87 96.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.116 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.411 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 30.1 tp10 -61.36 -48.67 80.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.379 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.97 73.17 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.911 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.7 m -62.08 -35.11 77.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.952 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 73' ' ' GLU . 24.5 mtmt -78.36 -18.2 55.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.527 -179.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -98.42 -45.9 5.97 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 111.782 0.29 . . . . 10.0 111.782 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 76.5 t -76.05 -54.92 12.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.687 0.28 . . . . 10.0 111.639 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -90.11 -43.05 10.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.714 0.292 . . . . 10.0 111.205 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.2 16.62 24.75 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.806 -0.711 . . . . 10.0 111.591 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 67.6 mtm -131.04 124.18 30.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.754 0.311 . . . . 10.0 110.191 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.486 ' HD2' ' OE1' ' A' ' 32' ' ' GLU . 9.5 ttp180 -71.07 133.35 46.21 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.875 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.95 117.5 7.09 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.265 -0.642 . . . . 10.0 109.265 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.422 ' HB2' ' HG3' ' A' ' 87' ' ' GLN . 33.1 m-85 -56.66 149.56 17.52 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.451 0.469 . . . . 10.0 111.278 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -61.71 -34.08 75.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.037 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.55 ' HA ' HD12 ' A' ' 89' ' ' LEU . 20.6 m -68.1 -29.96 46.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 10.0 110.79 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.458 HE22 HD23 ' A' ' 110' ' ' LEU . 96.3 mt-30 -70.64 -31.09 67.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.07 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 74.6 mt -64.29 -34.19 77.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.793 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.55 HD12 ' HA ' ' A' ' 86' ' ' VAL . 14.5 mt -66.85 -49.75 64.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.684 178.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -63.58 -46.25 92.72 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.629 -0.714 . . . . 10.0 112.501 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -61.29 -31.93 78.92 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.996 -0.621 . . . . 10.0 112.213 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . 0.546 ' SD ' ' HG3' ' A' ' 21' ' ' MET . 14.9 ttm -72.6 -35.44 67.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.993 0.425 . . . . 10.0 110.44 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 89' ' ' LEU . 58.7 t -70.31 -36.33 66.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.127 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 93.8 mt -72.92 3.08 5.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.713 -0.676 . . . . 10.0 112.091 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -80.04 -30.08 39.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.336 0.589 . . . . 10.0 109.485 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -104.75 -167.22 1.32 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.409 -0.814 . . . . 10.0 111.051 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 -86.38 57.58 4.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.065 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 408' ' ' ASP . 31.4 m -127.9 147.79 50.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.957 -0.565 . . . . 10.0 112.05 -178.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.565 HD11 HD13 ' A' ' 407' ' ' LEU . 43.5 mm -100.16 123.85 53.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 108.745 -0.835 . . . . 10.0 108.745 177.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -109.69 134.45 51.96 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.05 0.452 . . . . 10.0 112.056 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 102' ' ' MET . 0.0 OUTLIER -97.21 158.72 15.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.61 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.449 ' SD ' ' HB2' ' A' ' 106' ' ' GLU . 49.2 ttm -171.69 134.97 0.84 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.836 -0.801 . . . . 10.0 108.836 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -62.06 151.6 34.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.239 0.542 . . . . 10.0 111.476 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.0 m -71.51 92.74 1.14 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.929 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 152.7 -28.85 0.84 Allowed Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.783 -0.722 . . . . 10.0 112.205 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.449 ' HB2' ' SD ' ' A' ' 102' ' ' MET . 5.5 mm-40 -66.96 -17.26 64.83 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.769 0.319 . . . . 10.0 111.135 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.28 67.21 0.64 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.744 -0.741 . . . . 10.0 112.429 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -61.07 -58.84 6.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.84 0.352 . . . . 10.0 111.049 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.1 -36.29 81.26 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.969 -179.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.458 HD23 HE22 ' A' ' 87' ' ' GLN . 31.6 tp -67.81 -27.2 66.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.271 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 95.7 m -80.19 -30.4 38.72 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.013 0.435 . . . . 10.0 111.252 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.554 ' HB1' HD21 ' A' ' 207' ' ' LEU . . . -67.29 -12.3 59.76 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.072 0.767 . . . . 10.0 113.072 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 31.8 p -75.63 -24.41 56.45 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.02 0.378 . . . . 10.0 112.02 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.406 ' N ' ' HD2' ' A' ' 115' ' ' PRO . 52.4 mt -65.95 -56.23 18.29 Favored Pre-proline 0 CA--C 1.539 0.541 0 N-CA-C 112.098 0.407 . . . . 10.0 112.098 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 114' ' ' LEU . 38.3 Cg_endo -65.06 -26.16 58.25 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 121.891 1.727 . . . . 10.0 111.881 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.28 -52.71 44.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.526 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.412 ' O ' ' HG ' ' A' ' 121' ' ' LEU . 68.8 t80 -60.41 -43.9 96.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.082 0.467 . . . . 10.0 110.688 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.43 ' O ' HD11 ' A' ' 60' ' ' LEU . 34.7 tp -60.55 -51.07 71.0 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.638 -0.71 . . . . 10.0 112.009 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -73.31 -24.11 60.36 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.839 0.311 . . . . 10.0 111.839 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.457 ' HB1' ' HB3' ' A' ' 173' ' ' ASP . . . -67.12 -24.07 65.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.711 0.291 . . . . 10.0 110.975 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 71.6 mt -59.9 -26.46 65.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.609 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.0 p -66.48 -29.39 69.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.895 0.378 . . . . 10.0 111.171 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 85.96 14.14 67.78 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.782 -0.723 . . . . 10.0 112.602 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -93.06 -12.5 30.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.838 0.351 . . . . 10.0 111.165 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 88.85 119.49 1.67 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.783 -0.723 . . . . 10.0 113.012 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 70.1 t -80.41 115.54 23.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 22.5 m170 -86.16 92.0 8.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.004 0.43 . . . . 10.0 110.339 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 28.3 t -84.65 122.97 38.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.044 -0.525 . . . . 10.0 110.153 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 208' ' ' VAL . 87.1 t -109.7 122.47 64.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.363 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.22 148.16 39.45 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.831 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.599 ' HA ' HD11 ' A' ' 214' ' ' ILE . 4.1 m -54.17 -37.84 36.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 O-C-N 123.486 0.492 . . . . 10.0 112.029 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -141.44 168.53 19.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.465 -0.334 . . . . 10.0 110.561 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -75.17 -26.74 59.3 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.145 -0.48 . . . . 10.0 111.532 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -56.66 -52.88 63.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.892 0.377 . . . . 10.0 110.544 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 98.3 mt -70.76 -34.64 72.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.582 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.61 -52.6 64.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.687 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -67.81 -35.54 78.8 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.999 0.428 . . . . 10.0 110.339 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 138' ' ' ARG . 4.5 ttp180 -58.0 -59.03 5.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.061 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . 0.405 ' CG ' HH21 ' A' ' 138' ' ' ARG . 2.2 m-20 -70.86 -27.98 64.23 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.597 0.592 . . . . 10.0 112.597 -178.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' A' ' 144' ' ' ARG . . . -59.81 -44.28 94.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.861 0.362 . . . . 10.0 110.906 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -88.89 -25.44 22.13 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.429 -179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -71.86 -46.92 56.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.916 0.388 . . . . 10.0 111.241 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -89.36 0.34 56.89 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.438 -0.347 . . . . 10.0 111.046 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 140' ' ' ALA . 58.3 ttm-85 -60.69 -49.67 88.66 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.205 0.446 . . . . 10.0 112.205 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' PRO . . . . . 0.485 ' HD3' ' HB3' ' A' ' 144' ' ' ARG . 28.0 Cg_exo -62.96 -10.57 20.88 Favored 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 122.178 1.919 . . . . 10.0 112.888 -179.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 11.0 tp -92.66 -50.17 5.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.052 0.453 . . . . 10.0 110.288 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -71.79 -45.87 60.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.007 -0.542 . . . . 10.0 112.004 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.94 -24.75 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.982 0.42 . . . . 10.0 110.792 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -70.37 -33.15 71.09 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.764 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 60.1 mt -84.29 -14.91 48.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.811 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 109.94 16.97 10.01 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.798 -0.715 . . . . 10.0 112.951 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 37.2 mt -102.58 134.08 46.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.795 0.331 . . . . 10.0 110.435 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.03 126.69 34.34 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.567 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 46.9 t -106.06 128.63 60.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.908 0.385 . . . . 10.0 110.828 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -124.13 146.99 16.49 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.075 -0.583 . . . . 10.0 111.773 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 3.6 tp -118.56 125.8 74.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.062 0.458 . . . . 10.0 110.44 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -101.68 113.38 26.49 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.054 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 36.0 mt -100.37 141.71 23.23 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.742 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' PRO . . . . . 0.462 ' HA ' ' CD ' ' A' ' 181' ' ' GLU . 24.0 Cg_endo -61.07 107.21 0.44 Allowed 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.962 2.441 . . . . 10.0 112.854 -179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 93.69 16.3 46.17 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.021 -0.609 . . . . 10.0 113.372 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 12.4 ptm -77.64 159.58 76.54 Favored Pre-proline 0 CA--C 1.535 0.393 0 CA-C-N 117.26 0.53 . . . . 10.0 109.9 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -52.06 143.52 40.74 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.062 2.508 . . . . 10.0 113.291 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . 0.483 ' HB3' ' HD3' ' A' ' 164' ' ' PRO . . . -57.89 -49.11 95.53 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.794 -0.639 . . . . 10.0 112.422 -179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' A' ' 163' ' ' ALA . 41.9 Cg_exo -58.69 -36.31 97.36 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.599 1.533 . . . . 10.0 112.046 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -66.02 -39.25 90.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.513 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.411 ' HZ2' ' CG ' ' A' ' 185' ' ' ASP . 57.5 mttm -60.95 -43.58 98.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.155 179.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -59.8 -39.37 84.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.667 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -68.16 -39.32 82.63 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.988 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -73.08 -38.87 66.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.011 -0.541 . . . . 10.0 111.501 -179.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -75.54 -26.29 57.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.686 0.279 . . . . 10.0 111.564 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . 0.403 ' HA ' ' NE ' ' A' ' 201' ' ' ARG . . . -80.34 1.48 28.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.048 0.452 . . . . 10.0 110.756 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -81.61 176.32 9.75 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.802 -0.636 . . . . 10.0 109.722 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' ASP . . . . . 0.457 ' HB3' ' HB1' ' A' ' 120' ' ' ALA . 16.0 m-20 -78.24 -33.42 49.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.881 0.372 . . . . 10.0 110.522 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 88.0 mt -136.79 122.16 26.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.121 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 4.1 m -115.51 122.73 46.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.833 0.349 . . . . 10.0 111.194 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -97.95 136.2 38.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.898 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' GLY . . . . . . . . . . . . . . . -170.81 170.32 43.08 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.441 -0.885 . . . . 10.0 112.817 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' THR . . . . . . . . . . . . . 2.5 m -88.48 151.12 22.75 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 122.43 0.292 . . . . 10.0 110.679 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -57.62 -42.31 83.09 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.052 0.39 . . . . 10.0 112.052 -179.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -58.21 -54.26 48.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.615 -0.266 . . . . 10.0 111.421 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' GLU . . . . . 0.462 ' CD ' ' HA ' ' A' ' 159' ' ' PRO . 4.4 tp10 -65.27 -37.67 87.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.418 -0.355 . . . . 10.0 111.091 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.81 -39.24 80.56 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.897 0.379 . . . . 10.0 110.701 179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -76.13 -42.64 23.57 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.85 -0.69 . . . . 10.0 111.596 179.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -61.95 -37.97 86.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.89 0.376 . . . . 10.0 110.429 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . 0.411 ' CG ' ' HZ2' ' A' ' 166' ' ' LYS . 8.3 m-20 -59.5 -44.06 93.21 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.799 -0.637 . . . . 10.0 110.429 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.64 -38.78 91.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.47 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' LEU . . . . . 0.462 HD11 HG22 ' A' ' 375' ' ' ILE . 47.5 mt -64.58 -46.62 81.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.819 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 28.3 mtm180 -69.68 -35.86 75.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.124 0.488 . . . . 10.0 110.545 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.03 -50.65 71.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.445 -0.798 . . . . 10.0 111.483 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -78.3 -0.9 30.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.732 -0.667 . . . . 10.0 112.438 -178.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' MET . . . . . . . . . . . . . 25.7 ttp -105.39 10.77 33.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.193 0.521 . . . . 10.0 110.403 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' ALA . . . . . 0.441 ' HB1' ' HB2' ' A' ' 197' ' ' GLU . . . -78.05 166.07 23.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.254 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -103.83 -26.24 12.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.078 0.466 . . . . 10.0 110.227 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -118.05 138.52 25.56 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.49 -23.94 76.59 Favored 'Trans proline' 0 CA--C 1.53 0.284 0 C-N-CA 122.614 2.209 . . . . 10.0 112.534 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 37.8 mp0 -78.44 -13.01 60.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.464 -0.334 . . . . 10.0 111.079 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . 0.441 ' HB2' ' HB1' ' A' ' 192' ' ' ALA . 67.6 mt-10 -82.39 -4.99 58.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.549 -0.296 . . . . 10.0 110.902 -179.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' A' ' 198' ' ' ARG . 45.6 mtt85 -62.68 157.78 20.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.284 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 199' ' ' VAL . . . . . . . . . . . . . 12.2 m -133.29 -14.63 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.985 -0.552 . . . . 10.0 111.057 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -91.79 163.79 13.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.179 0.514 . . . . 10.0 111.558 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' ARG . . . . . 0.403 ' NE ' ' HA ' ' A' ' 171' ' ' ALA . 4.6 mtm180 -122.76 174.86 6.86 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.679 -0.86 . . . . 10.0 108.679 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? -55.23 124.67 17.74 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.122 0.487 . . . . 10.0 111.182 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 10.4 mt -79.82 72.32 6.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.69 -0.686 . . . . 10.0 110.307 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' HIS . . . . . . . . . . . . . 9.7 t-160 -88.49 -53.57 4.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.413 -0.358 . . . . 10.0 111.733 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -128.78 138.68 52.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.916 0.388 . . . . 10.0 111.789 -178.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' ALA . . . . . 0.575 ' HB2' ' CD2' ' A' ' 384' ' ' TYR . . . -129.97 135.84 48.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.552 178.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' LEU . . . . . 0.554 HD21 ' HB1' ' A' ' 112' ' ' ALA . 35.7 tp -131.69 109.92 10.52 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.354 -179.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 129' ' ' VAL . 2.9 p -104.97 140.55 22.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.67 0.272 . . . . 10.0 110.98 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.34 -40.59 70.6 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.036 0.384 . . . . 10.0 112.036 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' GLU . . . . . 0.425 ' HB2' ' NH2' ' A' ' 509' ' ' ARG . 7.5 tt0 -135.27 113.72 11.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.036 0.446 . . . . 10.0 111.029 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . 0.495 HG11 HD12 ' A' ' 99' ' ' ILE . 34.2 m -84.54 -14.88 11.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.111 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 216' ' ' ILE . 0.9 OUTLIER -55.53 -71.13 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.057 -0.52 . . . . 10.0 111.729 -179.18 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' SER . . . . . . . . . . . . . 3.1 m -76.13 -38.09 57.23 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.473 0.546 . . . . 10.0 112.473 -178.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' ILE . . . . . 0.599 HD11 ' HA ' ' A' ' 131' ' ' VAL . 45.5 mt -71.55 -43.54 71.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 113.993 1.108 . . . . 10.0 113.993 -177.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 215' ' ' LEU . . . . . 0.407 HD22 ' CE2' ' A' ' 405' ' ' TYR . 17.0 mt -93.74 -50.68 5.26 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.929 0.714 . . . . 10.0 112.929 -177.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 216' ' ' ILE . . . . . 0.421 ' HB ' ' O ' ' A' ' 212' ' ' ASP . 48.6 mm -73.14 -56.68 8.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 217' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -70.97 -39.49 72.48 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 218' ' ' GLU . . . . . 0.51 ' HB2' ' O ' ' A' ' 214' ' ' ILE . 6.0 mm-40 -91.61 19.27 6.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.89 -51.4 69.44 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.947 0.351 . . . . 10.0 111.947 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 220' ' ' ARG . . . . . 0.433 ' O ' ' HD3' ' A' ' 222' ' ' PRO . 0.0 OUTLIER -96.85 32.36 2.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.96 0.409 . . . . 10.0 111.392 -178.571 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 221' ' ' THR . . . . . . . . . . . . . 17.4 m -101.86 105.02 39.24 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-O 120.92 0.39 . . . . 10.0 110.197 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 222' ' ' PRO . . . . . 0.433 ' HD3' ' O ' ' A' ' 220' ' ' ARG . 73.1 Cg_endo -91.33 132.25 1.44 Allowed 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.939 2.426 . . . . 10.0 112.778 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 223' ' ' LEU . . . . . 0.437 ' O ' ' HA ' ' A' ' 374' ' ' SER . 69.2 mt -78.22 105.65 9.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.156 -0.474 . . . . 10.0 109.768 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 59.0 mt -86.49 122.88 39.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.775 -0.648 . . . . 10.0 112.18 -178.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 225' ' ' ILE . . . . . . . . . . . . . 59.8 mt -105.45 134.29 47.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.273 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 226' ' ' SER . . . . . 0.413 ' CB ' HD21 ' A' ' 369' ' ' ASN . 22.3 m -116.41 166.88 11.56 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.477 -0.194 . . . . 10.0 110.477 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . -128.91 158.77 22.05 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.514 -0.85 . . . . 10.0 112.797 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 228' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -76.93 -22.43 11.56 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 122.655 2.237 . . . . 10.0 112.362 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 229' ' ' ALA . . . . . . . . . . . . . . . -130.27 71.91 1.47 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 230' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -81.86 -108.82 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.905 -0.589 . . . . 10.0 112.033 -178.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 231' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.59 175.12 3.03 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.272 0.558 . . . . 10.0 111.801 -178.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 232' ' ' SER . . . . . 0.516 ' HB2' HG13 ' B' ' 17' ' ' VAL . 15.5 m -142.18 145.37 34.09 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.492 0.663 . . . . 10.0 111.677 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 233' ' ' SER . . . . . 0.421 ' HB3' ' HB ' ' A' ' 365' ' ' ILE . 0.1 OUTLIER -57.01 -35.81 69.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.911 -1.041 . . . . 10.0 111.521 179.565 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 234' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -50.22 -42.01 50.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.092 -0.958 . . . . 10.0 112.876 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 235' ' ' MET . . . . . 0.502 ' HB2' HG11 ' B' ' 17' ' ' VAL . 0.4 OUTLIER -72.06 -58.94 3.02 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.815 -0.354 . . . . 10.0 111.695 -178.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 236' ' ' TYR . . . . . 0.449 ' HB3' ' HB2' ' A' ' 359' ' ' ALA . 43.8 m-85 -55.9 -41.43 74.49 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.249 0.462 . . . . 10.0 112.249 -178.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 237' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -67.5 -40.33 85.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.574 0.226 . . . . 10.0 111.1 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.73 -40.6 88.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.978 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 239' ' ' VAL . . . . . . . . . . . . . 98.9 t -68.48 -43.18 84.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.284 -0.416 . . . . 10.0 111.123 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 240' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -78.18 7.44 6.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.712 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 241' ' ' LYS . . . . . . . . . . . . . 3.8 tptm -89.1 -25.94 21.62 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.672 -0.24 . . . . 10.0 111.512 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 242' ' ' ILE . . . . . . . . . . . . . 10.8 tp -88.35 -18.27 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.885 0.374 . . . . 10.0 111.555 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 243' ' ' ILE . . . . . 0.459 ' HB ' ' HD3' ' A' ' 244' ' ' PRO . 57.1 mt -63.55 -48.69 80.52 Favored Pre-proline 0 CA--C 1.541 0.603 0 N-CA-C 112.765 0.654 . . . . 10.0 112.765 -179.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 244' ' ' PRO . . . . . 0.459 ' HD3' ' HB ' ' A' ' 243' ' ' ILE . 24.6 Cg_exo -65.17 -6.71 13.65 Favored 'Trans proline' 0 C--N 1.358 1.06 0 C-N-CA 122.144 1.896 . . . . 10.0 112.996 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 245' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -81.63 -16.84 50.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.966 0.413 . . . . 10.0 110.651 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 246' ' ' LEU . . . . . . . . . . . . . 11.8 mt -90.74 162.42 14.89 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.551 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 247' ' ' ILE . . . . . . . . . . . . . 29.7 pt -114.6 148.19 17.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.336 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 248' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 248' ' ' ARG . 6.3 ptm85 -77.25 107.32 9.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.204 0.526 . . . . 10.0 111.657 -179.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 249' ' ' GLN . . . . . 0.417 ' HG3' ' N ' ' A' ' 250' ' ' GLU . 6.2 pt20 169.38 -30.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.64 -1.164 . . . . 10.0 108.847 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 250' ' ' GLU . . . . . 0.492 ' HG2' ' N ' ' A' ' 251' ' ' LYS . 16.9 tt0 -179.59 163.29 1.17 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.263 -0.88 . . . . 10.0 109.233 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.492 ' N ' ' HG2' ' A' ' 250' ' ' GLU . 48.7 mttm 75.91 80.8 0.1 Allowed 'General case' 0 N--CA 1.468 0.467 0 O-C-N 123.992 0.808 . . . . 10.0 112.479 178.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 252' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 45.48 36.02 2.26 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.749 -1.114 . . . . 10.0 113.263 177.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 253' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -95.17 -33.28 12.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.08 0.467 . . . . 10.0 110.833 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 254' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -113.58 172.98 6.64 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.954 -179.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 255' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.7 -21.61 32.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.305 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 256' ' ' THR . . . . . . . . . . . . . 36.2 m -155.03 -69.1 0.13 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.165 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 257' ' ' PHE . . . . . . . . . . . . . 24.4 t80 62.55 -84.76 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.61 0.569 . . . . 10.0 110.971 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 258' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 60.63 -163.34 0.25 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.874 0.47 . . . . 10.0 111.308 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 259' ' ' GLY . . . . . . . . . . . . . . . -78.39 -5.48 87.73 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.863 -0.684 . . . . 10.0 111.984 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 260' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -83.9 -68.46 0.71 Allowed 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 110.004 -0.369 . . . . 10.0 110.004 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 261' ' ' GLY . . . . . . . . . . . . . . . 68.07 -146.75 46.78 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.964 -0.636 . . . . 10.0 112.901 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 262' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -161.97 152.13 16.93 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.833 -0.803 . . . . 10.0 108.833 -179.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 263' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -73.62 -167.62 0.47 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 120.525 -0.47 . . . . 10.0 110.862 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 264' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.72 69.85 0.12 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.412 0.893 . . . . 10.0 113.412 -178.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 265' ' ' VAL . . . . . . . . . . . . . 1.4 m -153.97 35.45 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 109.027 -0.731 . . . . 10.0 109.027 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 266' ' ' ASP . . . . . 0.566 ' OD1' ' HG2' ' A' ' 268' ' ' LYS . 2.1 t0 73.54 167.02 0.3 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.143 -0.935 . . . . 10.0 110.008 -178.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -126.8 11.98 7.27 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 121.029 -0.269 . . . . 10.0 111.538 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 268' ' ' LYS . . . . . 0.566 ' HG2' ' OD1' ' A' ' 266' ' ' ASP . 0.6 OUTLIER -68.95 113.71 6.6 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.712 0.291 . . . . 10.0 110.37 179.73 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 269' ' ' SER . . . . . . . . . . . . . 20.6 m -87.08 78.86 8.83 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.092 0.473 . . . . 10.0 110.942 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 270' ' ' ARG . . . . . . . . . . . . . 7.2 mmt85 -69.6 -0.86 7.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.026 -0.534 . . . . 10.0 111.216 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -73.83 -15.08 61.18 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.691 179.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 272' ' ' VAL . . . . . . . . . . . . . 23.3 t 64.12 94.04 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 O-C-N 123.563 0.539 . . . . 10.0 111.111 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 273' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -112.57 -80.48 0.59 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.151 -0.477 . . . . 10.0 111.132 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 274' ' ' LEU . . . . . . . . . . . . . 47.7 mt 59.09 83.0 0.13 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.157 0.504 . . . . 10.0 111.088 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 275' ' ' THR . . . . . 0.404 HG23 ' HG2' ' A' ' 277' ' ' ARG . 4.8 t -132.32 154.33 49.83 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.631 -179.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 276' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -74.6 73.8 1.98 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.383 -0.372 . . . . 10.0 111.588 -179.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 277' ' ' ARG . . . . . 0.404 ' HG2' HG23 ' A' ' 275' ' ' THR . 2.2 mmp_? -115.53 176.11 5.22 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.18 -0.304 . . . . 10.0 110.18 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 278' ' ' GLY . . . . . 0.409 ' O ' ' HB2' ' A' ' 279' ' ' LEU . . . 80.89 -59.11 4.76 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.131 -0.557 . . . . 10.0 111.935 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.498 ' O ' HG22 ' A' ' 282' ' ' ILE . 4.1 mm? 72.2 -47.66 0.67 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.52 0.728 . . . . 10.0 111.666 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 280' ' ' VAL . . . . . . . . . . . . . 11.3 p -65.36 -17.88 22.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.068 0.461 . . . . 10.0 111.136 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 281' ' ' LEU . . . . . . . . . . . . . 80.5 mt -68.32 -41.24 81.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.453 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 282' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 279' ' ' LEU . 7.3 tp -62.57 -20.93 26.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 120.837 0.351 . . . . 10.0 111.079 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 283' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -73.04 -24.67 60.74 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.184 0.516 . . . . 10.0 109.951 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 284' ' ' GLU . . . . . . . . . . . . . 40.8 mm-40 -88.43 -36.14 16.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.755 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 285' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.61 -43.72 96.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.401 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 286' ' ' LEU . . . . . . . . . . . . . 48.1 mt -70.23 173.13 7.07 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.284 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 287' ' ' VAL . . . . . 0.539 ' O ' ' HG2' ' A' ' 288' ' ' LYS . 21.6 t 69.88 161.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.004 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 288' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' A' ' 287' ' ' VAL . 0.0 OUTLIER 67.78 179.05 0.23 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.602 0.761 . . . . 10.0 111.291 -179.914 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 72.33 170.65 0.32 Allowed 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.308 0.643 . . . . 10.0 112.102 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 290' ' ' GLY . . . . . . . . . . . . . . . -88.55 -14.86 60.93 Favored Glycine 0 N--CA 1.451 -0.333 0 CA-C-N 115.581 -0.736 . . . . 10.0 113.241 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 291' ' ' ILE . . . . . . . . . . . . . 13.1 tt -83.45 136.57 22.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 O-C-N 122.51 -0.406 . . . . 10.0 110.779 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 292' ' ' MET . . . . . . . . . . . . . 43.0 ttm 64.5 106.43 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 O-C-N 123.71 0.631 . . . . 10.0 111.962 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 293' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -87.98 -21.03 25.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.021 0.439 . . . . 10.0 110.585 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 294' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -89.8 -179.85 5.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.765 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 295' ' ' GLY . . . . . . . . . . . . . . . -104.77 68.57 0.26 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 121.046 -0.597 . . . . 10.0 111.991 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -95.61 157.14 16.03 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.922 0.391 . . . . 10.0 110.746 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 297' ' ' SER . . . . . . . . . . . . . 48.5 m -90.36 124.54 35.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.52 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 18.8 tp -75.58 -13.26 60.34 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -178.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 299' ' ' TYR . . . . . 0.413 ' HA ' ' SD ' ' A' ' 307' ' ' MET . 46.2 p90 -93.01 5.83 50.08 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.596 -0.442 . . . . 10.0 111.382 -179.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 300' ' ' SER . . . . . . . . . . . . . 49.0 m -75.74 155.64 85.02 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.392 -0.367 . . . . 10.0 110.241 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 301' ' ' PRO . . . . . 0.403 ' HB3' ' HB3' ' A' ' 806' ' ' GLU . 15.7 Cg_endo -55.4 -30.01 71.1 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 123.221 2.614 . . . . 10.0 113.39 -179.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 302' ' ' ALA . . . . . . . . . . . . . . . -81.71 -6.96 59.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.019 0.438 . . . . 10.0 111.381 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 303' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -118.72 7.11 11.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.905 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 304' ' ' ILE . . . . . . . . . . . . . 10.6 tp -60.81 -25.08 34.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.948 -0.569 . . . . 10.0 111.334 -179.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -63.49 -50.2 70.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.149 0.5 . . . . 10.0 109.928 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 306' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.16 -41.76 73.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.608 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 307' ' ' MET . . . . . 0.413 ' SD ' ' HA ' ' A' ' 299' ' ' TYR . 27.1 ttt -57.36 -43.72 83.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.983 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 308' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -66.32 -33.81 76.57 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.327 -0.233 . . . . 10.0 110.857 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 309' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -74.84 -39.95 61.32 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.177 -0.209 . . . . 10.0 111.348 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 310' ' ' VAL . . . . . . . . . . . . . 23.8 m -70.59 -35.28 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 C-N-CA 120.679 -0.408 . . . . 10.0 110.599 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 311' ' ' THR . . . . . . . . . . . . . 60.4 m -65.56 -35.59 81.28 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.384 0.611 . . . . 10.0 109.758 178.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 312' ' ' ALA . . . . . . . . . . . . . . . -67.08 -32.87 74.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.572 -0.74 . . . . 10.0 109.855 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 313' ' ' ALA . . . . . 0.455 ' HA ' ' CB ' ' A' ' 356' ' ' ALA . . . -73.29 -33.75 65.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.488 -0.778 . . . . 10.0 110.554 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 314' ' ' LEU . . . . . . . . . . . . . 1.8 mp -70.27 -46.63 63.97 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.773 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 315' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 319' ' ' LEU . 30.5 ptt180 -64.38 -26.29 68.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.851 0.358 . . . . 10.0 110.706 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 316' ' ' ALA . . . . . . . . . . . . . . . -77.48 2.33 16.54 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.235 0.54 . . . . 10.0 110.814 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 317' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -115.56 2.6 13.84 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.883 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 318' ' ' ALA . . . . . . . . . . . . . . . -140.39 -51.93 0.49 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.335 -0.393 . . . . 10.0 111.073 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 319' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 315' ' ' ARG . 3.6 mm? -67.56 -43.06 81.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.034 0.445 . . . . 10.0 110.489 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 320' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -98.7 97.59 8.82 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.076 179.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 321' ' ' THR . . . . . 0.447 ' HB ' ' CG1' ' A' ' 324' ' ' VAL . 3.0 m -88.48 135.73 33.34 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.076 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 322' ' ' ARG . . . . . 0.464 ' O ' ' HB2' ' A' ' 323' ' ' ASP . 0.2 OUTLIER -60.49 145.93 46.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.529 -0.305 . . . . 10.0 110.715 -179.622 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 323' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 322' ' ' ARG . 0.2 OUTLIER 81.42 -50.07 0.26 Allowed 'General case' 0 N--CA 1.468 0.446 0 O-C-N 124.306 1.003 . . . . 10.0 112.83 178.393 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 324' ' ' VAL . . . . . 0.447 ' CG1' ' HB ' ' A' ' 321' ' ' THR . 13.6 p -86.28 -35.19 8.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 112.671 0.619 . . . . 10.0 112.671 -178.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -97.64 -35.17 10.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.103 0.478 . . . . 10.0 110.957 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 326' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -151.28 146.31 25.95 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.364 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 327' ' ' ILE . . . . . . . . . . . . . 9.9 tp -122.98 132.14 71.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.195 -0.668 . . . . 10.0 109.195 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 328' ' ' VAL . . . . . 0.451 HG12 HG22 ' A' ' 333' ' ' VAL . 2.7 m -102.59 130.89 51.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.165 0.507 . . . . 10.0 111.053 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 329' ' ' LYS . . . . . 0.559 ' O ' ' HD3' ' A' ' 329' ' ' LYS . 0.0 OUTLIER -145.61 127.61 15.53 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.122 179.48 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 330' ' ' ASP . . . . . . . . . . . . . 3.7 p30 49.16 30.14 2.88 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.964 0.906 . . . . 10.0 112.941 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 331' ' ' GLY . . . . . 0.441 ' HA2' HG12 ' A' ' 363' ' ' VAL . . . 91.37 -2.42 78.06 Favored Glycine 0 C--N 1.328 0.138 0 C-N-CA 120.74 -0.743 . . . . 10.0 113.195 178.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 332' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -100.32 136.86 39.56 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 120.811 0.339 . . . . 10.0 110.306 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 333' ' ' VAL . . . . . 0.451 HG22 HG12 ' A' ' 328' ' ' VAL . 27.1 t -104.06 115.31 45.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.573 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 334' ' ' ILE . . . . . . . . . . . . . 59.3 mt -107.13 130.59 58.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.39 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 335' ' ' ILE . . . . . . . . . . . . . 4.3 mp -77.52 126.74 38.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 109.846 -0.427 . . . . 10.0 109.846 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 336' ' ' VAL . . . . . . . . . . . . . 46.8 t -101.99 122.03 53.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.243 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 337' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.53 119.82 23.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.91 -0.587 . . . . 10.0 109.727 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 338' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -83.2 -12.61 56.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.989 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 339' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -76.94 -51.98 10.22 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.07 -0.252 . . . . 10.0 111.638 -178.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 340' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.49 -10.41 11.94 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.211 0.448 . . . . 10.0 112.211 -179.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 341' ' ' GLY . . . . . . . . . . . . . . . 84.98 30.51 25.76 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.809 -0.71 . . . . 10.0 111.852 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 342' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -87.33 161.72 17.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.91 0.386 . . . . 10.0 110.81 -179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 343' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.31 115.71 27.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.278 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 344' ' ' MET . . . . . . . . . . . . . 59.4 mtt -113.14 101.15 9.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.869 0.366 . . . . 10.0 110.684 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 345' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -95.65 -26.05 15.89 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.982 0.42 . . . . 10.0 110.968 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 346' ' ' GLY . . . . . . . . . . . . . . . -96.8 48.53 1.63 Allowed Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.767 -0.73 . . . . 10.0 112.894 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 347' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -135.99 106.4 6.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.016 0.436 . . . . 10.0 110.441 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 348' ' ' ARG . . . . . 0.408 ' NH2' ' HB2' ' A' ' 366' ' ' GLN . 5.0 tpt180 -101.0 95.81 6.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.053 -0.521 . . . . 10.0 111.272 -179.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 349' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -73.48 144.13 46.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 10.0 109.948 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 350' ' ' SER . . . . . . . . . . . . . 6.1 m -91.53 -168.8 2.12 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 351' ' ' ASP . . . . . . . . . . . . . 29.7 t70 71.63 -57.66 0.6 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.418 1.087 . . . . 10.0 112.144 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 352' ' ' GLY . . . . . . . . . . . . . . . 145.01 58.34 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.433 -0.889 . . . . 10.0 112.614 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 353' ' ' LEU . . . . . . . . . . . . . 9.0 mp -97.3 -25.87 15.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.08 0.467 . . . . 10.0 110.872 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 354' ' ' HIS . . . . . 0.408 ' O ' ' HB ' ' A' ' 357' ' ' VAL . 29.9 p80 -129.41 -12.32 4.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.152 -0.476 . . . . 10.0 110.436 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 355' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -59.73 -34.39 72.88 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.639 -0.709 . . . . 10.0 110.71 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 356' ' ' ALA . . . . . 0.455 ' CB ' ' HA ' ' A' ' 313' ' ' ALA . . . -83.42 -23.37 32.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.878 -0.601 . . . . 10.0 109.67 178.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 357' ' ' VAL . . . . . 0.432 ' O ' ' HG2' ' A' ' 360' ' ' LYS . 40.9 t -66.68 -43.89 89.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.458 -0.792 . . . . 10.0 109.479 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 358' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -64.38 -18.18 64.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.232 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 359' ' ' ALA . . . . . 0.449 ' HB2' ' HB3' ' A' ' 236' ' ' TYR . . . -91.87 -35.58 13.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.818 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 360' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 357' ' ' VAL . 12.5 ptmm? -74.89 -36.94 62.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.716 0.294 . . . . 10.0 110.537 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 361' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -84.31 163.64 19.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.215 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 362' ' ' GLY . . . . . . . . . . . . . . . -84.01 50.71 4.45 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.108 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 363' ' ' VAL . . . . . 0.441 HG12 ' HA2' ' A' ' 331' ' ' GLY . 18.9 m -115.34 177.32 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.479 0.181 . . . . 10.0 110.567 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 364' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.56 109.07 21.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.814 0.34 . . . . 10.0 110.685 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 365' ' ' ILE . . . . . 0.447 ' H ' HG13 ' A' ' 365' ' ' ILE . 12.4 mt -61.92 127.97 22.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.974 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 366' ' ' GLN . . . . . 0.408 ' HB2' ' NH2' ' A' ' 348' ' ' ARG . 36.6 mm-40 -70.44 166.93 19.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.497 -0.319 . . . . 10.0 110.787 -179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 367' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -72.5 -18.96 61.62 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.973 0.416 . . . . 10.0 110.619 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 368' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 70.13 -178.13 0.22 Allowed 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.397 -0.819 . . . . 10.0 112.315 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.413 HD21 ' CB ' ' A' ' 226' ' ' SER . 2.7 t-20 -154.31 99.11 2.18 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.118 -0.946 . . . . 10.0 109.32 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 370' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -110.55 -101.97 0.39 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.842 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 371' ' ' THR . . . . . . . . . . . . . 89.2 m -163.46 137.36 5.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.535 0.207 . . . . 10.0 111.286 -178.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 372' ' ' LEU . . . . . . . . . . . . . 21.6 mt -96.65 -62.24 1.3 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 373' ' ' ALA . . . . . . . . . . . . . . . -138.51 154.14 48.78 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.469 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 374' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 223' ' ' LEU . 58.1 m -156.01 146.13 21.47 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.009 0.433 . . . . 10.0 111.478 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 375' ' ' ILE . . . . . 0.462 HG22 HD11 ' A' ' 187' ' ' LEU . 16.5 tt -145.96 141.0 21.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.608 -0.724 . . . . 10.0 109.752 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 376' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.63 145.43 25.68 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.318 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 377' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -56.8 -41.14 77.22 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.774 0.321 . . . . 10.0 110.314 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 378' ' ' GLN . . . . . 0.518 ' HA ' ' CE2' ' A' ' 405' ' ' TYR . 1.4 tm0? -55.96 -41.9 75.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.902 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 379' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -78.06 -30.66 49.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.167 -0.469 . . . . 10.0 111.054 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -68.1 -49.05 63.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.989 0.423 . . . . 10.0 110.304 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 381' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -72.78 -17.31 61.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.758 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 382' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.63 -25.27 63.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.348 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 73.9 mt -78.92 -12.87 60.05 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.806 -0.633 . . . . 10.0 111.753 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 384' ' ' TYR . . . . . 0.575 ' CD2' ' HB2' ' A' ' 206' ' ' ALA . 30.1 m-85 -80.81 138.75 36.25 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.799 0.333 . . . . 10.0 110.875 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 385' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -72.95 -73.48 0.2 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.186 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 386' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -91.41 90.55 7.73 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.486 -0.561 . . . . 10.0 109.486 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.47 HD23 HD21 ' A' ' 407' ' ' LEU . 66.2 tp -99.46 106.34 18.37 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.58 -0.737 . . . . 10.0 109.705 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 388' ' ' ALA . . . . . . . . . . . . . . . -122.74 161.44 23.92 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.801 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 389' ' ' GLY . . . . . . . . . . . . . . . -179.3 172.64 44.66 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.136 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 390' ' ' MET . . . . . . . . . . . . . 65.2 mtm -112.71 152.46 29.04 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.951 0.405 . . . . 10.0 110.576 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 391' ' ' THR . . . . . . . . . . . . . 9.6 t -122.04 -176.69 3.4 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.076 -0.713 . . . . 10.0 109.076 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 392' ' ' GLY . . . . . . . . . . . . . . . -106.43 165.18 13.53 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.623 -0.799 . . . . 10.0 111.584 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 393' ' ' THR . . . . . . . . . . . . . 4.7 m -71.08 74.52 0.66 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.399 0.618 . . . . 10.0 109.99 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 394' ' ' ALA . . . . . 0.468 ' HB1' ' HA ' ' A' ' 566' ' ' ARG . . . -131.39 -48.72 0.99 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.992 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 395' ' ' ASP . . . . . 0.461 ' CG ' ' H ' ' A' ' 396' ' ' THR . 21.0 t70 66.38 -140.54 0.16 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 -178.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 396' ' ' THR . . . . . 0.461 ' H ' ' CG ' ' A' ' 395' ' ' ASP . 4.8 m 70.0 -77.72 0.05 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 122.777 0.431 . . . . 10.0 111.652 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 397' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -81.72 15.15 2.28 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.2 0.524 . . . . 10.0 111.191 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 398' ' ' ALA . . . . . 0.448 ' HA ' ' CD2' ' A' ' 401' ' ' PHE . . . -66.99 -23.43 65.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.714 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 399' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -75.74 -10.92 59.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.906 0.384 . . . . 10.0 111.091 -179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 400' ' ' GLU . . . . . 0.445 ' HG2' ' CD1' ' A' ' 639' ' ' PHE . 43.0 mt-10 -89.27 -14.27 36.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.506 -0.316 . . . . 10.0 111.085 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 401' ' ' PHE . . . . . 0.448 ' CD2' ' HA ' ' A' ' 398' ' ' ALA . 18.7 m-85 -60.9 -51.7 68.17 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.961 0.41 . . . . 10.0 110.553 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 402' ' ' SER . . . . . 0.411 ' O ' ' HA ' ' A' ' 406' ' ' LYS . 0.7 OUTLIER -75.62 -21.0 58.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.955 -0.566 . . . . 10.0 111.418 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 29.1 m -81.84 -47.17 13.16 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.5 mt -88.68 -60.2 2.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 112.709 0.633 . . . . 10.0 112.709 -177.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 405' ' ' TYR . . . . . 0.518 ' CE2' ' HA ' ' A' ' 378' ' ' GLN . 68.8 m-85 -90.98 -4.78 56.18 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.635 0.606 . . . . 10.0 112.635 -177.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 406' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 402' ' ' SER . 67.4 mmtt 59.82 53.6 4.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.072 0.463 . . . . 10.0 110.205 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 407' ' ' LEU . . . . . 0.565 HD13 HD11 ' A' ' 99' ' ' ILE . 34.9 mt -111.47 144.17 41.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.086 -0.507 . . . . 10.0 111.257 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . 0.571 ' HB3' ' SG ' ' A' ' 98' ' ' CYS . 36.8 t0 -78.87 167.95 20.42 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.884 -0.784 . . . . 10.0 108.884 178.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 409' ' ' THR . . . . . . . . . . . . . 19.6 m -138.72 121.82 16.84 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 121.963 -0.46 . . . . 10.0 112.123 -178.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 410' ' ' VAL . . . . . . . . . . . . . 85.7 t -132.39 131.31 60.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.934 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.2 t -94.11 119.62 42.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.222 -0.288 . . . . 10.0 110.222 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 412' ' ' VAL . . . . . . . . . . . . . 41.1 t -93.56 132.66 29.61 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 116.405 -0.362 . . . . 10.0 110.587 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -67.96 159.25 53.78 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.763 2.309 . . . . 10.0 112.548 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 15.2 p -82.84 166.5 18.92 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.914 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 415' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -63.11 -37.23 86.39 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.421 0.629 . . . . 10.0 109.685 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 416' ' ' ARG . . . . . 0.404 ' HB2' ' HA3' ' A' ' 579' ' ' GLY . 26.4 mtm180 -136.86 147.88 60.93 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.913 178.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.52 135.6 50.27 Favored 'Trans proline' 0 CA--C 1.528 0.208 0 C-N-CA 122.297 1.998 . . . . 10.0 111.942 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 418' ' ' MET . . . . . . . . . . . . . 56.8 mtm -71.86 138.65 48.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.869 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 419' ' ' ILE . . . . . . . . . . . . . 1.3 mt -104.17 10.74 8.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.61 0.719 . . . . 10.0 109.431 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 420' ' ' ARG . . . . . . . . . . . . . 15.7 ttp-105 -66.62 124.99 24.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.095 -0.957 . . . . 10.0 110.928 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.543 ' O ' ' HA ' ' A' ' 583' ' ' SER . 89.4 mttt -105.89 136.25 45.87 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.409 -0.589 . . . . 10.0 109.409 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 422' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -104.82 148.98 26.05 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.864 0.364 . . . . 10.0 111.014 -179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 424' ' ' PRO . 72.5 mt -125.25 148.04 59.44 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.804 -0.635 . . . . 10.0 109.941 179.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 424' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 423' ' ' LEU . 39.4 Cg_exo -61.47 164.31 15.75 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.914 2.409 . . . . 10.0 113.986 -178.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 425' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -84.24 116.96 23.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.018 -0.992 . . . . 10.0 109.608 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 426' ' ' LEU . . . . . . . . . . . . . 59.0 mt -96.22 102.72 14.55 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.3 0.571 . . . . 10.0 110.256 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 427' ' ' VAL . . . . . 0.483 HG22 ' HB2' ' A' ' 588' ' ' LEU . 42.9 t -93.19 129.44 43.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.199 -0.909 . . . . 10.0 110.772 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 428' ' ' TYR . . . . . 0.469 ' CE1' ' HA ' ' A' ' 614' ' ' PRO . 79.3 m-85 -112.39 -178.6 3.45 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.078 179.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 429' ' ' MET . . . . . 0.572 ' HB2' ' OE2' ' A' ' 433' ' ' GLU . 20.1 mmt -74.21 -76.7 0.13 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.879 0.371 . . . . 10.0 111.112 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 430' ' ' THR . . . . . . . . . . . . . 59.4 p -89.72 160.45 16.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.162 -0.472 . . . . 10.0 111.052 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 431' ' ' GLU . . . . . 0.451 ' OE1' ' HD3' ' A' ' 434' ' ' LYS . 9.5 tp10 -60.85 -27.26 67.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.717 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 432' ' ' ALA . . . . . . . . . . . . . . . -59.47 -48.47 81.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.895 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 433' ' ' GLU . . . . . 0.572 ' OE2' ' HB2' ' A' ' 429' ' ' MET . 14.3 mt-10 -62.68 -39.17 93.12 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 121.079 0.466 . . . . 10.0 110.29 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 434' ' ' LYS . . . . . 0.513 ' O ' HG13 ' A' ' 438' ' ' ILE . 63.9 tttt -60.67 -51.45 69.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.311 -0.859 . . . . 10.0 110.798 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 435' ' ' ILE . . . . . 0.497 ' O ' HG12 ' A' ' 439' ' ' ILE . 49.4 mm -66.4 -42.79 91.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.982 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 436' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -60.3 -37.39 80.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.78 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 437' ' ' ALA . . . . . . . . . . . . . . . -65.99 -37.4 85.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.444 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 438' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 434' ' ' LYS . 76.8 mt -62.95 -42.95 98.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.922 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 439' ' ' ILE . . . . . 0.497 HG12 ' O ' ' A' ' 435' ' ' ILE . 41.6 mm -56.89 -42.36 78.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.674 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 440' ' ' GLU . . . . . . . . . . . . . 26.2 tp10 -64.54 -47.28 79.39 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.165 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 441' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -59.89 -39.09 84.16 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.079 0.466 . . . . 10.0 110.411 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.504 HG12 HG11 ' A' ' 452' ' ' VAL . 78.7 mt -71.38 -45.74 67.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.547 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 5.2 ttpt -50.03 -49.68 50.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.836 -0.62 . . . . 10.0 111.468 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 444' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -58.93 -44.04 91.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.966 -0.561 . . . . 10.0 111.672 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.44 ' HB3' ' HB3' ' A' ' 450' ' ' GLN . 38.3 mtt-85 -75.17 -22.0 58.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.105 -0.498 . . . . 10.0 112.316 -178.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' THR . . . . . . . . . . . . . 29.7 m -68.34 -36.62 79.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.128 0.49 . . . . 10.0 110.163 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.9 -25.55 30.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.999 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' LYS . . . . . . . . . . . . . 34.8 mttp -79.14 -31.36 44.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.209 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . 101.57 35.64 4.03 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.429 -0.891 . . . . 10.0 112.698 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' GLN . . . . . 0.646 ' HB2' ' HB1' ' A' ' 551' ' ' ALA . 59.7 tt0 -112.8 125.6 29.63 Favored Pre-proline 0 C--N 1.323 -0.561 0 O-C-N 122.673 -0.31 . . . . 10.0 110.825 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -65.36 136.88 48.93 Favored 'Trans proline' 0 C--O 1.237 0.447 0 C-N-CA 122.497 2.131 . . . . 10.0 111.153 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.504 HG11 HG12 ' A' ' 442' ' ' ILE . 60.9 t -123.04 122.96 66.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.301 -0.409 . . . . 10.0 111.505 -178.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' LEU . . . . . . . . . . . . . 45.7 tp -109.7 112.22 24.15 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.415 -0.587 . . . . 10.0 109.415 178.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 41.5 t -96.06 121.31 46.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.13 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -103.93 105.01 2.55 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.713 -0.756 . . . . 10.0 112.175 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' THR . . . . . . . . . . . . . 17.2 p -103.02 139.51 38.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.754 0.312 . . . . 10.0 110.529 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' ILE . . . . . 0.444 HG12 ' HB2' ' A' ' 560' ' ' GLU . 7.5 pt -100.88 3.89 10.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.378 0.609 . . . . 10.0 110.051 179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' SER . . . . . . . . . . . . . 3.5 p -133.82 128.8 35.48 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.978 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' ILE . . . . . . . . . . . . . 28.8 mt -62.12 -36.7 75.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.025 0.44 . . . . 10.0 110.587 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.417 ' H ' ' CD ' ' A' ' 460' ' ' GLU . 1.6 mp0 -57.95 -41.59 83.17 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.582 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -36.74 77.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.932 -0.576 . . . . 10.0 110.844 -179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' SER . . . . . . . . . . . . . 3.8 m -58.98 -46.07 89.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.951 0.405 . . . . 10.0 110.402 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -71.86 -32.32 67.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.66 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 61.4 tp -68.43 -54.88 14.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.616 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 7.9 p -63.48 -30.16 49.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.904 0.383 . . . . 10.0 110.336 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' SER . . . . . . . . . . . . . 10.5 t -64.5 -43.91 92.6 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -65.45 -42.43 92.37 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.33 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -63.28 -43.51 97.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.619 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' LEU . . . . . . . . . . . . . 47.0 mt -62.88 -42.03 99.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.246 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 35.3 m -64.41 -34.89 79.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.045 0.45 . . . . 10.0 110.017 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -63.29 -39.8 95.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.049 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -81.09 -4.88 56.75 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.295 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' GLY . . . . . . . . . . . . . . . 75.88 26.78 63.92 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.025 -0.607 . . . . 10.0 112.378 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' ILE . . . . . . . . . . . . . 71.3 mt -94.35 116.13 34.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.916 0.388 . . . . 10.0 110.803 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -64.2 131.67 48.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.202 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -155.93 157.89 37.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.992 -178.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -121.41 134.54 55.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.933 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' VAL . . . . . . . . . . . . . 11.0 t -110.6 132.63 58.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.681 0.277 . . . . 10.0 110.809 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.09 164.66 22.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.529 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -157.1 117.9 3.61 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.144 -0.48 . . . . 10.0 109.834 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' ALA . . . . . . . . . . . . . . . -59.57 -21.31 60.13 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.911 -0.586 . . . . 10.0 112.27 -179.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -76.38 -19.78 57.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.684 0.278 . . . . 10.0 111.113 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -127.18 64.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.473 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -59.59 -30.4 68.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 10.0 111.232 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.55 -28.89 69.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.583 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -84.56 -33.9 23.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.02 0.438 . . . . 10.0 109.898 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 84.0 mt-10 -58.37 -36.91 74.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.723 -0.672 . . . . 10.0 110.966 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' ALA . . . . . . . . . . . . . . . -53.62 -35.6 61.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.744 -0.662 . . . . 10.0 111.974 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' ALA . . . . . . . . . . . . . . . -83.01 -35.16 26.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.917 0.389 . . . . 10.0 110.675 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' ILE . . . . . . . . . . . . . 75.8 mt -66.86 -54.0 29.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.297 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 49.4 t -61.54 -30.67 48.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.93 -0.577 . . . . 10.0 111.16 -179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' ALA . . . . . . . . . . . . . . . -60.69 -29.96 69.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.607 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' GLN . . . . . . . . . . . . . 71.4 mm-40 -114.27 21.38 14.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.773 0.321 . . . . 10.0 110.942 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -70.68 -17.63 62.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.028 0.442 . . . . 10.0 111.069 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' GLY . . . . . . . . . . . . . . . -101.27 15.27 57.82 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.88 -0.676 . . . . 10.0 112.046 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -79.33 142.09 58.18 Favored Pre-proline 0 C--N 1.324 -0.542 0 N-CA-C 110.075 -0.342 . . . . 10.0 110.075 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.93 123.3 12.14 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.539 2.16 . . . . 10.0 112.789 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . 71.5 16.68 5.88 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.615 -0.721 . . . . 10.0 112.751 178.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -89.74 110.23 21.15 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.984 0.421 . . . . 10.0 110.605 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' VAL . . . . . . . . . . . . . 20.4 t -92.74 114.44 29.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.983 179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 2.0 m -115.95 134.3 55.12 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.176 -0.465 . . . . 10.0 111.02 -179.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' ILE . . . . . . . . . . . . . 62.7 mt -110.61 120.75 62.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 120.85 0.357 . . . . 10.0 110.069 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -111.29 124.25 51.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.605 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' THR . . . . . . . . . . . . . 14.5 m -103.56 119.65 39.31 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.54 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' ASN . . . . . . . . . . . . . 14.1 m120 54.98 48.14 20.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.619 -0.718 . . . . 10.0 111.956 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 49.2 ttm -74.72 121.2 21.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.099 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' ALA . . . . . . . . . . . . . . . -69.66 -174.16 0.69 Allowed 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.608 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' GLY . . . . . . . . . . . . . . . -73.89 -178.13 37.2 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.065 -0.588 . . . . 10.0 112.587 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.425 ' NH2' ' HB2' ' A' ' 210' ' ' GLU . 52.6 mtt180 63.98 -95.52 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.83 0.452 . . . . 10.0 110.504 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' GLY . . . . . . . . . . . . . . . 81.21 167.04 37.4 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.929 -0.653 . . . . 10.0 113.096 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.59 167.81 21.2 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.618 0.247 . . . . 10.0 111.087 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -85.53 106.76 17.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.747 0.308 . . . . 10.0 110.339 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 65.9 mt -80.62 108.95 14.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.257 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' VAL . . . . . . . . . . . . . 19.6 t -88.12 127.78 40.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.638 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . . . . . . . . . 50.3 mt -71.6 132.3 44.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.162 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' GLY . . . . . . . . . . . . . . . 90.72 11.52 61.9 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.743 -0.741 . . . . 10.0 111.751 -179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' GLY . . . . . . . . . . . . . . . 94.68 179.45 37.7 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.891 -0.671 . . . . 10.0 111.774 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 2.6 p -117.45 96.0 5.21 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.805 0.336 . . . . 10.0 110.976 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' TRP . . . . . . . . . . . . . 18.0 p-90 -59.84 -25.81 65.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.795 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 12.5 mt-30 -66.72 -34.26 77.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.656 -0.702 . . . . 10.0 110.48 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -80.34 -31.15 38.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.262 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.14 -46.08 75.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.686 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' VAL . . . . . . . . . . . . . 34.0 m -69.02 -27.2 34.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 120.846 0.355 . . . . 10.0 110.754 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' ALA . . . . . . . . . . . . . . . -78.84 -9.11 59.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.982 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 525' ' ' ALA . . . . . . . . . . . . . . . -93.56 -7.54 43.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.144 0.497 . . . . 10.0 110.483 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 60.3 mt -99.01 134.65 41.54 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.799 -0.637 . . . . 10.0 109.936 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 527' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -65.63 -49.7 67.74 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.191 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 528' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -126.63 88.55 54.14 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.703 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 529' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -83.29 112.99 2.01 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.972 2.448 . . . . 10.0 111.591 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 530' ' ' THR . . . . . 0.547 ' H ' ' NE2' ' A' ' 533' ' ' GLN . 16.7 p -87.82 176.52 7.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.34 -0.391 . . . . 10.0 110.581 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -58.96 -44.93 91.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.947 0.403 . . . . 10.0 111.054 -179.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.485 ' OE1' ' HB ' ' A' ' 530' ' ' THR . 1.2 mp0 -63.61 -36.23 83.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.651 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . 0.547 ' NE2' ' H ' ' A' ' 530' ' ' THR . 31.9 mt-30 -65.97 -49.87 66.34 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.953 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . . . . . . . . . 74.2 mt -60.33 -45.32 96.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 10.0 110.605 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -64.54 -44.13 91.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.795 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -60.43 -50.02 75.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.691 -0.231 . . . . 10.0 110.811 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 85.0 mt -62.64 -45.07 99.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.607 -0.27 . . . . 10.0 110.67 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 5.5 ttmt -60.75 -45.16 95.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.887 0.375 . . . . 10.0 110.782 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -64.25 -43.18 95.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.259 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' ASP . . . . . 0.59 ' O ' ' HG3' ' A' ' 544' ' ' ARG . 0.1 OUTLIER -67.64 -40.43 84.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.389 -0.368 . . . . 10.0 110.057 179.617 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' TRP . . . . . . . . . . . . . 44.3 t90 -59.8 -42.15 92.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.739 -0.664 . . . . 10.0 110.142 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -53.37 -44.0 68.23 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.79 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' VAL . . . . . . . . . . . . . 59.6 t -65.47 -47.61 86.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.881 -0.599 . . . . 10.0 110.739 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 544' ' ' ARG . . . . . 0.59 ' HG3' ' O ' ' A' ' 540' ' ' ASP . 13.4 mtm180 -63.72 -33.27 75.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.346 0.593 . . . . 10.0 110.272 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 545' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -65.52 -50.59 64.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.186 -0.915 . . . . 10.0 111.063 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 546' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.79 -26.81 64.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.298 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 547' ' ' ALA . . . . . . . . . . . . . . . -62.2 -39.45 92.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.189 0.519 . . . . 10.0 109.88 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 548' ' ' VAL . . . . . . . . . . . . . 86.2 t -65.85 -37.34 79.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.994 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 98.5 mt -66.09 -32.74 74.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.748 -0.66 . . . . 10.0 110.202 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -69.97 -38.98 76.22 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.275 179.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 551' ' ' ALA . . . . . 0.646 ' HB1' ' HB2' ' A' ' 450' ' ' GLN . . . -69.0 -44.24 73.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.722 -0.672 . . . . 10.0 111.125 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 552' ' ' GLY . . . . . . . . . . . . . . . 145.26 18.56 0.17 Allowed Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.075 -1.06 . . . . 10.0 113.684 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 553' ' ' GLY . . . . . . . . . . . . . . . 77.54 -169.75 54.85 Favored Glycine 0 C--N 1.328 0.13 0 C-N-CA 120.668 -0.777 . . . . 10.0 112.352 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 63.8 tp -72.2 125.53 27.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.0 0.428 . . . . 10.0 110.409 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 555' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -94.31 123.62 37.83 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.786 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 40.8 mm -105.43 128.19 59.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.343 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 557' ' ' ILE . . . . . 0.408 ' HA ' ' O ' ' A' ' 585' ' ' ARG . 26.2 mt -120.77 123.2 69.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 120.989 0.423 . . . . 10.0 110.49 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . -105.53 122.08 7.05 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 111.321 -0.712 . . . . 10.0 111.321 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 559' ' ' THR . . . . . . . . . . . . . 18.3 p -82.51 -56.27 3.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.143 0.497 . . . . 10.0 111.113 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 560' ' ' GLU . . . . . 0.444 ' HB2' HG12 ' A' ' 457' ' ' ILE . 14.4 mp0 -110.73 141.46 44.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.033 -0.53 . . . . 10.0 110.617 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 561' ' ' ARG . . . . . 0.484 ' HG2' HD21 ' A' ' 588' ' ' LEU . 15.1 mmt180 -87.13 123.49 32.24 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.149 -0.685 . . . . 10.0 109.149 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 562' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -67.19 143.72 56.4 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.704 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -57.15 -66.12 0.51 Allowed 'General case' 0 N--CA 1.462 0.154 0 O-C-N 123.431 0.457 . . . . 10.0 109.99 179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.58 121.62 20.01 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 565' ' ' ARG . . . . . 0.442 ' HB2' ' HB3' ' A' ' 631' ' ' GLN . 16.9 tpt180 -60.5 -21.2 62.16 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 123.457 0.473 . . . . 10.0 111.659 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 566' ' ' ARG . . . . . 0.468 ' HA ' ' HB1' ' A' ' 394' ' ' ALA . 11.2 ttm180 -55.43 -61.4 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.962 0.41 . . . . 10.0 110.749 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 567' ' ' ILE . . . . . . . . . . . . . 30.0 mt -71.31 -24.51 24.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.032 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 568' ' ' ASP . . . . . 0.426 ' HB3' ' HA ' ' A' ' 565' ' ' ARG . 4.8 t70 -63.08 -49.34 74.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.485 0.659 . . . . 10.0 109.523 178.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 569' ' ' ASN . . . . . 0.439 ' HB3' ' HA ' ' A' ' 394' ' ' ALA . 50.2 t30 -67.58 -38.55 84.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.954 -1.021 . . . . 10.0 110.676 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 570' ' ' GLN . . . . . 0.452 ' HG3' ' HB2' ' A' ' 394' ' ' ALA . 94.3 mt-30 -67.12 -30.95 71.1 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.799 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.532 HD12 HH21 ' A' ' 574' ' ' ARG . 44.4 tp -66.82 -32.78 74.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.035 -0.53 . . . . 10.0 109.988 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 572' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -85.64 -33.77 21.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.485 -0.78 . . . . 10.0 110.995 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . -74.63 54.81 2.49 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 121.235 -0.507 . . . . 10.0 113.902 -179.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 574' ' ' ARG . . . . . 0.532 HH21 HD12 ' A' ' 571' ' ' LEU . 29.9 mmt180 -92.15 -51.46 5.17 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.496 -0.557 . . . . 10.0 109.496 178.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 575' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.46 -167.87 2.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.173 179.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 576' ' ' GLY . . . . . . . . . . . . . . . 73.92 39.11 47.58 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.475 -0.869 . . . . 10.0 112.238 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 577' ' ' ARG . . . . . 0.549 ' H ' ' HB3' ' A' ' 580' ' ' ASP . 51.3 mtt180 -97.58 122.45 40.65 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.757 -0.46 . . . . 10.0 109.757 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 578' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 58.73 41.17 22.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.015 0.436 . . . . 10.0 111.793 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 579' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 416' ' ' ARG . . . 82.16 32.33 29.14 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 121.039 -0.601 . . . . 10.0 113.096 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 580' ' ' ASP . . . . . 0.549 ' HB3' ' H ' ' A' ' 577' ' ' ARG . 6.1 t70 -81.11 163.65 22.98 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -89.47 -139.49 0.13 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.275 -0.421 . . . . 10.0 110.905 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 582' ' ' GLY . . . . . . . . . . . . . . . 120.65 167.41 13.36 Favored Glycine 0 N--CA 1.443 -0.851 0 C-N-CA 120.666 -0.778 . . . . 10.0 112.326 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 583' ' ' SER . . . . . 0.543 ' HA ' ' O ' ' A' ' 421' ' ' LYS . 1.3 p -149.19 122.27 8.86 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.442 0.163 . . . . 10.0 110.619 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 584' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -94.49 125.81 39.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.721 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 585' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 557' ' ' ILE . 4.3 tpm_? -132.99 124.83 28.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.539 -0.3 . . . . 10.0 110.192 179.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 586' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -116.43 140.01 49.82 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.9 0.381 . . . . 10.0 111.114 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 587' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -132.18 122.97 26.12 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.104 -0.702 . . . . 10.0 109.104 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 588' ' ' LEU . . . . . 0.484 HD21 ' HG2' ' A' ' 561' ' ' ARG . 5.3 mt -130.39 179.25 6.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.829 0.347 . . . . 10.0 111.286 -178.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 589' ' ' SER . . . . . . . . . . . . . 38.8 p -142.55 178.6 7.5 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.803 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 590' ' ' MET . . . . . . . . . . . . . 74.7 mmm -85.31 -4.32 59.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.09 0.471 . . . . 10.0 110.271 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 591' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -105.33 0.58 27.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.507 -0.769 . . . . 10.0 109.9 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 592' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.57 154.86 41.08 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.76 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 593' ' ' ALA . . . . . . . . . . . . . . . -69.59 -24.71 63.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.256 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.62 ' O ' HG12 ' A' ' 597' ' ' ILE . 10.1 tp -59.42 -34.23 72.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.295 -0.411 . . . . 10.0 111.342 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 14.8 mmt -64.38 -16.72 62.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.525 -0.307 . . . . 10.0 111.764 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 12.8 mmm180 -82.73 -10.66 58.79 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.62 HG12 ' O ' ' A' ' 594' ' ' LEU . 17.2 pt -82.15 -8.85 11.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.225 -0.59 . . . . 10.0 110.201 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 598' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -84.39 -13.9 50.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.26 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . 67.85 -68.36 0.16 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.419 -0.81 . . . . 10.0 111.954 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 600' ' ' SER . . . . . . . . . . . . . 28.1 m -71.52 115.78 11.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.35 -0.386 . . . . 10.0 111.233 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 601' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -68.45 -19.71 64.59 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.138 179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 602' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -38.4 79.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.188 179.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 603' ' ' VAL . . . . . . . . . . . . . 61.7 t -63.08 -51.84 66.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.011 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 604' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' A' ' 608' ' ' ARG . 1.2 m -63.08 -34.5 77.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.446 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 605' ' ' GLY . . . . . . . . . . . . . . . -63.21 -39.14 97.56 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.138 -0.553 . . . . 10.0 111.756 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 606' ' ' MET . . . . . . . . . . . . . 14.1 tpt -70.02 -29.04 66.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.134 0.492 . . . . 10.0 110.267 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 607' ' ' MET . . . . . . . . . . . . . 63.0 mtt -70.66 -21.47 62.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.146 -0.479 . . . . 10.0 110.784 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 608' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 604' ' ' SER . 48.9 mtt180 -73.1 -6.46 45.8 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.101 0.477 . . . . 10.0 110.409 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 609' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -79.97 -4.07 50.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.501 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 610' ' ' LEU . . . . . . . . . . . . . 31.3 tp -65.75 -39.31 90.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.976 -0.556 . . . . 10.0 111.109 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 611' ' ' GLY . . . . . . . . . . . . . . . 109.73 -40.77 2.43 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.916 -0.659 . . . . 10.0 111.458 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 612' ' ' MET . . . . . 0.463 ' CG ' ' HA ' ' A' ' 428' ' ' TYR . 1.7 mpt? 60.63 -106.47 0.26 Allowed 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.028 0.531 . . . . 10.0 111.677 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 613' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 69.94 109.88 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.326 0 O-C-N 123.666 0.603 . . . . 10.0 111.283 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 614' ' ' PRO . . . . . 0.469 ' HA ' ' CE1' ' A' ' 428' ' ' TYR . 37.8 Cg_endo -66.3 85.5 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.61 2.207 . . . . 10.0 112.491 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 615' ' ' GLY . . . . . . . . . . . . . . . 162.44 -44.2 0.36 Allowed Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.902 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 616' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.43 54.71 3.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.118 0.485 . . . . 10.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 617' ' ' ALA . . . . . . . . . . . . . . . -81.47 84.89 6.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.578 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 618' ' ' ILE . . . . . . . . . . . . . 14.9 tt -86.56 1.87 5.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.936 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 619' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 71.75 141.47 0.05 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.435 0.694 . . . . 10.0 111.462 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 620' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -147.36 92.89 4.76 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.122 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -61.49 -28.33 83.34 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 123.407 2.738 . . . . 10.0 114.115 -178.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 622' ' ' TRP . . . . . . . . . . . . . 37.8 p-90 -61.0 -25.3 66.79 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 111.852 0.316 . . . . 10.0 111.852 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.94 -50.12 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.725 0.298 . . . . 10.0 110.232 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 624' ' ' THR . . . . . . . . . . . . . 68.0 m -59.6 -38.5 81.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.859 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 625' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -63.84 -39.54 94.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.862 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 626' ' ' ALA . . . . . . . . . . . . . . . -69.57 -43.61 72.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.175 179.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 627' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.13 -44.02 99.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.781 -0.645 . . . . 10.0 110.585 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 628' ' ' ALA . . . . . . . . . . . . . . . -61.28 -40.4 94.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.596 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 629' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -66.21 -45.04 82.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.199 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 630' ' ' ALA . . . . . 0.456 ' O ' HG23 ' A' ' 634' ' ' VAL . . . -61.67 -46.64 88.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.993 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 631' ' ' GLN . . . . . 0.442 ' HB3' ' HB2' ' A' ' 565' ' ' ARG . 56.5 mt-30 -58.83 -43.15 90.63 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.961 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 632' ' ' ARG . . . . . . . . . . . . . 51.2 mtp85 -71.08 -33.85 70.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.396 -0.365 . . . . 10.0 110.279 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 633' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -63.29 -38.79 92.52 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.007 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 634' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 630' ' ' ALA . 69.6 t -58.63 -47.67 88.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.241 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -73.21 -23.5 60.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.704 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 636' ' ' SER . . . . . . . . . . . . . 50.0 m -67.66 -29.65 69.0 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.411 -0.959 . . . . 10.0 108.411 177.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 637' ' ' ARG . . . . . . . . . . . . . 8.9 ttm180 -78.12 -32.63 50.56 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.846 -1.07 . . . . 10.0 108.526 177.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 638' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -60.3 -49.92 75.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.128 -0.942 . . . . 10.0 109.802 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 639' ' ' PHE . . . . . 0.445 ' CD1' ' HG2' ' A' ' 400' ' ' GLU . 32.2 t80 -56.62 -38.22 71.79 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.56 179.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 640' ' ' ASP . . . . . 0.472 ' O ' ' HG2' ' A' ' 643' ' ' LYS . 32.4 t70 -59.34 -35.49 73.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.602 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 641' ' ' ILE . . . . . . . . . . . . . 24.9 mt -82.75 -38.97 15.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.119 179.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 642' ' ' ARG . . . . . 0.501 ' O ' ' HG ' ' A' ' 646' ' ' LEU . 5.5 mtm180 -61.03 -39.16 88.72 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.666 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 643' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 18.8 pttm -66.31 -25.32 66.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.016 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 644' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 640' ' ' ASP . 15.8 mm100 -66.95 -39.65 87.33 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.621 -0.511 . . . . 10.0 109.621 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 33.1 mt -66.94 -39.69 87.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.629 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 646' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 642' ' ' ARG . 46.9 mt -63.42 -35.55 80.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.733 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 647' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -63.62 -24.11 67.66 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.115 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 648' ' ' TYR . . . . . 0.423 ' CZ ' ' HG3' ' A' ' 800' ' ' LYS . 48.1 m-85 -97.28 -39.95 8.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.132 0.491 . . . . 10.0 110.979 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 649' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -75.21 -27.02 59.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.713 0.634 . . . . 10.0 112.713 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 650' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 646' ' ' LEU . 5.4 t0 -68.16 -21.56 64.89 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.216 0.531 . . . . 10.0 110.368 179.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 651' ' ' VAL . . . . . . . . . . . . . 17.8 t -68.23 -49.45 66.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 178.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -68.49 -25.51 65.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.301 -0.863 . . . . 10.0 110.054 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 653' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -61.5 -54.24 45.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 10.0 111.043 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 654' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -61.9 -42.98 99.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.912 -179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 655' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -64.89 -38.66 91.73 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.652 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 656' ' ' ARG . . . . . . . . . . . . . 14.0 ttp-105 -65.25 -45.88 82.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.788 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 657' ' ' ARG . . . . . . . . . . . . . 53.0 ttp180 -61.35 -40.28 93.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.487 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 658' ' ' ALA . . . . . . . . . . . . . . . -64.4 -54.18 36.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.764 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 659' ' ' ILE . . . . . . . . . . . . . 9.2 tp -67.09 -35.29 74.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 116.64 -0.255 . . . . 10.0 111.603 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 660' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -64.27 -41.71 96.78 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 110.356 -0.239 . . . . 10.0 110.356 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 15.0 t -61.9 -50.3 72.73 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.635 -0.506 . . . . 10.0 109.635 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 662' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -57.56 -45.95 84.53 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.779 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . . . . . . . . . 19.3 ttt-85 -62.19 -36.98 83.56 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.931 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 664' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -74.36 -37.12 63.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.754 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 665' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -61.01 -41.44 96.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.954 0.407 . . . . 10.0 110.65 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 666' ' ' LEU . . . . . . . . . . . . . 77.2 mt -83.15 -5.03 58.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.393 0.616 . . . . 10.0 110.499 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . . . . . . . . . 52.1 tp -91.26 -47.19 7.64 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.351 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -65.69 -41.26 92.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.502 -0.772 . . . . 10.0 112.046 -179.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 34.0 m -73.35 145.59 11.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.9 0.381 . . . . 10.0 111.302 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 670' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.66 -27.17 29.28 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.974 0.416 . . . . 10.0 110.055 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -81.48 -178.04 6.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.486 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 672' ' ' VAL . . . . . 0.465 ' O ' HG12 ' A' ' 676' ' ' ILE . 7.4 p -179.82 -24.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.392 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 673' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -37.29 63.59 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.412 -0.813 . . . . 10.0 111.329 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 674' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.96 -53.98 52.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.641 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 675' ' ' THR . . . . . 0.482 ' O ' HG12 ' A' ' 679' ' ' ILE . 0.2 OUTLIER -62.55 -41.92 99.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.837 -0.619 . . . . 10.0 110.564 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 676' ' ' ILE . . . . . 0.465 HG12 ' O ' ' A' ' 672' ' ' VAL . 29.5 mm -57.91 -51.44 70.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.663 -0.698 . . . . 10.0 111.56 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 49.7 m-20 -68.68 -32.2 71.85 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 678' ' ' SER . . . . . . . . . . . . . 49.8 m -65.8 -49.63 67.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.741 0.305 . . . . 10.0 110.548 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 679' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 675' ' ' THR . 42.8 pt -73.83 -21.49 18.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 120.826 -0.35 . . . . 10.0 111.084 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 680' ' ' ARG . . . . . . . . . . . . . 49.2 ttm-85 -59.58 -38.67 81.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.795 0.331 . . . . 10.0 110.536 179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 681' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.99 -34.85 79.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.82 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -80.39 -41.95 23.71 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.457 -178.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 64.7 t -59.63 -47.6 90.46 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-O 120.941 0.4 . . . . 10.0 110.76 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 684' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -64.71 -38.52 91.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.332 -0.394 . . . . 10.0 110.07 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 23.1 tttm -59.95 -51.48 69.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.504 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 686' ' ' ALA . . . . . . . . . . . . . . . -59.85 -36.86 77.74 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.083 -0.508 . . . . 10.0 111.232 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 25.8 m -68.81 -43.73 75.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.702 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 96.4 mt -66.74 -47.24 83.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.295 -0.412 . . . . 10.0 110.394 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 689' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -58.32 -24.46 59.72 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.915 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 690' ' ' ALA . . . . . . . . . . . . . . . -74.06 -18.28 60.85 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 691' ' ' TYR . . . . . 0.434 ' OH ' ' HD3' ' A' ' 709' ' ' ARG . 97.5 m-85 -122.53 -25.82 4.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.937 0.399 . . . . 10.0 111.071 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 692' ' ' ILE . . . . . . . . . . . . . 51.4 mt -126.06 102.46 27.74 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.866 -0.607 . . . . 10.0 109.701 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 693' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -60.99 132.49 42.3 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.499 2.132 . . . . 10.0 111.594 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 694' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -44.3 104.92 0.06 OUTLIER 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 123.654 2.903 . . . . 10.0 113.653 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 695' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 53.75 80.98 0.1 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.008 -0.996 . . . . 10.0 111.802 179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 696' ' ' SER . . . . . . . . . . . . . 8.8 p -137.27 -163.1 1.37 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.98 -0.554 . . . . 10.0 110.604 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 5.1 mt -78.05 128.79 34.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.278 179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . 0.588 ' HA ' ' CD2' ' A' ' 701' ' ' TRP . 11.4 pm0 -55.57 -28.14 53.29 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.466 0.543 . . . . 10.0 112.466 -179.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 699' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -71.41 -22.52 61.85 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.074 0.464 . . . . 10.0 110.59 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 700' ' ' MET . . . . . . . . . . . . . 22.9 ttt -92.87 11.24 27.86 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.181 0.515 . . . . 10.0 110.797 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 701' ' ' TRP . . . . . 0.588 ' CD2' ' HA ' ' A' ' 698' ' ' GLU . 53.8 m0 -97.77 126.18 42.99 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.325 -0.398 . . . . 10.0 111.227 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 702' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -85.38 79.44 9.47 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 703' ' ' ILE . . . . . 0.524 ' HB ' ' HD3' ' A' ' 704' ' ' PRO . 33.3 mm -62.16 -50.39 80.34 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.318 -0.855 . . . . 10.0 111.461 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 704' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 703' ' ' ILE . 35.6 Cg_exo -58.24 -46.11 27.11 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.886 1.724 . . . . 10.0 112.189 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 705' ' ' GLY . . . . . . . . . . . . . . . -61.03 -44.64 97.94 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.007 -0.616 . . . . 10.0 112.583 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 40.0 tp -66.73 -42.63 85.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.511 0.196 . . . . 10.0 111.053 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 707' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -60.6 -50.9 71.65 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.473 -0.33 . . . . 10.0 110.651 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 708' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -62.92 -37.22 86.14 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.376 -0.374 . . . . 10.0 110.573 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . 0.434 ' HD3' ' OH ' ' A' ' 691' ' ' TYR . 7.1 tpt180 -61.48 -48.64 80.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.502 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 710' ' ' LEU . . . . . . . . . . . . . 89.4 mt -63.28 -35.59 80.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.292 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -70.49 -41.4 72.75 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.266 0.469 . . . . 10.0 112.266 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 712' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -85.31 -44.15 13.08 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 113.051 0.76 . . . . 10.0 113.051 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 713' ' ' ASP . . . . . 0.412 ' O ' ' HE3' ' A' ' 828' ' ' LYS . 1.2 m-20 -83.36 -34.59 25.58 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.444 0.905 . . . . 10.0 113.444 -176.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 714' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -115.97 -1.26 12.56 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.735 1.013 . . . . 10.0 113.735 -177.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 715' ' ' ASP . . . . . . . . . . . . . 33.0 t70 60.72 35.0 19.8 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.672 0.749 . . . . 10.0 109.952 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 13.8 tp -123.2 108.1 12.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.136 -179.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 717' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -90.92 103.69 16.37 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.109 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 80.6 mt -122.16 123.84 27.1 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.897 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 719' ' ' PRO . . . . . 0.454 ' HB2' ' HB2' ' A' ' 722' ' ' GLU . 87.8 Cg_endo -82.08 70.5 7.08 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.762 2.308 . . . . 10.0 111.233 178.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 720' ' ' ILE . . . . . . . . . . . . . 91.7 mt -56.42 -39.6 62.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.295 -0.866 . . . . 10.0 111.649 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -58.49 -47.95 82.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.606 179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 722' ' ' GLU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 719' ' ' PRO . 27.0 mm-40 -64.92 -34.59 78.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.428 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 723' ' ' TRP . . . . . . . . . . . . . 38.3 m0 -63.19 -49.95 72.22 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.972 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 724' ' ' LEU . . . . . . . . . . . . . 35.6 tp -75.74 -24.79 56.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.063 0.459 . . . . 10.0 110.736 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 725' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -69.17 -50.92 43.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.846 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 726' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -81.25 -34.54 32.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.13 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 727' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -119.44 90.29 42.21 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.643 -0.253 . . . . 10.0 110.617 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -70.39 -15.68 34.77 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.116 1.877 . . . . 10.0 111.63 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -72.49 -7.88 52.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.303 -0.862 . . . . 10.0 110.918 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 730' ' ' LEU . . . . . 0.45 HD22 ' HA ' ' A' ' 730' ' ' LEU . 0.3 OUTLIER -65.92 -35.56 80.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.301 179.587 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 731' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 51.92 -102.18 0.12 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.426 -0.807 . . . . 10.0 111.066 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 732' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -141.64 -53.07 0.44 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.017 0.437 . . . . 10.0 110.465 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -56.26 -48.7 76.04 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.637 -0.71 . . . . 10.0 111.385 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 2.4 m -66.25 -28.4 68.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.153 -0.476 . . . . 10.0 111.239 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 48.1 tp -66.46 -41.95 88.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.462 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 736' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 736' ' ' ARG . 55.9 mtt-85 -60.82 -39.65 89.78 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.815 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -60.75 -42.79 98.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.604 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 738' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 738' ' ' ARG . 7.6 mmm-85 -64.45 -43.41 94.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.561 -0.745 . . . . 10.0 111.388 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 739' ' ' ILE . . . . . . . . . . . . . 94.1 mt -62.7 -48.71 86.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.976 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 740' ' ' LEU . . . . . . . . . . . . . 34.3 tp -64.42 -46.23 84.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.054 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.71 88.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 10.0 111.433 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 742' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -66.06 -36.06 82.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.289 -0.414 . . . . 10.0 111.554 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 743' ' ' SER . . . . . . . . . . . . . 54.1 p -63.79 -37.72 88.41 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.814 0.34 . . . . 10.0 110.2 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 744' ' ' ILE . . . . . 0.409 ' O ' ' HG3' ' A' ' 748' ' ' GLN . 30.6 mt -72.58 -38.21 58.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.079 -0.51 . . . . 10.0 109.882 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -58.97 -49.66 77.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.131 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 60.3 t -66.57 -36.07 76.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.102 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 747' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -60.08 -48.2 82.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.414 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 748' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 744' ' ' ILE . 27.2 mt-30 -60.61 -40.82 93.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.806 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 749' ' ' ARG . . . . . 0.462 ' HD3' ' OE2' ' A' ' 836' ' ' GLU . 19.8 ttp-105 -63.05 -43.39 98.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.349 179.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 750' ' ' LYS . . . . . . . . . . . . . 86.8 mttt -70.09 -37.33 75.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.134 0.492 . . . . 10.0 109.988 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.9 -42.08 98.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.64 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 752' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -62.33 -19.95 63.85 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.235 0.458 . . . . 10.0 112.235 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 21.6 t -82.99 -43.58 18.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.131 0.491 . . . . 10.0 110.68 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 754' ' ' VAL . . . . . . . . . . . . . 17.4 t -81.84 -37.49 15.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.244 -179.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 755' ' ' GLY . . . . . . . . . . . . . . . 119.81 134.25 4.75 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 110.706 -0.957 . . . . 10.0 110.706 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 756' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 760' ' ' ARG . . . -54.03 -59.58 4.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.727 0.299 . . . . 10.0 111.789 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 757' ' ' GLU . . . . . . . . . . . . . 26.3 mp0 -63.51 -36.13 82.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.085 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 758' ' ' MET . . . . . . . . . . . . . 16.1 tpt -65.15 -41.46 94.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.688 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 759' ' ' MET . . . . . . . . . . . . . 47.3 mmm -62.18 -40.22 95.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.727 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.499 ' HG2' ' O ' ' A' ' 756' ' ' ALA . 16.2 mmp_? -59.58 -39.62 84.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.367 0.604 . . . . 10.0 110.027 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 761' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -70.59 -36.93 73.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.677 -0.692 . . . . 10.0 109.735 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 762' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -66.5 -47.56 72.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.294 -0.866 . . . . 10.0 110.245 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -58.15 -45.33 87.61 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.39 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 764' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -60.9 -45.54 94.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.385 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 765' ' ' GLY . . . . . . . . . . . . . . . -62.34 -47.25 90.92 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 121.086 -0.578 . . . . 10.0 112.454 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 766' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.28 -44.41 95.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.703 0.287 . . . . 10.0 110.556 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 767' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -56.83 -50.4 72.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.119 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 768' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.28 -45.94 91.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.579 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 769' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.98 -44.25 96.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.591 -0.277 . . . . 10.0 110.979 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 770' ' ' THR . . . . . . . . . . . . . 11.1 m -62.64 -38.91 92.1 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.478 -0.328 . . . . 10.0 110.557 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 771' ' ' LEU . . . . . . . . . . . . . 17.8 mt -59.87 -52.1 66.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.519 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 772' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -61.86 -42.02 98.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.718 -0.674 . . . . 10.0 111.303 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 773' ' ' SER . . . . . 0.502 ' HB3' ' HB1' ' B' ' 19' ' ' ALA . 44.1 m -58.95 -54.21 49.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.561 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 6.1 mp -67.7 -27.66 67.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.669 -0.242 . . . . 10.0 111.366 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 775' ' ' TRP . . . . . . . . . . . . . 15.5 t-105 -62.53 -41.75 99.07 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.47 ' C ' ' HD2' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -61.12 -47.31 86.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.685 -0.688 . . . . 10.0 109.628 178.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 777' ' ' GLU . . . . . 0.408 ' CD ' ' HZ3' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -55.93 -42.62 76.4 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.205 179.537 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 778' ' ' HIS . . . . . 0.658 ' O ' ' HG2' ' A' ' 782' ' ' MET . 59.2 t60 -65.01 -46.46 81.27 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.445 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 779' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 779' ' ' LEU . 25.6 mt -59.57 -46.42 88.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.873 0.368 . . . . 10.0 111.01 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 780' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.54 90.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.766 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 781' ' ' ALA . . . . . . . . . . . . . . . -61.99 -34.38 76.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.952 -0.567 . . . . 10.0 111.623 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 782' ' ' MET . . . . . 0.658 ' HG2' ' O ' ' A' ' 778' ' ' HIS . 97.3 mmm -58.0 -50.95 71.63 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.176 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 783' ' ' ASP . . . . . 0.539 ' O ' ' HG2' ' A' ' 787' ' ' GLN . 8.1 t70 -73.24 -36.3 66.39 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-O 120.651 0.262 . . . . 10.0 110.417 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 784' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -56.98 -36.87 70.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.605 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 785' ' ' LEU . . . . . . . . . . . . . 57.3 tp -88.62 -30.93 18.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.499 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 786' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -56.76 -45.96 81.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.683 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 787' ' ' GLN . . . . . 0.539 ' HG2' ' O ' ' A' ' 783' ' ' ASP . 10.0 pt20 -75.31 -3.18 31.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.158 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 788' ' ' GLY . . . . . . . . . . . . . . . -98.02 -11.29 49.99 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.717 -0.553 . . . . 10.0 111.717 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 789' ' ' ILE . . . . . . . . . . . . . 50.5 mm -73.64 86.14 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.818 0.818 . . . . 10.0 109.717 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 790' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -172.63 -30.88 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.662 -1.154 . . . . 10.0 108.666 -179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 32.5 mt -108.21 -41.58 4.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.241 -0.89 . . . . 10.0 110.056 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 792' ' ' ARG . . . . . . . . . . . . . 22.1 ttm180 -73.77 128.01 34.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.345 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 793' ' ' GLY . . . . . . . . . . . . . . . 131.49 -175.59 19.55 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.965 -0.635 . . . . 10.0 112.022 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 794' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -152.18 -177.19 6.02 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.409 -0.219 . . . . 10.0 110.409 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 795' ' ' ALA . . . . . . . . . . . . . . . -74.44 157.15 36.11 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.875 0.369 . . . . 10.0 111.749 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 796' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 65.3 35.26 7.72 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.535 -0.757 . . . . 10.0 111.121 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 797' ' ' LYS . . . . . 0.406 ' HG2' ' OE2' ' A' ' 802' ' ' GLU . 4.8 tppp? -148.94 131.47 15.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.328 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 798' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -77.65 128.46 79.6 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.192 -0.458 . . . . 10.0 109.877 179.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 799' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.91 -38.69 86.9 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.892 2.395 . . . . 10.0 113.321 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 800' ' ' LYS . . . . . 0.475 ' HB2' ' NZ ' ' A' ' 800' ' ' LYS . 0.0 OUTLIER -67.97 -43.5 78.83 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 -179.755 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 801' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -64.21 -39.36 93.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.526 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . 0.406 ' OE2' ' HG2' ' A' ' 797' ' ' LYS . 2.9 tp10 -65.36 -46.53 79.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.929 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 803' ' ' TYR . . . . . 0.408 ' CD2' ' HD1' ' A' ' 648' ' ' TYR . 72.6 t80 -59.29 -38.92 81.42 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.125 179.389 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 804' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -59.24 -46.12 89.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.931 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 805' ' ' ARG . . . . . . . . . . . . . 34.8 mtm105 -58.9 -46.93 86.69 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.236 0.541 . . . . 10.0 110.077 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 806' ' ' GLU . . . . . 0.403 ' HB3' ' HB3' ' A' ' 301' ' ' PRO . 6.8 mm-40 -59.42 -43.86 92.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.441 -0.8 . . . . 10.0 110.563 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 807' ' ' SER . . . . . . . . . . . . . 14.3 m -67.36 -38.78 85.34 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.446 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 808' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -67.21 -41.04 86.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.732 0.301 . . . . 10.0 110.4 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 809' ' ' SER . . . . . . . . . . . . . 10.9 m -65.77 -39.35 90.92 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 810' ' ' MET . . . . . . . . . . . . . 22.9 ttm -63.73 -34.9 78.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.278 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 811' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -69.54 -45.72 68.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.543 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 812' ' ' ALA . . . . . . . . . . . . . . . -61.8 -50.55 71.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.972 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 813' ' ' ALA . . . . . . . . . . . . . . . -60.1 -32.38 70.93 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.074 0.464 . . . . 10.0 110.861 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 814' ' ' MET . . . . . . . . . . . . . 40.8 ttp -65.64 -49.22 69.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.029 179.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 815' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.26 -40.57 94.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 816' ' ' GLU . . . . . 0.435 ' HA ' ' HE2' ' A' ' 819' ' ' LYS . 34.6 mm-40 -61.11 -41.88 97.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.083 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 817' ' ' SER . . . . . . . . . . . . . 4.8 m -75.78 -28.34 58.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.569 179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 818' ' ' LEU . . . . . . . . . . . . . 31.0 tp -61.08 -60.38 3.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.857 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 819' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 816' ' ' GLU . 44.7 pttt -59.16 -32.97 70.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.692 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 820' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -62.82 -57.41 10.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.679 -0.692 . . . . 10.0 111.31 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 821' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -65.39 -34.11 77.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.456 -0.338 . . . . 10.0 111.911 -178.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 822' ' ' VAL . . . . . 0.417 ' O ' ' HG ' ' A' ' 826' ' ' LEU . 39.6 t -58.62 -53.27 49.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.712 0.291 . . . . 10.0 110.511 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 823' ' ' ILE . . . . . . . . . . . . . 33.9 mm -64.66 -39.76 86.73 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.535 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 824' ' ' SER . . . . . . . . . . . . . 36.2 m -62.37 -50.64 70.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.05 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 825' ' ' THR . . . . . . . . . . . . . 29.0 m -58.26 -41.77 85.0 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 111.961 0.356 . . . . 10.0 111.961 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 826' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 822' ' ' VAL . 98.9 mt -65.55 -23.98 67.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.936 0.398 . . . . 10.0 111.343 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 827' ' ' SER . . . . . . . . . . . . . 4.5 m -95.34 -21.19 18.55 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.365 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 828' ' ' LYS . . . . . 0.412 ' HE3' ' O ' ' A' ' 713' ' ' ASP . 88.0 mttt -74.49 -9.92 59.05 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.565 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 8.4 p -56.97 125.79 13.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-O 121.198 0.523 . . . . 10.0 110.439 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 830' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -104.7 115.71 30.79 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.193 -179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 831' ' ' VAL . . . . . . . . . . . . . 3.4 m -138.33 156.21 29.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.322 -0.854 . . . . 10.0 109.089 179.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 832' ' ' ARG . . . . . . . . . . . . . 8.9 ptt180 -62.78 140.08 58.73 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 123.224 0.327 . . . . 10.0 110.208 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 833' ' ' MET . . . . . . . . . . . . . 34.9 mmt -88.68 120.08 70.13 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.729 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.69 159.33 38.96 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.519 2.146 . . . . 10.0 111.858 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 835' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -82.9 113.69 20.68 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.179 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 836' ' ' GLU . . . . . 0.462 ' OE2' ' HD3' ' A' ' 749' ' ' ARG . 16.7 mt-10 . . . . . 0 C--O 1.247 0.933 0 CA-C-O 118.531 -0.747 . . . . 10.0 109.825 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 48.2 tpp -83.78 104.92 14.27 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.953 0.406 . . . . 10.0 109.983 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 15.2 mt -118.91 86.23 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.069 0.462 . . . . 10.0 110.172 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.86 93.71 4.69 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.59 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 70.0 mt -79.58 86.77 5.19 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.714 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 47.6 mtm180 -93.64 132.64 37.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.574 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 24.0 mtmt -124.48 151.37 44.68 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.907 -0.405 . . . . 10.0 109.907 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.493 ' HA ' ' HE ' ' B' ' 8' ' ' ARG . 4.3 mmp_? -133.09 -44.43 0.86 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.957 0.408 . . . . 10.0 110.262 179.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.32 104.25 12.49 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 178.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 17.7 pttm -103.15 160.22 14.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.126 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 80.8 mt -107.54 104.0 51.1 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.901 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.98 3.94 5.67 Favored 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.603 2.202 . . . . 10.0 112.219 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 57.2 mt -62.66 -29.5 70.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.307 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.67 -46.18 86.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.33 -0.396 . . . . 10.0 111.193 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 m -84.65 -18.12 9.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.92 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.77 -34.76 78.62 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.37 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.516 HG13 ' HB2' ' A' ' 232' ' ' SER . 42.2 t -65.8 -45.63 91.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.012 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.19 -48.09 83.16 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.421 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.502 ' HB1' ' HB3' ' A' ' 773' ' ' SER . . . -65.75 -32.33 73.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.713 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -65.62 -22.58 69.93 Favored Glycine 0 N--CA 1.452 -0.286 0 CA-C-N 115.676 -0.693 . . . . 10.0 112.549 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.4 ' CG1' ' HE3' ' A' ' 776' ' ' LYS . 99.1 t -57.07 -38.04 58.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.106 0.479 . . . . 10.0 110.962 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 9.6 tpt -86.69 -16.82 35.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.303 0.573 . . . . 10.0 110.728 -179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 71.1 m -87.5 77.89 8.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.676 -179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -76.68 68.56 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.075 -0.511 . . . . 10.0 111.054 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -83.83 72.15 10.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.459 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -95.77 -10.68 28.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.2 -0.454 . . . . 10.0 111.18 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -107.78 84.33 1.94 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.307 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.639 -0.696 . . . . 10.0 110.367 -179.869 . . . . . . . . 0 0 . 1 stop_ save_